| 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 | 45.8 | Very low | 37.5 | Very low | 211 Ų | 211 | 162.6 Ų | 162.6 | 100% | 1.039 | 80% | 0.797 | S | S | * | * | 0 | 126.3 | 0 | -67.1 | -74.3 | -179.2 | 0 | 0 | 106 | R3 | M1-R3 HydrophobicContact SD-CG 4.45Š| |||
| 2 | P | 44.6 | Very low | 36.9 | Very low | 125 Ų | 125 | 159.2 Ų | 159.2 | 81% | 0.812 | 80% | 0.801 | S | S | * | * | cis | -107.6 | 152.9 | 31.6 | 33.2 | -18.8 | 0 | 0 | 0 | 112.6 | ||||
| 3 | R | 38.4 | Very low | 36.6 | Very low | 204 Ų | 204 | 156.5 Ų | 156.5 | 77% | 0.77 | 80% | 0.804 | S | S | * | * | 69.4 | 104.1 | 52.2 | -75.1 | -124.4 | 177.7 | 125.5 | 0.2 | 114.9 | M1 | M1-R3 HydrophobicContact SD-CG 4.45Š| |||
| 4 | L | 39.1 | Very low | 36.4 | Very low | 148 Ų | 148 | 153.1 Ų | 153.1 | 78% | 0.775 | 81% | 0.811 | S | S | * | * | 165.6 | 129 | 104.4 | -107.8 | 112.5 | 0 | 0 | 0 | 113.7 | |||||
| 5 | H | 39.9 | Very low | 36.1 | Very low | 143 Ų | 143 | 155.1 Ų | 155.1 | 66% | 0.662 | 81% | 0.813 | S | S | * | * | trans | 61 | 122.5 | 138.1 | -80.5 | -95.2 | 0 | 0 | 0 | 125.5 | ||||
| 6 | D | 40.6 | Very low | 35.8 | Very low | 124 Ų | 124 | 151.6 Ų | 151.6 | 66% | 0.663 | 81% | 0.806 | S | S | * | * | 49.7 | 117.1 | 125.7 | -62.2 | -17.1 | 0 | 0 | 0 | 121.9 | |||||
| 7 | H | 40.8 | Very low | 35.7 | Very low | 195 Ų | 195 | 148.8 Ų | 148.8 | 90% | 0.903 | 81% | 0.809 | S | S | * | * | trans | -126.2 | 98.9 | 146.8 | -78.3 | -68.3 | 0 | 0 | 0 | 111.7 | ||||
| 8 | F | 34.3 | Very low | 35.6 | Very low | 180 Ų | 180 | 153.6 Ų | 153.6 | 79% | 0.789 | 81% | 0.813 | S | S | * | * | trans | -49.1 | 135.9 | 153.3 | -132.5 | -106.9 | 0 | 0 | 0 | 110.6 | ||||
| 9 | W | 30.3 | Very low | 35.5 | Very low | 259 Ų | 259 | 158.9 Ų | 158.9 | 98% | 0.981 | 82% | 0.821 | S | S | * | * | trans | -117.9 | 115.7 | 163.4 | -125.2 | 14.5 | 0 | 0 | 0 | 109.9 | ||||
| 10 | S | 28.9 | Very low | 35.5 | Very low | 84 Ų | 84 | 163.7 Ų | 163.7 | 59% | 0.587 | 83% | 0.828 | S | S | * | * | trans | -142 | 139.5 | 170.8 | -79.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 11 | C | 30.2 | Very low | 35.2 | Very low | 116 Ų | 116 | 159.5 Ų | 159.5 | 78% | 0.784 | 83% | 0.826 | S | S | * | * | trans | 72 | 127 | 155 | -62.9 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 12 | S | 30.5 | Very low | 35 | Very low | 121 Ų | 121 | 155.4 Ų | 155.4 | 85% | 0.846 | 82% | 0.815 | S | S | * | * | -173.4 | 150.7 | 89.6 | -85.1 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 13 | C | 33 | Very low | 34.9 | Very low | 125 Ų | 125 | 155.2 Ų | 155.2 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | trans | -66.7 | 159.3 | -179.1 | -53.1 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 14 | A | 33.4 | Very low | 34.9 | Very low | 109 Ų | 109 | 157.5 Ų | 157.5 | 90% | 0.901 | 82% | 0.822 | S | S | * | * | trans | -141.3 | 154 | 148.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 15 | H | 31.6 | Very low | 34.6 | Very low | 182 Ų | 182 | 155.5 Ų | 155.5 | 84% | 0.843 | 83% | 0.827 | S | S | * | * | trans | -107.5 | 137.7 | -139.5 | -145.5 | -120.9 | 0 | 0 | 0 | 112.7 | ||||
| 16 | S | 31.7 | Very low | 34.4 | Very low | 99 Ų | 99 | 153.4 Ų | 153.4 | 69% | 0.692 | 83% | 0.829 | S | S | * | * | trans | 58.8 | 118.9 | 132.2 | -148.4 | 0 | 0 | 0 | 0 | 122 | ||||
| 17 | A | 33.6 | Very low | 34.1 | Very low | 104 Ų | 104 | 153 Ų | 153 | 86% | 0.86 | 84% | 0.843 | S | S | * | * | trans | -149.1 | 124.9 | 139 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 18 | R | 34.6 | Very low | 33.9 | Very low | 235 Ų | 235 | 147.6 Ų | 147.6 | 89% | 0.887 | 83% | 0.831 | S | S | * | * | trans | -64.8 | 144.3 | -178.8 | -79.9 | 168.3 | 167.6 | -175.7 | -2.8 | 114.8 | ||||
| 19 | R | 33.8 | Very low | 33.9 | Very low | 255 Ų | 255 | 141.8 Ų | 141.8 | 96% | 0.962 | 82% | 0.822 | S | S | * | * | trans | -140.4 | 145.6 | 132.7 | -77.5 | -163.5 | -176.6 | -121.2 | 0.3 | 111.2 | ||||
| 20 | R | 34.3 | Very low | 34.1 | Very low | 255 Ų | 255 | 137.8 Ų | 137.8 | 96% | 0.962 | 82% | 0.819 | S | S | * | * | trans | -73.9 | 153.7 | -167.7 | -77.9 | 174.1 | 171.7 | -176.9 | -3.3 | 114.1 | ||||
| 21 | G | 29.2 | Very low | 34.5 | Very low | 75 Ų | 75 | 138.7 Ų | 138.7 | 77% | 0.773 | 83% | 0.832 | S | S | * | * | trans | -75.3 | -146.3 | -174.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 22 | P | 41.7 | Very low | 34.7 | Very low | 126 Ų | 126 | 137 Ų | 137 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | cis | -136.7 | -155.7 | 15.6 | 39.7 | -17.3 | 0 | 0 | 0 | 114.2 | ||||
| 23 | P | 42 | Very low | 34.9 | Very low | 121 Ų | 121 | 140 Ų | 140 | 79% | 0.786 | 82% | 0.824 | S | S | * | * | -117.2 | 169.5 | -60.3 | 33.3 | -16.2 | 0 | 0 | 0 | 114.2 | |||||
| 24 | R | 38.8 | Very low | 34.9 | Very low | 252 Ų | 252 | 140.7 Ų | 140.7 | 95% | 0.951 | 82% | 0.824 | S | S | * | * | trans | -54.1 | 141.8 | 167.5 | -81.1 | 170.5 | 157.4 | 149.2 | -7.5 | 113 | ||||
| 25 | A | 33.5 | Very low | 35.2 | Very low | 105 Ų | 105 | 139.3 Ų | 139.3 | 87% | 0.868 | 82% | 0.82 | S | S | * | * | trans | -133 | 139.3 | 156.2 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 26 | S | 35.2 | Very low | 35.4 | Very low | 100 Ų | 100 | 139.1 Ų | 139.1 | 70% | 0.699 | 82% | 0.819 | S | S | * | * | trans | -73.4 | 136.8 | -163.2 | -179.8 | 0 | 0 | 0 | 0 | 114.3 | A28 | S26-A28 PolarHBondContact O-N 2.66Å; S26-A28 WeakPolarHBondContact OG-CB 3.33Å | ||
| 27 | A | 35.4 | Very low | 35.5 | Very low | 116 Ų | 116 | 142.8 Ų | 142.8 | 96% | 0.959 | 83% | 0.828 | S | S | * | * | S | Bend | trans | -79.9 | 55.2 | 169 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 28 | A | 36.1 | Very low | 35.7 | Very low | 80 Ų | 80 | 146.2 Ų | 146.2 | 66% | 0.661 | 83% | 0.83 | S | S | * | * | trans | -127.1 | 12.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | S26 | S26-A28 PolarHBondContact O-N 2.66Å; S26-A28 WeakPolarHBondContact OG-CB 3.33Å | ||
| 29 | G | 34.8 | Very low | 35.9 | Very low | 58 Ų | 58 | 141 Ų | 141 | 60% | 0.598 | 83% | 0.829 | S | S | * | * | S | Bend | trans | -106.7 | -3.3 | -170.7 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||
| 30 | L | 33.4 | Very low | 35.6 | Very low | 176 Ų | 176 | 133.4 Ų | 133.4 | 92% | 0.921 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -107.1 | 4.1 | -170.7 | -133.7 | 80.4 | 0 | 0 | 0 | 115.4 | ||
| 31 | A | 37.2 | Very low | 35.6 | Very low | 103 Ų | 103 | 126.9 Ų | 126.9 | 85% | 0.851 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -104.4 | -6.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 32 | A | 34.9 | Very low | 35.7 | Very low | 80 Ų | 80 | 130.2 Ų | 130.2 | 66% | 0.661 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -100.8 | 3.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 33 | K | 34.6 | Very low | 35.2 | Very low | 184 Ų | 184 | 130 Ų | 130 | 80% | 0.8 | 82% | 0.822 | S | S | * | * | S | Bend | trans | -122.9 | 35.4 | -171.7 | -153.3 | 153.7 | -178.2 | 168.1 | 0 | 114.9 | ||
| 34 | V | 34.2 | Very low | 34.6 | Very low | 140 Ų | 140 | 127.4 Ų | 127.4 | 85% | 0.848 | 82% | 0.816 | S | S | * | * | S | Bend | trans | -132.2 | -10.7 | 168.7 | 177.6 | 0 | 0 | 0 | 0 | 112.4 | ||
| 35 | G | 38.9 | Very low | 34.8 | Very low | 79 Ų | 79 | 121.4 Ų | 121.4 | 81% | 0.814 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -91.9 | -5 | -177.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 36 | E | 36.4 | Very low | 34.7 | Very low | 179 Ų | 179 | 122.6 Ų | 122.6 | 84% | 0.836 | 81% | 0.812 | S | S | * | * | S | Bend | trans | -122.6 | 49.4 | -165.4 | -142.7 | 178.8 | -171.2 | 0 | 0 | 112.4 | ||
| 37 | M | 32.5 | Very low | 34.6 | Very low | 176 Ų | 176 | 125.6 Ų | 125.6 | 87% | 0.867 | 82% | 0.819 | S | S | * | * | S | Bend | trans | -145.4 | 27.3 | 174.2 | -115.9 | -169.3 | -57.6 | 0 | 0 | 114.7 | ||
| 38 | I | 38.8 | Very low | 34.4 | Very low | 175 Ų | 175 | 127.7 Ų | 127.7 | 90% | 0.897 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -142.5 | 22.6 | 171.2 | -22.3 | 175.3 | 0 | 0 | 0 | 114.4 | ||
| 39 | S | 38.2 | Very low | 34.2 | Very low | 125 Ų | 125 | 129 Ų | 129 | 87% | 0.874 | 82% | 0.824 | S | S | * | * | trans | -146.8 | 72.9 | 175.8 | -166 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 40 | A | 28.1 | Very low | 34.1 | Very low | 97 Ų | 97 | 130.2 Ų | 130.2 | 80% | 0.802 | 83% | 0.829 | S | S | * | * | trans | -165.4 | 91.3 | 157.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 41 | S | 32.9 | Very low | 34 | Very low | 118 Ų | 118 | 131.5 Ų | 131.5 | 83% | 0.825 | 83% | 0.83 | S | S | * | * | S | Bend | trans | -158.1 | 122.8 | 147.3 | -76.5 | 0 | 0 | 0 | 0 | 109 | ||
| 42 | V | 32.5 | Very low | 33.6 | Very low | 144 Ų | 144 | 130.3 Ų | 130.3 | 87% | 0.873 | 83% | 0.827 | S | S | * | * | trans | 91.7 | 76.3 | 173.8 | -159.8 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 43 | S | 30.4 | Very low | 33.5 | Very low | 123 Ų | 123 | 131.1 Ų | 131.1 | 86% | 0.86 | 83% | 0.834 | S | S | * | * | trans | -63.5 | 150.7 | 136.2 | -48.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 44 | G | 30.8 | Very low | 34.3 | Very low | 65 Ų | 65 | 127.3 Ų | 127.3 | 67% | 0.67 | 83% | 0.828 | S | S | * | * | cis | -170.1 | -168.8 | 11.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 45 | P | 42.3 | Very low | 34.1 | Very low | 127 Ų | 127 | 127.8 Ų | 127.8 | 83% | 0.825 | 83% | 0.826 | S | S | * | * | trans | -97.6 | 154.6 | -169.4 | 36.6 | -30.7 | 0 | 0 | 0 | 112.9 | ||||
| 46 | S | 31.2 | Very low | 33.9 | Very low | 130 Ų | 130 | 128.9 Ų | 128.9 | 91% | 0.909 | 83% | 0.827 | S | S | * | * | trans | -148 | 123.2 | 164.8 | -68 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 47 | L | 32.2 | Very low | 34 | Very low | 163 Ų | 163 | 128 Ų | 128 | 85% | 0.853 | 83% | 0.828 | S | S | * | * | trans | -26.6 | 136.4 | 170.3 | -77.9 | 151.1 | 0 | 0 | 0 | 120.3 | ||||
| 48 | L | 31.2 | Very low | 34.8 | Very low | 160 Ų | 160 | 125.2 Ų | 125.2 | 84% | 0.838 | 82% | 0.823 | S | S | * | * | 9.4 | 121.2 | 127.2 | -86.8 | 156.1 | 0 | 0 | 0 | 118.8 | |||||
| 49 | A | 33.4 | Very low | 34.7 | Very low | 106 Ų | 106 | 121.2 Ų | 121.2 | 88% | 0.876 | 82% | 0.816 | S | S | * | * | trans | -154.6 | 133.1 | 138.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 50 | A | 31.2 | Very low | 35.1 | Very low | 85 Ų | 85 | 121.2 Ų | 121.2 | 70% | 0.702 | 81% | 0.813 | S | S | * | * | trans | -92.6 | 148.7 | -176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 51 | H | 31.3 | Very low | 35.5 | Very low | 203 Ų | 203 | 120.2 Ų | 120.2 | 94% | 0.94 | 81% | 0.812 | S | S | * | * | 165.2 | 135.9 | 125.8 | -100.4 | -45.7 | 0 | 0 | 0 | 112.7 | |||||
| 52 | G | 29.5 | Very low | 35.4 | Very low | 78 Ų | 78 | 118.5 Ų | 118.5 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | 127.2 | 94.9 | 153.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 53 | A | 33 | Very low | 35.8 | Very low | 97 Ų | 97 | 123.7 Ų | 123.7 | 80% | 0.802 | 82% | 0.817 | S | S | * | * | trans | -94 | -174.8 | 162.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 54 | P | 51 | Low | 36.1 | Very low | 103 Ų | 103 | 123.2 Ų | 123.2 | 67% | 0.669 | 81% | 0.814 | S | S | * | * | cis | -132 | -165.4 | -19.9 | 29.8 | -6 | 0 | 0 | 0 | 112.4 | ||||
| 55 | D | 30.9 | Very low | 36.7 | Very low | 151 Ų | 151 | 125.4 Ų | 125.4 | 81% | 0.807 | 83% | 0.826 | S | S | * | * | trans | 96.3 | 101.8 | 154.3 | -56.1 | -29.2 | 0 | 0 | 0 | 119.1 | ||||
| 56 | A | 33.9 | Very low | 36.5 | Very low | 102 Ų | 102 | 123.6 Ų | 123.6 | 84% | 0.843 | 82% | 0.822 | S | S | * | * | 156.3 | 110.3 | 103.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 57 | D | 38.9 | Very low | 36.8 | Very low | 159 Ų | 159 | 125.9 Ų | 125.9 | 85% | 0.85 | 82% | 0.82 | S | S | * | * | trans | -103.4 | 147.5 | 152.4 | -104.1 | -30.2 | 0 | 0 | 0 | 106.6 | ||||
| 58 | P | 50.2 | Low | 37.1 | Very low | 119 Ų | 119 | 123.9 Ų | 123.9 | 77% | 0.773 | 82% | 0.82 | S | S | * | * | -152.4 | 145.5 | 72.8 | 36.1 | -15.1 | 0 | 0 | 0 | 117.9 | |||||
| 59 | A | 35.9 | Very low | 37.3 | Very low | 90 Ų | 90 | 118.8 Ų | 118.8 | 74% | 0.744 | 81% | 0.806 | S | S | * | * | trans | 37.5 | 173.4 | 132.2 | 0 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 60 | P | 46.9 | Very low | 37.7 | Very low | 125 Ų | 125 | 119.8 Ų | 119.8 | 81% | 0.812 | 80% | 0.804 | S | S | * | * | cis | -132.1 | 163.4 | -13.7 | 32 | -11.4 | 0 | 0 | 0 | 115.4 | ||||
| 61 | G | 35.5 | Very low | 38.4 | Very low | 76 Ų | 76 | 124.5 Ų | 124.5 | 78% | 0.784 | 81% | 0.811 | S | S | * | * | 70.3 | 69.8 | 128.6 | 0 | 0 | 0 | 0 | 0 | 120.1 | R63 | G61-R63 PolarHBondContact O-N 3.49Š| |||
| 62 | G | 30.8 | Very low | 39.2 | Very low | 83 Ų | 83 | 120.9 Ų | 120.9 | 86% | 0.856 | 81% | 0.806 | S | S | * | * | trans | -77.3 | 90.8 | 160.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | S64 | G62-S64 PolarHBondContact O-N 2.87Š| ||
| 63 | R | 42.4 | Very low | 39.9 | Very low | 252 Ų | 252 | 119.3 Ų | 119.3 | 95% | 0.951 | 79% | 0.789 | S | S | * | * | trans | -67.3 | 103.9 | 162.7 | -105 | 174.3 | 157.3 | 167.8 | -6.3 | 108.7 | G61 | G61-R63 PolarHBondContact O-N 3.49Š| ||
| 64 | S | 35.4 | Very low | 40.9 | Very low | 114 Ų | 114 | 117.5 Ų | 117.5 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | trans | -108.3 | 96 | 160.1 | -76.2 | 0 | 0 | 0 | 0 | 109.1 | G62 A66 | G62-S64 PolarHBondContact O-N 2.87Å; S64-A66 PolarHBondContact O-N 2.91Å | ||
| 65 | A | 44.4 | Very low | 41.1 | Very low | 110 Ų | 110 | 117.8 Ų | 117.8 | 91% | 0.909 | 78% | 0.782 | S | S | * | * | trans | -72.3 | 97 | 157.3 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 66 | A | 36.5 | Very low | 42.4 | Very low | 89 Ų | 89 | 117.9 Ų | 117.9 | 74% | 0.736 | 77% | 0.772 | S | S | * | * | trans | -114 | 99.8 | 169.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | S64 | S64-A66 PolarHBondContact O-N 2.91Š| ||
| 67 | M | 38.5 | Very low | 43.7 | Very low | 179 Ų | 179 | 117 Ų | 117 | 88% | 0.882 | 76% | 0.757 | S | S | * | * | trans | 28 | 108.8 | 147.7 | -130.6 | 106.2 | 93 | 0 | 0 | 116.8 | G69 | M67-G69 PolarHBondContact O-N 2.98Š| ||
| 68 | S | 37.8 | Very low | 45.1 | Very low | 121 Ų | 121 | 115.1 Ų | 115.1 | 85% | 0.846 | 75% | 0.748 | S | S | * | * | trans | -49.8 | 97.4 | 153.4 | 48.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 69 | G | 37 | Very low | 46.3 | Very low | 53 Ų | 53 | 112.5 Ų | 112.5 | 55% | 0.546 | 73% | 0.729 | S | S | . | * | P | Polyproline II helix | trans | -70.3 | 150.8 | 161.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | M67 E71 | M67-G69 PolarHBondContact O-N 2.98Å; G69-E71 PolarHBondContact O-N 3.31Å |
| 70 | P | 41.4 | Very low | 48.2 | Very low | 127 Ų | 127 | 114.4 Ų | 114.4 | 83% | 0.825 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 119.9 | 176.8 | 27.2 | -31 | 0 | 0 | 0 | 108.7 | ||
| 71 | E | 44.5 | Very low | 49.9 | Very low | 184 Ų | 184 | 114.2 Ų | 114.2 | 86% | 0.86 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 127.4 | 170.3 | -70.3 | -155.3 | 115.5 | 0 | 0 | 109.4 | G69 G73 | G69-E71 PolarHBondContact O-N 3.31Å; E71-G73 PolarHBondContact O-N 3.35Å |
| 72 | P | 48.7 | Very low | 52.2 | Low | 127 Ų | 127 | 116.8 Ų | 116.8 | 83% | 0.825 | 70% | 0.697 | S | S | * | * | trans | -72.8 | 102.2 | 176.5 | 26.8 | -28.8 | 0 | 0 | 0 | 109.3 | ||||
| 73 | G | 43.8 | Very low | 54.8 | Low | 44 Ų | 44 | 117.6 Ų | 117.6 | 45% | 0.454 | 67% | 0.674 | S | S | . | * | trans | 33.7 | 113.7 | 147.2 | 0 | 0 | 0 | 0 | 0 | 117.7 | E71 | E71-G73 PolarHBondContact O-N 3.35Š| ||
| 74 | G | 54.6 | Low | 56.9 | Low | 59 Ų | 59 | 109.5 Ų | 109.5 | 61% | 0.608 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -51.6 | 167.5 | 162.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y76 | G74-Y76 PolarHBondContact O-N 3.39Š|
| 75 | P | 55.8 | Low | 59.5 | Low | 110 Ų | 110 | 108.8 Ų | 108.8 | 71% | 0.714 | 64% | 0.64 | S | S | * | * | trans | -57.5 | 108.6 | -167.8 | -19.9 | 30.1 | 0 | 0 | 0 | 111.7 | P77 | P75-P77 WeakPolarHBondContact O-CD 3.27Š| ||
| 76 | Y | 58.6 | Low | 61.7 | Low | 152 Ų | 152 | 109 Ų | 109 | 60% | 0.596 | 62% | 0.622 | S | S | * | * | trans | -55.6 | 121.3 | 175.7 | -66 | -90.6 | 0 | 0 | 0 | 109.5 | G74 N78 T79 | G74-Y76 PolarHBondContact O-N 3.39Å; Y76-N78 PolarHBondContact O-N 3.35Å; Y76-T79 PolarHBondContact O-N 3.04Å; Y76-T79 PolarHBondContact O-OG1 3.33Å | ||
| 77 | P | 61 | Low | 64.3 | Low | 83 Ų | 83 | 107.1 Ų | 107.1 | 54% | 0.539 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -55.1 | -29.3 | -178.1 | 18.9 | -30.9 | 0 | 0 | 0 | 112.5 | P75 T79 W80 H81 | P75-P77 WeakPolarHBondContact O-CD 3.27Å; P77-T79 PolarHBondContact O-N 3.22Å; P77-W80 PolarHBondContact O-N 3.39Å; P77-H81 PolarHBondContact O-CD2 3.26Å; P77-H81 PolarHBondContact O-N 3.03Å |
| 78 | N | 66.8 | Low | 66.9 | Low | 121 Ų | 121 | 100.5 Ų | 100.5 | 65% | 0.647 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -59.8 | -27.8 | 179 | -60.5 | -18.4 | 0 | 0 | 0 | 113.7 | Y76 H82 | Y76-N78 PolarHBondContact O-N 3.35Å; N78-H82 WeakPolarHBondContact O-CB 3.44Å; N78-H82 PolarHBondContact O-N 3.4Å; N78-H82 VanDerWaalsContact O-N 3.13Å |
| 79 | T | 76.9 | Confident | 69.6 | Low | 63 Ų | 63 | 100.1 Ų | 100.1 | 39% | 0.387 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -76.1 | -35.5 | -178.1 | 58.3 | 0 | 0 | 0 | 0 | 113.1 | Y76 P77 R83 | Y76-T79 PolarHBondContact O-N 3.04Å; Y76-T79 PolarHBondContact O-OG1 3.33Å; P77-T79 PolarHBondContact O-N 3.22Å; T79-R83 VanDerWaalsContact O-CG 3.3Å; T79-R83 WeakPolarHBondContact O-CG 3.17Å; T79-R83 PolarHBondContact O-N 3.08Å; T79-R83 VanDerWaalsContact O-N 3.14Å |
| 80 | W | 74.7 | Confident | 72.4 | Confident | 131 Ų | 131 | 100.2 Ų | 100.2 | 50% | 0.496 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -69.1 | -46.2 | 176 | -73.5 | 105.5 | 0 | 0 | 0 | 111.8 | P77 H82 R83 L84 | P77-W80 PolarHBondContact O-N 3.39Å; W80-H82 VanDerWaalsContact C-N 3.32Å; W80-H82 PolarHBondContact O-N 3.07Å; W80-R83 PolarHBondContact O-N 3.25Å; W80-L84 WeakPolarHBondContact O-CG 2.89Å; W80-L84 PolarHBondContact O-N 3.16Å |
| 81 | H | 83.2 | Confident | 74.9 | Confident | 121 Ų | 121 | 94.4 Ų | 94.4 | 56% | 0.56 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -59.6 | -44.1 | 175.5 | -68.8 | -64.6 | 0 | 0 | 0 | 111.3 | P77 R83 L84 V85 | P77-H81 PolarHBondContact O-CD2 3.26Å; P77-H81 PolarHBondContact O-N 3.03Å; H81-R83 VanDerWaalsContact C-N 3.34Å; H81-R83 PolarHBondContact O-N 2.95Å; H81-L84 PolarHBondContact O-N 3.41Å; H81-V85 WeakPolarHBondContact O-CB 3.29Å; H81-V85 WeakPolarHBondContact O-CG2 3.17Å; H81-V85 PolarHBondContact O-N 2.78Å |
| 82 | H | 84 | Confident | 77.4 | Confident | 129 Ų | 129 | 89.1 Ų | 89.1 | 60% | 0.597 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -60.6 | -41.4 | 177.5 | -167.6 | -67.8 | 0 | 0 | 0 | 112.6 | N78 W80 Q86 | N78-H82 WeakPolarHBondContact O-CB 3.44Å; N78-H82 PolarHBondContact O-N 3.4Å; N78-H82 VanDerWaalsContact O-N 3.13Å; W80-H82 VanDerWaalsContact C-N 3.32Å; W80-H82 PolarHBondContact O-N 3.07Å; H82-Q86 WeakPolarHBondContact O-CB 3.22Å; H82-Q86 PolarHBondContact O-N 3.38Å |
| 83 | R | 85 | Confident | 79.5 | Confident | 101 Ų | 101 | 85.7 Ų | 85.7 | 38% | 0.381 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -68 | -41.5 | 177.9 | -71.7 | 174.1 | -174.3 | -167 | 1.3 | 112.3 | T79 W80 H81 Q86 R87 | T79-R83 VanDerWaalsContact O-CG 3.3Å; T79-R83 WeakPolarHBondContact O-CG 3.17Å; T79-R83 PolarHBondContact O-N 3.08Å; T79-R83 VanDerWaalsContact O-N 3.14Å; W80-R83 PolarHBondContact O-N 3.25Å; H81-R83 VanDerWaalsContact C-N 3.34Å; H81-R83 PolarHBondContact O-N 2.95Å; R83-Q86 PolarHBondContact O-N 3.01Å; R83-R87 VanDerWaalsContact O-CG 3.32Å; R83-R87 WeakPolarHBondContact O-CG 3.25Å; R83-R87 PolarHBondContact O-N 3.28Å |
| 84 | L | 87.4 | Confident | 81.9 | Confident | 82 Ų | 82 | 85.8 Ų | 85.8 | 43% | 0.429 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -64.3 | -43.9 | 176.1 | -72.9 | 170.4 | 0 | 0 | 0 | 111.4 | W80 H81 R87 S88 | W80-L84 WeakPolarHBondContact O-CG 2.89Å; W80-L84 PolarHBondContact O-N 3.16Å; H81-L84 PolarHBondContact O-N 3.41Å; L84-R87 PolarHBondContact O-N 3.35Å; L84-S88 WeakPolarHBondContact O-CB 3.49Å; L84-S88 PolarHBondContact O-N 2.92Å |
| 85 | V | 89.9 | Confident | 83.8 | Confident | 99 Ų | 99 | 83.2 Ų | 83.2 | 60% | 0.6 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -60.9 | -45.7 | 175.4 | 170.2 | 0 | 0 | 0 | 0 | 110.6 | H81 R87 S88 L89 | H81-V85 WeakPolarHBondContact O-CB 3.29Å; H81-V85 WeakPolarHBondContact O-CG2 3.17Å; H81-V85 PolarHBondContact O-N 2.78Å; V85-R87 PolarHBondContact O-N 3Å; V85-S88 WeakPolarHBondContact O-CB 3.22Å; V85-S88 PolarHBondContact O-N 3.06Å; V85-L89 WeakPolarHBondContact O-CB 3.45Å; V85-L89 PolarHBondContact O-N 2.78Å |
| 86 | Q | 90.3 | Very high | 85.6 | Confident | 114 Ų | 114 | 79.4 Ų | 79.4 | 53% | 0.533 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -61.4 | -44.5 | 177.5 | -173.6 | -179.9 | 2.7 | 0 | 0 | 112.1 | H82 R83 L89 V90 | H82-Q86 WeakPolarHBondContact O-CB 3.22Å; H82-Q86 PolarHBondContact O-N 3.38Å; R83-Q86 PolarHBondContact O-N 3.01Å; Q86-L89 PolarHBondContact O-N 3.33Å; Q86-V90 WeakPolarHBondContact O-CG2 3.32Å; Q86-V90 PolarHBondContact O-N 2.91Å |
| 87 | R | 91.4 | Very high | 87.1 | Confident | 50 Ų | 50 | 76.2 Ų | 76.2 | 19% | 0.189 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -61.8 | -45.1 | 175.9 | -73 | 174.7 | 175.8 | 173.9 | -1.6 | 111.7 | R83 L84 V85 L89 V90 L91 L142 L266 A267 | R83-R87 VanDerWaalsContact O-CG 3.32Å; R83-R87 WeakPolarHBondContact O-CG 3.25Å; R83-R87 PolarHBondContact O-N 3.28Å; L84-R87 PolarHBondContact O-N 3.35Å; V85-R87 PolarHBondContact O-N 3Å; R87-L89 VanDerWaalsContact C-N 3.34Å; R87-L89 PolarHBondContact O-N 3.47Å; R87-V90 PolarHBondContact O-N 3.36Å; R87-L91 WeakPolarHBondContact O-CB 3.02Å; R87-L91 WeakPolarHBondContact O-CG 3.43Å; R87-L91 PolarHBondContact O-N 3.4Å; R87-L142 HydrophobicContact CB-CD2 4.32Å; R87-L266 HydrophobicContact CG-CB 4.31Å; R87-L266 VanDerWaalsContact CZ-O 3.28Å; R87-L266 PolarHBondContact NE-O 3.26Å; R87-L266 PolarHBondContact NH2-O 2.91Å; R87-A267 PolarHBondContact NH2-O 3.26Å |
| 88 | S | 92.9 | Very high | 88.6 | Confident | 40 Ų | 40 | 73.2 Ų | 73.2 | 28% | 0.28 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -59.1 | -45.4 | 176.2 | -170.8 | 0 | 0 | 0 | 0 | 111.3 | L84 V85 V90 L91 F92 | L84-S88 WeakPolarHBondContact O-CB 3.49Å; L84-S88 PolarHBondContact O-N 2.92Å; V85-S88 WeakPolarHBondContact O-CB 3.22Å; V85-S88 PolarHBondContact O-N 3.06Å; S88-V90 PolarHBondContact O-N 2.97Å; S88-L91 PolarHBondContact O-N 2.92Å; S88-F92 VanDerWaalsContact O-CB 3.23Å; S88-F92 WeakPolarHBondContact O-CB 3.18Å; S88-F92 PolarHBondContact O-N 2.91Å |
| 89 | L | 94.6 | Very high | 89.6 | Confident | 112 Ų | 112 | 68.2 Ų | 68.2 | 59% | 0.586 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -61.1 | -44.6 | 177.7 | -169.5 | 82.6 | 0 | 0 | 0 | 111.8 | V85 Q86 R87 F92 S93 | V85-L89 WeakPolarHBondContact O-CB 3.45Å; V85-L89 PolarHBondContact O-N 2.78Å; Q86-L89 PolarHBondContact O-N 3.33Å; R87-L89 VanDerWaalsContact C-N 3.34Å; R87-L89 PolarHBondContact O-N 3.47Å; L89-F92 PolarHBondContact O-N 2.79Å; L89-S93 WeakPolarHBondContact O-CB 3.26Å; L89-S93 PolarHBondContact O-N 3.44Å; L89-S93 PolarHBondContact O-OG 3.2Å |
| 90 | V | 94.1 | Very high | 90.2 | Very high | 56 Ų | 56 | 68.1 Ų | 68.1 | 34% | 0.339 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -63.8 | -47.9 | 177.4 | 172.8 | 0 | 0 | 0 | 0 | 110.6 | Q86 R87 S88 F92 S93 V94 L266 | Q86-V90 WeakPolarHBondContact O-CG2 3.32Å; Q86-V90 PolarHBondContact O-N 2.91Å; R87-V90 PolarHBondContact O-N 3.36Å; S88-V90 PolarHBondContact O-N 2.97Å; V90-F92 VanDerWaalsContact C-N 3.34Å; V90-F92 PolarHBondContact O-N 3.21Å; V90-S93 PolarHBondContact O-N 3.39Å; V90-V94 HydrophobicContact CG1-CG2 4.42Å; V90-V94 VanDerWaalsContact O-CG2 3.3Å; V90-V94 WeakPolarHBondContact O-CG2 3.26Å; V90-V94 PolarHBondContact O-N 3.22Å; V90-L266 HydrophobicContact CB-CD1 4.32Å; V90-L266 HydrophobicContact CG1-CD1 3.89Å; V90-L266 HydrophobicContact CG1-CD2 4.27Å |
| 91 | L | 94.7 | Very high | 90.8 | Very high | 4 Ų | 4 | 64.5 Ų | 64.5 | 2% | 0.021 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62 | -41.7 | 178.3 | -73.8 | 165 | 0 | 0 | 0 | 112.1 | R87 S88 V94 G95 A138 L142 V259 I262 L266 | R87-L91 WeakPolarHBondContact O-CB 3.02Å; R87-L91 WeakPolarHBondContact O-CG 3.43Å; R87-L91 PolarHBondContact O-N 3.4Å; S88-L91 PolarHBondContact O-N 2.92Å; L91-V94 PolarHBondContact O-N 3.46Å; L91-G95 PolarHBondContact O-N 3.12Å; L91-A138 HydrophobicContact CB-CB 4.35Å; L91-L142 HydrophobicContact CD1-CD2 4.32Å; L91-L142 HydrophobicContact CD1-CG 4.21Å; L91-V259 HydrophobicContact CD2-CG1 4.24Å; L91-I262 HydrophobicContact CD2-CB 4.21Å; L91-I262 HydrophobicContact CD2-CG2 3.76Å; L91-L266 HydrophobicContact CD1-CD1 4.47Å; L91-L266 HydrophobicContact CD2-CD1 3.94Å; L91-L266 HydrophobicContact CG-CD1 3.81Å |
| 92 | F | 96.2 | Very high | 90.9 | Very high | 73 Ų | 73 | 59.6 Ų | 59.6 | 32% | 0.32 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59.1 | -50.7 | 174.7 | 178 | -90.8 | 0 | 0 | 0 | 110.9 | S88 L89 V90 V94 G95 V96 G134 A138 | S88-F92 VanDerWaalsContact O-CB 3.23Å; S88-F92 WeakPolarHBondContact O-CB 3.18Å; S88-F92 PolarHBondContact O-N 2.91Å; L89-F92 PolarHBondContact O-N 2.79Å; V90-F92 VanDerWaalsContact C-N 3.34Å; V90-F92 PolarHBondContact O-N 3.21Å; F92-V94 PolarHBondContact O-N 3.05Å; F92-G95 PolarHBondContact O-N 2.93Å; F92-G95 VanDerWaalsContact O-N 3.17Å; F92-V96 HydrophobicContact CD1-CG2 4.11Å; F92-V96 HydrophobicContact CE1-CG2 3.69Å; F92-V96 HydrophobicContact CE2-CG2 4.41Å; F92-V96 HydrophobicContact CZ-CG2 3.85Å; F92-V96 WeakPolarHBondContact O-CG2 3.21Å; F92-V96 PolarHBondContact O-N 2.92Å; F92-G134 WeakPolarHBondContact CA-O 3.48Å; F92-A138 HydrophobicContact CB-CB 4.35Å |
| 93 | S | 94.1 | Very high | 90.7 | Very high | 56 Ų | 56 | 55.4 Ų | 55.4 | 39% | 0.392 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -59.8 | -45.8 | -179.9 | -54 | 0 | 0 | 0 | 0 | 111.4 | L89 V90 G95 V96 V97 | L89-S93 WeakPolarHBondContact O-CB 3.26Å; L89-S93 PolarHBondContact O-N 3.44Å; L89-S93 PolarHBondContact O-OG 3.2Å; V90-S93 PolarHBondContact O-N 3.39Å; S93-G95 VanDerWaalsContact C-N 3.34Å; S93-G95 PolarHBondContact O-N 2.95Å; S93-V96 PolarHBondContact O-N 3.26Å; S93-V97 WeakPolarHBondContact O-CG2 3.27Å; S93-V97 PolarHBondContact O-N 3.29Å |
| 94 | V | 94 | Very high | 90.4 | Very high | 46 Ų | 46 | 54.9 Ų | 54.9 | 28% | 0.279 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -62.9 | -41.7 | 176.5 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | V90 L91 F92 V97 L98 I262 | V90-V94 HydrophobicContact CG1-CG2 4.42Å; V90-V94 VanDerWaalsContact O-CG2 3.3Å; V90-V94 WeakPolarHBondContact O-CG2 3.26Å; V90-V94 PolarHBondContact O-N 3.22Å; L91-V94 PolarHBondContact O-N 3.46Å; F92-V94 PolarHBondContact O-N 3.05Å; V94-V97 PolarHBondContact O-N 2.88Å; V94-L98 HydrophobicContact CG1-CD1 3.83Å; V94-L98 HydrophobicContact CG1-CG 4.27Å; V94-L98 WeakPolarHBondContact O-CB 3.34Å; V94-L98 WeakPolarHBondContact O-CG 3.49Å; V94-L98 PolarHBondContact O-N 2.9Å; V94-I262 HydrophobicContact CG1-CD1 3.93Å |
| 95 | G | 93.9 | Very high | 90 | Very high | 5 Ų | 5 | 53.3 Ų | 53.3 | 5% | 0.052 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -62.1 | -43.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | L91 F92 S93 A99 | L91-G95 PolarHBondContact O-N 3.12Å; F92-G95 PolarHBondContact O-N 2.93Å; F92-G95 VanDerWaalsContact O-N 3.17Å; S93-G95 VanDerWaalsContact C-N 3.34Å; S93-G95 PolarHBondContact O-N 2.95Å; G95-A99 VanDerWaalsContact O-CB 3.31Å; G95-A99 WeakPolarHBondContact O-CB 3.47Å; G95-A99 PolarHBondContact O-N 3.22Å |
| 96 | V | 93.1 | Very high | 89 | Confident | 30 Ų | 30 | 51.8 Ų | 51.8 | 18% | 0.182 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.3 | -48.8 | 174.9 | 172.2 | 0 | 0 | 0 | 0 | 110.7 | F92 S93 L98 A99 L100 P130 | F92-V96 HydrophobicContact CD1-CG2 4.11Å; F92-V96 HydrophobicContact CE1-CG2 3.69Å; F92-V96 HydrophobicContact CE2-CG2 4.41Å; F92-V96 HydrophobicContact CZ-CG2 3.85Å; F92-V96 WeakPolarHBondContact O-CG2 3.21Å; F92-V96 PolarHBondContact O-N 2.92Å; S93-V96 PolarHBondContact O-N 3.26Å; V96-L98 PolarHBondContact O-N 2.95Å; V96-A99 PolarHBondContact O-N 2.83Å; V96-L100 HydrophobicContact CG1-CD1 3.99Å; V96-L100 HydrophobicContact CG1-CG 4.42Å; V96-L100 VanDerWaalsContact O-CG 3.32Å; V96-L100 WeakPolarHBondContact O-CG 3.46Å; V96-L100 PolarHBondContact O-N 2.68Å; V96-P130 HydrophobicContact CG1-CB 4.08Å |
| 97 | V | 91.8 | Very high | 87.9 | Confident | 85 Ų | 85 | 48.4 Ų | 48.4 | 52% | 0.515 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -61.7 | -46.3 | -179.9 | 170.9 | 0 | 0 | 0 | 0 | 111.1 | S93 V94 A99 L100 V101 | S93-V97 WeakPolarHBondContact O-CG2 3.27Å; S93-V97 PolarHBondContact O-N 3.29Å; V94-V97 PolarHBondContact O-N 2.88Å; V97-A99 PolarHBondContact O-N 3.21Å; V97-L100 PolarHBondContact O-N 3.35Å; V97-V101 HydrophobicContact CG1-CG2 4.37Å; V97-V101 VanDerWaalsContact O-CG2 3.31Å; V97-V101 WeakPolarHBondContact O-CG2 3.23Å; V97-V101 PolarHBondContact O-N 3.36Å |
| 98 | L | 91.1 | Very high | 86.4 | Confident | 20 Ų | 20 | 51.2 Ų | 51.2 | 11% | 0.105 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.2 | -46.9 | 176.2 | -74 | 172.6 | 0 | 0 | 0 | 110.8 | V94 V96 L100 V101 L102 I168 V172 | V94-L98 HydrophobicContact CG1-CD1 3.83Å; V94-L98 HydrophobicContact CG1-CG 4.27Å; V94-L98 WeakPolarHBondContact O-CB 3.34Å; V94-L98 WeakPolarHBondContact O-CG 3.49Å; V94-L98 PolarHBondContact O-N 2.9Å; V96-L98 PolarHBondContact O-N 2.95Å; L98-L100 VanDerWaalsContact C-N 3.32Å; L98-L100 PolarHBondContact O-N 2.98Å; L98-V101 PolarHBondContact O-N 3.21Å; L98-L102 WeakPolarHBondContact O-CB 3.25Å; L98-L102 WeakPolarHBondContact O-CG 3.32Å; L98-L102 PolarHBondContact O-N 3.5Å; L98-I168 HydrophobicContact CD2-CG2 3.89Å; L98-V172 HydrophobicContact CD2-CG2 4.21Å |
| 99 | A | 89.4 | Confident | 84.7 | Confident | 16 Ų | 16 | 56.2 Ų | 56.2 | 13% | 0.132 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -58 | -43.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G95 V96 V97 N103 P130 C133 | G95-A99 VanDerWaalsContact O-CB 3.31Å; G95-A99 WeakPolarHBondContact O-CB 3.47Å; G95-A99 PolarHBondContact O-N 3.22Å; V96-A99 PolarHBondContact O-N 2.83Å; V97-A99 PolarHBondContact O-N 3.21Å; A99-N103 WeakPolarHBondContact O-CB 3.47Å; A99-N103 PolarHBondContact O-N 3.32Å; A99-P130 HydrophobicContact CB-CB 4.47Å; A99-C133 HydrophobicContact CB-CB 3.59Å |
| 100 | L | 87.6 | Confident | 82.6 | Confident | 61 Ų | 61 | 57.4 Ų | 57.4 | 32% | 0.319 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -63.4 | -46 | 175.9 | -69.6 | 173.5 | 0 | 0 | 0 | 111.8 | V96 V97 L98 L102 N103 L104 P130 | V96-L100 HydrophobicContact CG1-CD1 3.99Å; V96-L100 HydrophobicContact CG1-CG 4.42Å; V96-L100 VanDerWaalsContact O-CG 3.32Å; V96-L100 WeakPolarHBondContact O-CG 3.46Å; V96-L100 PolarHBondContact O-N 2.68Å; V97-L100 PolarHBondContact O-N 3.35Å; L98-L100 VanDerWaalsContact C-N 3.32Å; L98-L100 PolarHBondContact O-N 2.98Å; L100-L102 PolarHBondContact O-N 3.38Å; L100-N103 PolarHBondContact O-N 2.86Å; L100-L104 WeakPolarHBondContact O-CB 3.38Å; L100-L104 VanDerWaalsContact O-CG 3.28Å; L100-L104 WeakPolarHBondContact O-CG 3.43Å; L100-L104 PolarHBondContact O-N 3.23Å; L100-P130 HydrophobicContact CD2-CB 4.11Å; L100-P130 HydrophobicContact CD2-CG 3.66Å; L100-P130 HydrophobicContact CG-CB 4.25Å; L100-P130 HydrophobicContact CG-CG 4.32Å |
| 101 | V | 87.2 | Confident | 80.2 | Confident | 55 Ų | 55 | 57.9 Ų | 57.9 | 33% | 0.333 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -60.1 | -47.7 | 177.8 | 168.9 | 0 | 0 | 0 | 0 | 111 | V97 L98 N103 L104 L105 V172 | V97-V101 HydrophobicContact CG1-CG2 4.37Å; V97-V101 VanDerWaalsContact O-CG2 3.31Å; V97-V101 WeakPolarHBondContact O-CG2 3.23Å; V97-V101 PolarHBondContact O-N 3.36Å; L98-V101 PolarHBondContact O-N 3.21Å; V101-N103 VanDerWaalsContact C-N 3.34Å; V101-N103 PolarHBondContact O-N 2.91Å; V101-L104 PolarHBondContact O-N 2.87Å; V101-L105 HydrophobicContact CG1-CD1 4.02Å; V101-L105 VanDerWaalsContact O-CG 3.29Å; V101-L105 WeakPolarHBondContact O-CG 3.46Å; V101-L105 PolarHBondContact O-N 3.05Å; V101-V172 HydrophobicContact CG1-CG1 4.38Å |
| 102 | L | 85.6 | Confident | 77.8 | Confident | 17 Ų | 17 | 64 Ų | 64 | 9% | 0.089 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -62.7 | -43 | 178.6 | -64 | -173.8 | 0 | 0 | 0 | 111.4 | L98 L100 L105 Q106 F171 V172 N175 | L98-L102 WeakPolarHBondContact O-CB 3.25Å; L98-L102 WeakPolarHBondContact O-CG 3.32Å; L98-L102 PolarHBondContact O-N 3.5Å; L100-L102 PolarHBondContact O-N 3.38Å; L102-L105 PolarHBondContact O-N 2.99Å; L102-Q106 VanDerWaalsContact O-CG 3.25Å; L102-Q106 WeakPolarHBondContact O-CG 3.39Å; L102-Q106 PolarHBondContact O-N 3.32Å; L102-F171 HydrophobicContact CD1-CE1 3.7Å; L102-F171 HydrophobicContact CD1-CZ 3.56Å; L102-V172 HydrophobicContact CD2-CB 4.48Å; L102-V172 HydrophobicContact CD2-CG1 4.46Å; L102-V172 HydrophobicContact CD2-CG2 4.21Å; L102-N175 HydrophobicContact CD1-CB 4.37Å; L102-N175 HydrophobicContact CD2-CB 3.49Å; L102-N175 VanDerWaalsContact CD2-CB 3.49Å; L102-N175 VanDerWaalsContact CD2-CG 3.49Å; L102-N175 HydrophobicContact CG-CB 4.42Å |
| 103 | N | 81.4 | Confident | 75.4 | Confident | 41 Ų | 41 | 67.1 Ų | 67.1 | 22% | 0.219 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -61.5 | -47.7 | 176.9 | -166.5 | 21.3 | 0 | 0 | 0 | 110.9 | A99 L100 V101 L105 Q106 I107 I122 | A99-N103 WeakPolarHBondContact O-CB 3.47Å; A99-N103 PolarHBondContact O-N 3.32Å; L100-N103 PolarHBondContact O-N 2.86Å; V101-N103 VanDerWaalsContact C-N 3.34Å; V101-N103 PolarHBondContact O-N 2.91Å; N103-L105 VanDerWaalsContact C-N 3.32Å; N103-L105 PolarHBondContact O-N 3.36Å; N103-Q106 CarbonylContact O-C 3.59Å; N103-Q106 WeakPolarHBondContact O-CA 3.01Å; N103-Q106 WeakPolarHBondContact O-CB 3.44Å; N103-Q106 PolarHBondContact O-N 2.98Å; N103-I107 HydrophobicContact CB-CD1 4.42Å; N103-I107 VanDerWaalsContact O-CD1 3.26Å; N103-I107 WeakPolarHBondContact O-CD1 3.32Å; N103-I107 VanDerWaalsContact O-CG1 3.27Å; N103-I107 WeakPolarHBondContact O-CG1 3.4Å; N103-I107 PolarHBondContact O-N 3.43Å; N103-I107 WeakPolarHBondContact OD1-CD1 3.28Å; N103-I122 WeakPolarHBondContact ND2-CG2 3.21Å |
| 104 | L | 78.5 | Confident | 73.2 | Confident | 91 Ų | 91 | 71.1 Ų | 71.1 | 48% | 0.476 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -58.5 | -42.8 | 176.7 | -72.1 | 174.5 | 0 | 0 | 0 | 112.1 | L100 V101 Q106 I107 Q108 | L100-L104 WeakPolarHBondContact O-CB 3.38Å; L100-L104 VanDerWaalsContact O-CG 3.28Å; L100-L104 WeakPolarHBondContact O-CG 3.43Å; L100-L104 PolarHBondContact O-N 3.23Å; V101-L104 PolarHBondContact O-N 2.87Å; L104-Q106 VanDerWaalsContact C-N 3.27Å; L104-Q106 PolarHBondContact O-N 2.92Å; L104-I107 PolarHBondContact O-N 3.33Å; L104-Q108 WeakPolarHBondContact O-CG 3.46Å; L104-Q108 PolarHBondContact O-N 3.4Å |
| 105 | L | 77.6 | Confident | 71.2 | Confident | 49 Ų | 49 | 71.3 Ų | 71.3 | 26% | 0.257 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -64.1 | -32.6 | 176.2 | -70.7 | 172.1 | 0 | 0 | 0 | 112.5 | V101 L102 N103 V172 | V101-L105 HydrophobicContact CG1-CD1 4.02Å; V101-L105 VanDerWaalsContact O-CG 3.29Å; V101-L105 WeakPolarHBondContact O-CG 3.46Å; V101-L105 PolarHBondContact O-N 3.05Å; L102-L105 PolarHBondContact O-N 2.99Å; N103-L105 VanDerWaalsContact C-N 3.32Å; N103-L105 PolarHBondContact O-N 3.36Å; L105-V172 HydrophobicContact CD1-CG1 3.62Å |
| 106 | Q | 70.2 | Confident | 69.5 | Low | 67 Ų | 67 | 79.3 Ų | 79.3 | 31% | 0.313 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -74 | -36.1 | 174.6 | -70.5 | 171.2 | -10.1 | 0 | 0 | 112 | L102 N103 L104 N175 A179 | L102-Q106 VanDerWaalsContact O-CG 3.25Å; L102-Q106 WeakPolarHBondContact O-CG 3.39Å; L102-Q106 PolarHBondContact O-N 3.32Å; N103-Q106 CarbonylContact O-C 3.59Å; N103-Q106 WeakPolarHBondContact O-CA 3.01Å; N103-Q106 WeakPolarHBondContact O-CB 3.44Å; N103-Q106 PolarHBondContact O-N 2.98Å; L104-Q106 VanDerWaalsContact C-N 3.27Å; L104-Q106 PolarHBondContact O-N 2.92Å; Q106-N175 PolarHBondContact NE2-OD1 2.86Å; Q106-A179 HydrophobicContact CG-CB 4.24Å |
| 107 | I | 65.8 | Low | 67.8 | Low | 42 Ų | 42 | 85.1 Ų | 85.1 | 22% | 0.215 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -78.8 | -38 | -177.5 | -67.9 | 152.6 | 0 | 0 | 0 | 113.1 | N103 L104 R109 N110 V118 I122 | N103-I107 HydrophobicContact CB-CD1 4.42Å; N103-I107 VanDerWaalsContact O-CD1 3.26Å; N103-I107 WeakPolarHBondContact O-CD1 3.32Å; N103-I107 VanDerWaalsContact O-CG1 3.27Å; N103-I107 WeakPolarHBondContact O-CG1 3.4Å; N103-I107 PolarHBondContact O-N 3.43Å; N103-I107 WeakPolarHBondContact OD1-CD1 3.28Å; L104-I107 PolarHBondContact O-N 3.33Å; I107-R109 PolarHBondContact O-N 2.9Å; I107-N110 PolarHBondContact O-N 3.17Å; I107-V118 HydrophobicContact CG2-CG1 3.96Å; I107-I122 HydrophobicContact CD1-CD1 3.18Å; I107-I122 HydrophobicContact CD1-CG1 3.88Å; I107-I122 HydrophobicContact CG1-CD1 4.16Å; I107-I122 HydrophobicContact CG2-CD1 4.31Å |
| 108 | Q | 59.7 | Low | 66.3 | Low | 110 Ų | 110 | 83.4 Ų | 83.4 | 51% | 0.514 | 43% | 0.426 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.5 | -14.5 | 178.7 | -78.3 | -158.6 | -0.2 | 0 | 0 | 113.7 | L104 F114 | L104-Q108 WeakPolarHBondContact O-CG 3.46Å; L104-Q108 PolarHBondContact O-N 3.4Å; Q108-F114 HydrophobicContact CG-CZ 3.99Å |
| 109 | R | 57.6 | Low | 64.7 | Low | 145 Ų | 145 | 86.3 Ų | 86.3 | 55% | 0.547 | 44% | 0.441 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81 | -22.6 | 175.8 | -167.2 | -101.2 | -167.9 | 151.2 | 5.1 | 114 | I107 D182 | I107-R109 PolarHBondContact O-N 2.9Å; R109-D182 IonicContact CZ-OD2 3.59Å; R109-D182 IonicContact NH1-OD2 3.51Å; R109-D182 IonicContact NH2-OD2 2.76Å; R109-D182 PolarHBondContact NH2-OD2 2.81Å |
| 110 | N | 50.6 | Low | 63.2 | Low | 137 Ų | 137 | 88.2 Ų | 88.2 | 73% | 0.733 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.8 | -24.4 | -171.6 | -153.6 | 6.2 | 0 | 0 | 0 | 113.6 | I107 | I107-N110 PolarHBondContact O-N 3.17Š|
| 111 | V | 44.9 | Very low | 61.8 | Low | 66 Ų | 66 | 89.3 Ų | 89.3 | 40% | 0.4 | 47% | 0.466 | S | S | . | . | trans | -148.8 | 108.2 | 178.4 | -166.4 | 0 | 0 | 0 | 0 | 109.3 | L113 | V111-L113 HydrophobicContact CG1-CB 4.46Å; V111-L113 VanDerWaalsContact CG1-O 3.25Å; V111-L113 WeakPolarHBondContact CG1-O 3.42Å; V111-L113 PolarHBondContact O-N 3.43Å | ||
| 112 | T | 44.4 | Very low | 60.4 | Low | 132 Ų | 132 | 88.4 Ų | 88.4 | 81% | 0.81 | 46% | 0.459 | S | S | * | . | S | Bend | trans | -77.6 | 11.2 | 176 | 43.7 | 0 | 0 | 0 | 0 | 113.8 | ||
| 113 | L | 45.7 | Very low | 59 | Low | 139 Ų | 139 | 94.4 Ų | 94.4 | 73% | 0.728 | 49% | 0.485 | S | S | * | . | S | Bend | trans | -131.3 | 94.6 | 174.9 | -72.6 | 171 | 0 | 0 | 0 | 107.6 | V111 P115 | V111-L113 HydrophobicContact CG1-CB 4.46Å; V111-L113 VanDerWaalsContact CG1-O 3.25Å; V111-L113 WeakPolarHBondContact CG1-O 3.42Å; V111-L113 PolarHBondContact O-N 3.43Å; L113-P115 WeakPolarHBondContact O-CD 3.23Å; L113-P115 WeakPolarHBondContact O-CG 3.49Å; L113-P115 VanDerWaalsContact O-N 3.07Å |
| 114 | F | 46.3 | Very low | 57.8 | Low | 139 Ų | 139 | 97 Ų | 97 | 61% | 0.61 | 51% | 0.506 | S | S | * | . | trans | -55.2 | 106.5 | -179.8 | -74.1 | -91.6 | 0 | 0 | 0 | 111.8 | Q108 | Q108-F114 HydrophobicContact CG-CZ 3.99Š| ||
| 115 | P | 53.3 | Low | 56.7 | Low | 51 Ų | 51 | 96.9 Ų | 96.9 | 33% | 0.331 | 51% | 0.512 | S | S | . | . | trans | -86.9 | 132.7 | 161.4 | 4.4 | 19.8 | 0 | 0 | 0 | 106.2 | L113 E117 V118 | L113-P115 WeakPolarHBondContact O-CD 3.23Å; L113-P115 WeakPolarHBondContact O-CG 3.49Å; L113-P115 VanDerWaalsContact O-N 3.07Å; P115-E117 HydrophobicContact CB-CB 4.38Å; P115-E117 PolarHBondContact O-N 3.27Å; P115-V118 HydrophobicContact CG-CG2 4.15Å; P115-V118 PolarHBondContact O-N 2.76Å | ||
| 116 | E | 57.7 | Low | 56.2 | Low | 173 Ų | 173 | 96 Ų | 96 | 81% | 0.808 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -52.1 | -22.6 | 175.9 | -69.9 | -168.6 | 153.6 | 0 | 0 | 112.7 | V118 I119 A120 | E116-V118 PolarHBondContact O-N 2.92Å; E116-I119 PolarHBondContact O-N 3.36Å; E116-A120 PolarHBondContact O-N 3.47Å; E116-A120 VanDerWaalsContact O-N 3.16Å |
| 117 | E | 57.9 | Low | 56.6 | Low | 151 Ų | 151 | 100.9 Ų | 100.9 | 71% | 0.706 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -59.9 | -35.2 | 176.8 | -58.2 | -179.1 | 174.6 | 0 | 0 | 114.4 | P115 A120 T121 | P115-E117 HydrophobicContact CB-CB 4.38Å; P115-E117 PolarHBondContact O-N 3.27Å; E117-A120 PolarHBondContact O-N 2.91Å; E117-T121 WeakPolarHBondContact O-CB 3.39Å; E117-T121 PolarHBondContact O-N 2.91Å; E117-T121 PolarHBondContact O-OG1 3.33Å |
| 118 | V | 59 | Low | 57.4 | Low | 50 Ų | 50 | 102.5 Ų | 102.5 | 30% | 0.303 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -72.7 | -40.1 | -178.8 | 177.1 | 0 | 0 | 0 | 0 | 110.7 | I107 P115 E116 A120 T121 I122 | I107-V118 HydrophobicContact CG2-CG1 3.96Å; P115-V118 HydrophobicContact CG-CG2 4.15Å; P115-V118 PolarHBondContact O-N 2.76Å; E116-V118 PolarHBondContact O-N 2.92Å; V118-A120 VanDerWaalsContact C-N 3.35Å; V118-T121 PolarHBondContact O-N 3.27Å; V118-I122 HydrophobicContact CG1-CD1 3.85Å; V118-I122 HydrophobicContact CG1-CG1 4.5Å; V118-I122 WeakPolarHBondContact O-CD1 3.31Å; V118-I122 WeakPolarHBondContact O-CG1 3.25Å; V118-I122 PolarHBondContact O-N 3.46Å |
| 119 | I | 58.9 | Low | 58.6 | Low | 80 Ų | 80 | 99 Ų | 99 | 41% | 0.41 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.8 | -48.3 | 175.1 | -60.1 | 172.8 | 0 | 0 | 0 | 109 | E116 T121 I122 F123 | E116-I119 PolarHBondContact O-N 3.36Å; I119-T121 VanDerWaalsContact C-N 3.32Å; I119-T121 PolarHBondContact O-N 3.25Å; I119-I122 PolarHBondContact O-N 2.87Å; I119-F123 HydrophobicContact CG2-CD2 3.76Å; I119-F123 HydrophobicContact CG2-CE2 3.64Å; I119-F123 WeakPolarHBondContact O-CD2 3.46Å; I119-F123 PolarHBondContact O-N 2.99Å; I119-F123 VanDerWaalsContact O-N 3.08Å |
| 120 | A | 57.9 | Low | 60.1 | Low | 57 Ų | 57 | 92.9 Ų | 92.9 | 47% | 0.471 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.2 | -39.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | E116 E117 V118 F123 S124 | E116-A120 PolarHBondContact O-N 3.47Å; E116-A120 VanDerWaalsContact O-N 3.16Å; E117-A120 PolarHBondContact O-N 2.91Å; V118-A120 VanDerWaalsContact C-N 3.35Å; A120-F123 PolarHBondContact O-N 2.91Å; A120-S124 VanDerWaalsContact O-CB 3.27Å; A120-S124 WeakPolarHBondContact O-CB 3.4Å; A120-S124 PolarHBondContact O-N 2.72Å |
| 121 | T | 57.7 | Low | 61.9 | Low | 84 Ų | 84 | 88.7 Ų | 88.7 | 52% | 0.515 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -68.4 | -34.8 | 178.4 | -56.3 | 0 | 0 | 0 | 0 | 112.3 | E117 V118 I119 S124 S125 | E117-T121 WeakPolarHBondContact O-CB 3.39Å; E117-T121 PolarHBondContact O-N 2.91Å; E117-T121 PolarHBondContact O-OG1 3.33Å; V118-T121 PolarHBondContact O-N 3.27Å; I119-T121 VanDerWaalsContact C-N 3.32Å; I119-T121 PolarHBondContact O-N 3.25Å; T121-S124 PolarHBondContact O-N 2.96Å; T121-S125 WeakPolarHBondContact O-CB 3.21Å; T121-S125 PolarHBondContact O-N 2.96Å |
| 122 | I | 57.5 | Low | 64.1 | Low | 36 Ų | 36 | 88.8 Ų | 88.8 | 19% | 0.185 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -69.3 | -42.2 | 175.1 | -64.9 | 151.9 | 0 | 0 | 0 | 110.8 | N103 I107 V118 I119 S124 A126 W127 | N103-I122 WeakPolarHBondContact ND2-CG2 3.21Å; I107-I122 HydrophobicContact CD1-CD1 3.18Å; I107-I122 HydrophobicContact CD1-CG1 3.88Å; I107-I122 HydrophobicContact CG1-CD1 4.16Å; I107-I122 HydrophobicContact CG2-CD1 4.31Å; V118-I122 HydrophobicContact CG1-CD1 3.85Å; V118-I122 HydrophobicContact CG1-CG1 4.5Å; V118-I122 WeakPolarHBondContact O-CD1 3.31Å; V118-I122 WeakPolarHBondContact O-CG1 3.25Å; V118-I122 PolarHBondContact O-N 3.46Å; I119-I122 PolarHBondContact O-N 2.87Å; I122-S124 PolarHBondContact O-N 2.98Å; I122-A126 CarbonylContact O-C 3.5Å; I122-A126 PolarHBondContact O-N 2.98Å; I122-W127 PolarHBondContact O-N 3.23Å |
| 123 | F | 56.9 | Low | 66.3 | Low | 143 Ų | 143 | 84.9 Ų | 84.9 | 63% | 0.627 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -69.1 | -16.2 | 174.5 | -79.3 | -70.3 | 0 | 0 | 0 | 113.5 | I119 A120 W127 | I119-F123 HydrophobicContact CG2-CD2 3.76Å; I119-F123 HydrophobicContact CG2-CE2 3.64Å; I119-F123 WeakPolarHBondContact O-CD2 3.46Å; I119-F123 PolarHBondContact O-N 2.99Å; I119-F123 VanDerWaalsContact O-N 3.08Å; A120-F123 PolarHBondContact O-N 2.91Å; F123-W127 VanDerWaalsContact O-CB 3.29Å; F123-W127 WeakPolarHBondContact O-CB 3.3Å |
| 124 | S | 56.6 | Low | 68.5 | Low | 94 Ų | 94 | 78.3 Ų | 78.3 | 66% | 0.657 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -106.6 | -33.3 | -179 | -162.8 | 0 | 0 | 0 | 0 | 114.2 | A120 T121 I122 | A120-S124 VanDerWaalsContact O-CB 3.27Å; A120-S124 WeakPolarHBondContact O-CB 3.4Å; A120-S124 PolarHBondContact O-N 2.72Å; T121-S124 PolarHBondContact O-N 2.96Å; I122-S124 PolarHBondContact O-N 2.98Å |
| 125 | S | 55.2 | Low | 70.7 | Confident | 89 Ų | 89 | 75.3 Ų | 75.3 | 62% | 0.622 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -103.2 | -31 | -172 | -163.4 | 0 | 0 | 0 | 0 | 113.3 | T121 | T121-S125 WeakPolarHBondContact O-CB 3.21Å; T121-S125 PolarHBondContact O-N 2.96Å |
| 126 | A | 67.6 | Low | 72.6 | Confident | 30 Ų | 30 | 75.3 Ų | 75.3 | 25% | 0.248 | 42% | 0.42 | C | S | . | . | S | Bend | trans | -124.1 | 23.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | I122 W128 V129 P130 | I122-A126 CarbonylContact O-C 3.5Å; I122-A126 PolarHBondContact O-N 2.98Å; A126-W128 PolarHBondContact O-N 2.82Å; A126-V129 HydrophobicContact CB-CG2 4.1Å; A126-V129 WeakPolarHBondContact O-CB 3.41Å; A126-V129 PolarHBondContact O-N 2.97Å; A126-P130 WeakPolarHBondContact O-CD 3.47Å |
| 127 | W | 78.6 | Confident | 74.3 | Confident | 171 Ų | 171 | 67.5 Ų | 67.5 | 65% | 0.648 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59 | -22.4 | -177.5 | 75.6 | -90.6 | 0 | 0 | 0 | 114.1 | I122 F123 P131 | I122-W127 PolarHBondContact O-N 3.23Å; F123-W127 VanDerWaalsContact O-CB 3.29Å; F123-W127 WeakPolarHBondContact O-CB 3.3Å; W127-P131 WeakPolarHBondContact O-CD 3.17Å; W127-P131 WeakPolarHBondContact O-CG 3.29Å |
| 128 | W | 82.4 | Confident | 76.1 | Confident | 75 Ų | 75 | 60.6 Ų | 60.6 | 28% | 0.284 | 35% | 0.354 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.9 | -20.1 | 178.6 | 61.4 | -95.4 | 0 | 0 | 0 | 113.2 | A126 P131 C132 L228 V233 Y234 | A126-W128 PolarHBondContact O-N 2.82Å; W128-P131 WeakPolarHBondContact O-CD 3.31Å; W128-C132 HydrophobicContact CE3-CB 4.4Å; W128-C132 VanDerWaalsContact O-CB 3.23Å; W128-C132 WeakPolarHBondContact O-CB 3.32Å; W128-C132 PolarHBondContact O-N 3.22Å; W128-L228 HydrophobicContact CH2-CD2 3.39Å; W128-L228 HydrophobicContact CZ2-CD2 4.23Å; W128-L228 HydrophobicContact CZ3-CD2 3.71Å; W128-V233 HydrophobicContact CZ2-CG1 4.36Å; W128-Y234 HydrophobicContact CH2-CD2 4.1Å; W128-Y234 AromaticContact CZ2-CD2 3.99Å; W128-Y234 HydrophobicContact CZ2-CD2 3.99Å |
| 129 | V | 83.9 | Confident | 77.8 | Confident | 38 Ų | 38 | 62.4 Ų | 62.4 | 23% | 0.23 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -66.5 | -51.7 | -175.7 | 178.2 | 0 | 0 | 0 | 0 | 111.4 | A126 C132 C133 | A126-V129 HydrophobicContact CB-CG2 4.1Å; A126-V129 WeakPolarHBondContact O-CB 3.41Å; A126-V129 PolarHBondContact O-N 2.97Å; V129-C132 WeakPolarHBondContact O-CB 3.48Å; V129-C132 PolarHBondContact O-N 3.48Å; V129-C133 PolarHBondContact O-N 3.46Å; V129-C133 PolarHBondContact O-SG 2.9Å; V129-C133 VanDerWaalsContact O-SG 3.39Å |
| 130 | P | 88.6 | Confident | 79.4 | Confident | 15 Ų | 15 | 59.2 Ų | 59.2 | 10% | 0.097 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 179.4 | -18.4 | 30.4 | 0 | 0 | 0 | 114 | V96 A99 L100 A126 C132 C133 G134 | V96-P130 HydrophobicContact CG1-CB 4.08Å; A99-P130 HydrophobicContact CB-CB 4.47Å; L100-P130 HydrophobicContact CD2-CB 4.11Å; L100-P130 HydrophobicContact CD2-CG 3.66Å; L100-P130 HydrophobicContact CG-CB 4.25Å; L100-P130 HydrophobicContact CG-CG 4.32Å; A126-P130 WeakPolarHBondContact O-CD 3.47Å; P130-C132 VanDerWaalsContact C-N 3.33Å; P130-C132 PolarHBondContact O-N 3.24Å; P130-C133 PolarHBondContact O-N 3.43Å; P130-G134 PolarHBondContact O-N 3.46Å |
| 131 | P | 89.5 | Confident | 80.9 | Confident | 49 Ų | 49 | 56.6 Ų | 56.6 | 32% | 0.318 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -59.8 | -38.5 | 172.9 | -25.6 | 34.9 | 0 | 0 | 0 | 113.8 | W127 W128 G134 T135 | W127-P131 WeakPolarHBondContact O-CD 3.17Å; W127-P131 WeakPolarHBondContact O-CG 3.29Å; W128-P131 WeakPolarHBondContact O-CD 3.31Å; P131-G134 PolarHBondContact O-N 2.95Å; P131-T135 WeakPolarHBondContact O-CB 3.38Å; P131-T135 PolarHBondContact O-N 3.05Å; P131-T135 PolarHBondContact O-OG1 2.88Å |
| 132 | C | 89.6 | Confident | 82.6 | Confident | 68 Ų | 68 | 55 Ų | 55 | 46% | 0.459 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63 | -48.6 | 175.9 | -176.6 | 0 | 0 | 0 | 0 | 111 | W128 V129 P130 G134 T135 A136 | W128-C132 HydrophobicContact CE3-CB 4.4Å; W128-C132 VanDerWaalsContact O-CB 3.23Å; W128-C132 WeakPolarHBondContact O-CB 3.32Å; W128-C132 PolarHBondContact O-N 3.22Å; V129-C132 WeakPolarHBondContact O-CB 3.48Å; V129-C132 PolarHBondContact O-N 3.48Å; P130-C132 VanDerWaalsContact C-N 3.33Å; P130-C132 PolarHBondContact O-N 3.24Å; C132-G134 PolarHBondContact O-N 3.37Å; C132-T135 PolarHBondContact O-N 3.31Å; C132-A136 WeakPolarHBondContact O-CB 3.37Å; C132-A136 PolarHBondContact O-N 3.48Å |
| 133 | C | 90.8 | Very high | 84.1 | Confident | 51 Ų | 51 | 56.8 Ų | 56.8 | 35% | 0.345 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -62.8 | -39.9 | 176.1 | -66.8 | 0 | 0 | 0 | 0 | 112.7 | A99 V129 P130 A136 A137 | A99-C133 HydrophobicContact CB-CB 3.59Å; V129-C133 PolarHBondContact O-N 3.46Å; V129-C133 PolarHBondContact O-SG 2.9Å; V129-C133 VanDerWaalsContact O-SG 3.39Å; P130-C133 PolarHBondContact O-N 3.43Å; C133-A136 PolarHBondContact O-N 2.94Å; C133-A137 VanDerWaalsContact O-CB 3.3Å; C133-A137 WeakPolarHBondContact O-CB 3.33Å; C133-A137 PolarHBondContact O-N 3.48Å |
| 134 | G | 92.8 | Very high | 85.6 | Confident | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60 | -45.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | F92 P130 P131 C132 A137 A138 | F92-G134 WeakPolarHBondContact CA-O 3.48Å; P130-G134 PolarHBondContact O-N 3.46Å; P131-G134 PolarHBondContact O-N 2.95Å; C132-G134 PolarHBondContact O-N 3.37Å; G134-A137 PolarHBondContact O-N 3.49Å; G134-A138 PolarHBondContact O-N 2.88Å |
| 135 | T | 93.1 | Very high | 86.9 | Confident | 77 Ų | 77 | 46.4 Ų | 46.4 | 47% | 0.472 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -64.8 | -45.8 | 178.4 | -52.9 | 0 | 0 | 0 | 0 | 111.1 | P131 C132 A137 A138 V139 | P131-T135 WeakPolarHBondContact O-CB 3.38Å; P131-T135 PolarHBondContact O-N 3.05Å; P131-T135 PolarHBondContact O-OG1 2.88Å; C132-T135 PolarHBondContact O-N 3.31Å; T135-A137 VanDerWaalsContact C-N 3.27Å; T135-A137 PolarHBondContact O-N 3.41Å; T135-A138 PolarHBondContact O-N 3Å; T135-V139 WeakPolarHBondContact O-CG2 3.37Å; T135-V139 PolarHBondContact O-N 3.49Å |
| 136 | A | 92.6 | Very high | 88.3 | Confident | 51 Ų | 51 | 46.2 Ų | 46.2 | 42% | 0.421 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -58.9 | -41 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | C132 C133 V139 V140 | C132-A136 WeakPolarHBondContact O-CB 3.37Å; C132-A136 PolarHBondContact O-N 3.48Å; C133-A136 PolarHBondContact O-N 2.94Å; A136-V139 PolarHBondContact O-N 3.49Å; A136-V140 WeakPolarHBondContact O-CB 3.4Å; A136-V140 VanDerWaalsContact O-CG2 3.24Å; A136-V140 WeakPolarHBondContact O-CG2 3.44Å; A136-V140 PolarHBondContact O-N 2.93Å |
| 137 | A | 94.3 | Very high | 89.2 | Confident | 8 Ų | 8 | 47 Ų | 47 | 7% | 0.066 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -64.8 | -41.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | C133 G134 T135 G141 V259 | C133-A137 VanDerWaalsContact O-CB 3.3Å; C133-A137 WeakPolarHBondContact O-CB 3.33Å; C133-A137 PolarHBondContact O-N 3.48Å; G134-A137 PolarHBondContact O-N 3.49Å; T135-A137 VanDerWaalsContact C-N 3.27Å; T135-A137 PolarHBondContact O-N 3.41Å; A137-G141 PolarHBondContact O-N 3.33Å; A137-V259 HydrophobicContact CB-CG1 3.87Å; A137-V259 HydrophobicContact CB-CG2 4.07Å; A137-V259 WeakPolarHBondContact O-CG1 3.31Å |
| 138 | A | 95.1 | Very high | 89.5 | Confident | 7 Ų | 7 | 39.3 Ų | 39.3 | 6% | 0.058 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.3 | -46.9 | 174 | 0 | 0 | 0 | 0 | 0 | 111.7 | L91 F92 G134 T135 L142 | L91-A138 HydrophobicContact CB-CB 4.35Å; F92-A138 HydrophobicContact CB-CB 4.35Å; G134-A138 PolarHBondContact O-N 2.88Å; T135-A138 PolarHBondContact O-N 3Å; A138-L142 WeakPolarHBondContact O-CB 3.29Å; A138-L142 WeakPolarHBondContact O-CG 3.33Å; A138-L142 PolarHBondContact O-N 3.46Å |
| 139 | V | 93.8 | Very high | 89.4 | Confident | 88 Ų | 88 | 40.2 Ų | 40.2 | 53% | 0.533 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.1 | -50.6 | 178.1 | 172.8 | 0 | 0 | 0 | 0 | 111 | T135 A136 L142 L143 | T135-V139 WeakPolarHBondContact O-CG2 3.37Å; T135-V139 PolarHBondContact O-N 3.49Å; A136-V139 PolarHBondContact O-N 3.49Å; V139-L142 PolarHBondContact O-N 3.34Å; V139-L143 VanDerWaalsContact O-CB 3.23Å; V139-L143 WeakPolarHBondContact O-CB 3.34Å; V139-L143 PolarHBondContact O-N 2.86Å |
| 140 | V | 92.4 | Very high | 89.3 | Confident | 13 Ų | 13 | 46.3 Ų | 46.3 | 8% | 0.079 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.3 | -45.3 | -178.5 | 171.4 | 0 | 0 | 0 | 0 | 111.6 | A136 L142 L143 Y144 I217 V259 | A136-V140 WeakPolarHBondContact O-CB 3.4Å; A136-V140 VanDerWaalsContact O-CG2 3.24Å; A136-V140 WeakPolarHBondContact O-CG2 3.44Å; A136-V140 PolarHBondContact O-N 2.93Å; V140-L142 VanDerWaalsContact C-N 3.25Å; V140-L142 PolarHBondContact O-N 3.47Å; V140-L143 PolarHBondContact O-N 2.97Å; V140-Y144 HydrophobicContact CG1-CD2 3.8Å; V140-Y144 HydrophobicContact CG1-CE2 3.68Å; V140-Y144 WeakPolarHBondContact O-CD2 3.33Å; V140-Y144 PolarHBondContact O-N 2.93Å; V140-Y144 VanDerWaalsContact O-N 3.08Å; V140-I217 HydrophobicContact CB-CD1 4.18Å; V140-I217 HydrophobicContact CG1-CD1 3.57Å; V140-I217 HydrophobicContact CG2-CD1 3.51Å; V140-I217 HydrophobicContact CG2-CG1 4.07Å; V140-I217 HydrophobicContact CG2-CG2 4.34Å; V140-V259 HydrophobicContact CB-CG1 4.38Å; V140-V259 HydrophobicContact CG1-CB 4.45Å; V140-V259 HydrophobicContact CG1-CG1 4.36Å |
| 141 | G | 90.9 | Very high | 88.8 | Confident | 1 Ų | 1 | 50.4 Ų | 50.4 | 1% | 0.01 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -66.6 | -25.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | A137 P145 G263 | A137-G141 PolarHBondContact O-N 3.33Å; G141-P145 WeakPolarHBondContact O-CD 3.49Å; G141-G263 WeakPolarHBondContact O-CA 3.3Å |
| 142 | L | 91.4 | Very high | 87.8 | Confident | 52 Ų | 52 | 50.8 Ų | 50.8 | 27% | 0.272 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -84.5 | -34.3 | 171.4 | -67.3 | 173.9 | 0 | 0 | 0 | 112.5 | R87 L91 A138 V139 V140 P145 C146 | R87-L142 HydrophobicContact CB-CD2 4.32Å; L91-L142 HydrophobicContact CD1-CD2 4.32Å; L91-L142 HydrophobicContact CD1-CG 4.21Å; A138-L142 WeakPolarHBondContact O-CB 3.29Å; A138-L142 WeakPolarHBondContact O-CG 3.33Å; A138-L142 PolarHBondContact O-N 3.46Å; V139-L142 PolarHBondContact O-N 3.34Å; V140-L142 VanDerWaalsContact C-N 3.25Å; V140-L142 PolarHBondContact O-N 3.47Å; L142-P145 WeakPolarHBondContact O-CD 3.45Å; L142-C146 PolarHBondContact O-SG 3.35Å |
| 143 | L | 89.1 | Confident | 86.6 | Confident | 72 Ų | 72 | 50.5 Ų | 50.5 | 38% | 0.377 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -68.2 | -39.2 | -178.3 | -174.7 | 63 | 0 | 0 | 0 | 112.4 | V139 V140 C146 I147 L213 | V139-L143 VanDerWaalsContact O-CB 3.23Å; V139-L143 WeakPolarHBondContact O-CB 3.34Å; V139-L143 PolarHBondContact O-N 2.86Å; V140-L143 PolarHBondContact O-N 2.97Å; L143-C146 PolarHBondContact O-N 3.3Å; L143-I147 HydrophobicContact CD1-CD1 3.66Å; L143-I147 HydrophobicContact CD1-CG1 4.08Å; L143-I147 HydrophobicContact CD2-CD1 4.2Å; L143-I147 HydrophobicContact CG-CD1 3.65Å; L143-I147 HydrophobicContact CG-CG1 4.32Å; L143-I147 WeakPolarHBondContact O-CG1 3.4Å; L143-I147 PolarHBondContact O-N 3.29Å; L143-L213 HydrophobicContact CD2-CD2 4.21Å |
| 144 | Y | 88.6 | Confident | 85 | Confident | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -57.3 | -54.7 | -178 | -96.3 | -121.9 | 0 | 0 | 0 | 113.1 | V140 C146 I147 D148 G210 L213 G214 I217 G260 | V140-Y144 HydrophobicContact CG1-CD2 3.8Å; V140-Y144 HydrophobicContact CG1-CE2 3.68Å; V140-Y144 WeakPolarHBondContact O-CD2 3.33Å; V140-Y144 PolarHBondContact O-N 2.93Å; V140-Y144 VanDerWaalsContact O-N 3.08Å; Y144-C146 VanDerWaalsContact C-N 3.32Å; Y144-C146 PolarHBondContact O-N 3.34Å; Y144-I147 PolarHBondContact O-N 3.46Å; Y144-D148 VanDerWaalsContact O-CG 3.24Å; Y144-D148 PolarHBondContact O-N 3.1Å; Y144-G210 PolarHBondContact OH-O 3.46Å; Y144-L213 HydrophobicContact CD1-CD1 4.43Å; Y144-L213 HydrophobicContact CD2-CB 4.15Å; Y144-L213 HydrophobicContact CD2-CD1 3.53Å; Y144-L213 HydrophobicContact CD2-CG 4.47Å; Y144-L213 HydrophobicContact CE2-CB 3.39Å; Y144-L213 HydrophobicContact CE2-CD1 3.67Å; Y144-L213 HydrophobicContact CE2-CG 4.17Å; Y144-L213 HydrophobicContact CG-CD1 3.93Å; Y144-G214 PolarHBondContact OH-N 3.48Å; Y144-G214 VanDerWaalsContact OH-N 3.17Å; Y144-I217 HydrophobicContact CE2-CD1 3.88Å; Y144-G260 VanDerWaalsContact CG-CA 3.47Å |
| 145 | P | 85.4 | Confident | 83.2 | Confident | 20 Ų | 20 | 56.2 Ų | 56.2 | 13% | 0.13 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -58.9 | -37.8 | 176.7 | -25 | 33.4 | 0 | 0 | 0 | 114.2 | G141 L142 S149 A267 | G141-P145 WeakPolarHBondContact O-CD 3.49Å; L142-P145 WeakPolarHBondContact O-CD 3.45Å; P145-S149 WeakPolarHBondContact O-CB 3.22Å; P145-S149 PolarHBondContact O-N 2.8Å; P145-A267 HydrophobicContact CB-CB 3.91Å; P145-A267 HydrophobicContact CG-CB 3.91Å |
| 146 | C | 84.6 | Confident | 81 | Confident | 84 Ų | 84 | 60.9 Ų | 60.9 | 57% | 0.568 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -64.7 | -43.7 | 179.1 | -64.8 | 0 | 0 | 0 | 0 | 111.7 | L142 L143 Y144 S149 H150 | L142-C146 PolarHBondContact O-SG 3.35Å; L143-C146 PolarHBondContact O-N 3.3Å; Y144-C146 VanDerWaalsContact C-N 3.32Å; Y144-C146 PolarHBondContact O-N 3.34Å; C146-S149 WeakPolarHBondContact O-CB 3.48Å; C146-S149 PolarHBondContact O-N 2.92Å; C146-H150 PolarHBondContact O-N 2.88Å |
| 147 | I | 85.9 | Confident | 79 | Confident | 47 Ų | 47 | 66.5 Ų | 66.5 | 24% | 0.241 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -73 | -36.6 | -179.8 | -69.2 | -178.8 | 0 | 0 | 0 | 111.2 | L143 Y144 S149 H150 L151 L213 | L143-I147 HydrophobicContact CD1-CD1 3.66Å; L143-I147 HydrophobicContact CD1-CG1 4.08Å; L143-I147 HydrophobicContact CD2-CD1 4.2Å; L143-I147 HydrophobicContact CG-CD1 3.65Å; L143-I147 HydrophobicContact CG-CG1 4.32Å; L143-I147 WeakPolarHBondContact O-CG1 3.4Å; L143-I147 PolarHBondContact O-N 3.29Å; Y144-I147 PolarHBondContact O-N 3.46Å; I147-S149 VanDerWaalsContact C-N 3.3Å; I147-S149 PolarHBondContact O-N 2.66Å; I147-H150 PolarHBondContact O-N 3.24Å; I147-L151 HydrophobicContact CG2-CD1 3.6Å; I147-L151 HydrophobicContact CG2-CG 4.19Å; I147-L151 WeakPolarHBondContact O-CB 3.28Å; I147-L151 VanDerWaalsContact O-CG 3.31Å; I147-L151 WeakPolarHBondContact O-CG 3.39Å; I147-L151 PolarHBondContact O-N 3.46Å; I147-L213 HydrophobicContact CB-CD1 4.08Å; I147-L213 HydrophobicContact CD1-CD1 3.82Å; I147-L213 HydrophobicContact CD1-CD2 3.38Å; I147-L213 HydrophobicContact CD1-CG 4.13Å; I147-L213 HydrophobicContact CG1-CD1 4.49Å; I147-L213 HydrophobicContact CG2-CD1 4.08Å |
| 148 | D | 83.9 | Confident | 76.9 | Confident | 10 Ų | 10 | 75.8 Ų | 75.8 | 5% | 0.053 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -59.9 | -42.8 | 172.3 | -71.1 | -7.8 | 0 | 0 | 0 | 111.5 | Y144 H150 L151 G152 E153 S209 R264 | Y144-D148 VanDerWaalsContact O-CG 3.24Å; Y144-D148 PolarHBondContact O-N 3.1Å; D148-H150 VanDerWaalsContact C-N 3.34Å; D148-H150 PolarHBondContact O-N 3.34Å; D148-L151 PolarHBondContact O-N 2.95Å; D148-G152 PolarHBondContact O-N 3.19Å; D148-G152 VanDerWaalsContact O-N 3.14Å; D148-E153 PolarHBondContact O-N 3.2Å; D148-S209 WeakPolarHBondContact OD1-CB 3.35Å; D148-S209 PolarHBondContact OD1-OG 3.38Å; D148-R264 IonicContact OD1-CZ 2.98Å; D148-R264 IonicContact OD1-NE 2.66Å; D148-R264 IonicContact OD1-NH2 3.85Å; D148-R264 PolarHBondContact OD1-NH2 3.33Å; D148-R264 IonicContact OD2-CZ 3.98Å; D148-R264 VanDerWaalsContact OD2-CZ 3.29Å; D148-R264 IonicContact OD2-NE 2.91Å; D148-R264 PolarHBondContact OD2-NE 2.81Å; D148-R264 IonicContact OD2-NH2 3.29Å; D148-R264 PolarHBondContact OD2-NH2 2.81Å; D148-R264 VanDerWaalsContact OD2-NH2 3.1Å |
| 149 | S | 80.1 | Confident | 75.4 | Confident | 93 Ų | 93 | 76.8 Ų | 76.8 | 65% | 0.65 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -62.1 | -40.8 | 174.9 | -174.3 | 0 | 0 | 0 | 0 | 112 | P145 C146 I147 G152 | P145-S149 WeakPolarHBondContact O-CB 3.22Å; P145-S149 PolarHBondContact O-N 2.8Å; C146-S149 WeakPolarHBondContact O-CB 3.48Å; C146-S149 PolarHBondContact O-N 2.92Å; I147-S149 VanDerWaalsContact C-N 3.3Å; I147-S149 PolarHBondContact O-N 2.66Å; S149-G152 PolarHBondContact O-N 3.46Å |
| 150 | H | 82.6 | Confident | 74.6 | Confident | 166 Ų | 166 | 79.1 Ų | 79.1 | 77% | 0.769 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -71.5 | -32.8 | 179.5 | -170.9 | -88.8 | 0 | 0 | 0 | 112.6 | C146 I147 D148 G152 | C146-H150 PolarHBondContact O-N 2.88Å; I147-H150 PolarHBondContact O-N 3.24Å; D148-H150 VanDerWaalsContact C-N 3.34Å; D148-H150 PolarHBondContact O-N 3.34Å; H150-G152 VanDerWaalsContact C-N 3.28Å |
| 151 | L | 78.8 | Confident | 74.2 | Confident | 101 Ų | 101 | 85.6 Ų | 85.6 | 53% | 0.529 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -82.9 | -4.8 | 178.2 | -69 | 171.5 | 0 | 0 | 0 | 113.2 | I147 D148 E153 | I147-L151 HydrophobicContact CG2-CD1 3.6Å; I147-L151 HydrophobicContact CG2-CG 4.19Å; I147-L151 WeakPolarHBondContact O-CB 3.28Å; I147-L151 VanDerWaalsContact O-CG 3.31Å; I147-L151 WeakPolarHBondContact O-CG 3.39Å; I147-L151 PolarHBondContact O-N 3.46Å; D148-L151 PolarHBondContact O-N 2.95Å; L151-E153 HydrophobicContact CB-CG 4.3Å; L151-E153 PolarHBondContact O-N 2.83Å; L151-E153 VanDerWaalsContact O-N 3.16Å |
| 152 | G | 67.1 | Low | 74 | Confident | 58 Ų | 58 | 87.4 Ų | 87.4 | 60% | 0.598 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.1 | 21.4 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | D148 S149 H150 P154 | D148-G152 PolarHBondContact O-N 3.19Å; D148-G152 VanDerWaalsContact O-N 3.14Å; S149-G152 PolarHBondContact O-N 3.46Å; H150-G152 VanDerWaalsContact C-N 3.28Å; G152-P154 VanDerWaalsContact O-CD 3.24Å; G152-P154 WeakPolarHBondContact O-CD 3.11Å; G152-P154 VanDerWaalsContact O-N 3.09Å |
| 153 | E | 65.6 | Low | 73.8 | Confident | 61 Ų | 61 | 86.1 Ų | 86.1 | 29% | 0.285 | 45% | 0.445 | S | S | . | . | trans | -64.8 | 112.4 | 173.7 | -78.3 | -93.2 | 152.2 | 0 | 0 | 105.9 | D148 L151 H155 | D148-E153 PolarHBondContact O-N 3.2Å; L151-E153 HydrophobicContact CB-CG 4.3Å; L151-E153 PolarHBondContact O-N 2.83Å; L151-E153 VanDerWaalsContact O-N 3.16Å; E153-H155 PolarHBondContact O-N 3.02Å | ||
| 154 | P | 55.9 | Low | 73.8 | Confident | 77 Ų | 77 | 82.8 Ų | 82.8 | 50% | 0.5 | 43% | 0.427 | S | S | . | . | trans | -62 | 137.1 | -178.4 | 30.4 | -35.8 | 0 | 0 | 0 | 105.9 | G152 K156 | G152-P154 VanDerWaalsContact O-CD 3.24Å; G152-P154 WeakPolarHBondContact O-CD 3.11Å; G152-P154 VanDerWaalsContact O-N 3.09Å; P154-K156 HydrophobicContact CB-CB 4.47Å; P154-K156 HydrophobicContact CB-CD 4.03Å; P154-K156 HydrophobicContact CB-CG 3.85Å; P154-K156 HydrophobicContact CG-CB 4.32Å; P154-K156 HydrophobicContact CG-CD 3.68Å; P154-K156 HydrophobicContact CG-CG 3.93Å; P154-K156 PolarHBondContact O-N 3.18Å | ||
| 155 | H | 56.8 | Low | 73.9 | Confident | 95 Ų | 95 | 88.4 Ų | 88.4 | 44% | 0.44 | 46% | 0.455 | S | S | . | . | trans | -66.4 | 40.6 | 176.2 | -80.1 | 62 | 0 | 0 | 0 | 111.6 | E153 F157 M268 | E153-H155 PolarHBondContact O-N 3.02Å; H155-F157 PolarHBondContact O-N 3.31Å; H155-M268 HydrophobicContact CB-SD 4.31Å | ||
| 156 | K | 46.3 | Very low | 74.2 | Confident | 174 Ų | 174 | 94.6 Ų | 94.6 | 76% | 0.757 | 48% | 0.476 | S | S | * | . | trans | -75.4 | 71 | 177.8 | -79.5 | -177.6 | -172.9 | -174.5 | 0 | 108.6 | P154 | P154-K156 HydrophobicContact CB-CB 4.47Å; P154-K156 HydrophobicContact CB-CD 4.03Å; P154-K156 HydrophobicContact CB-CG 3.85Å; P154-K156 HydrophobicContact CG-CB 4.32Å; P154-K156 HydrophobicContact CG-CD 3.68Å; P154-K156 HydrophobicContact CG-CG 3.93Å; P154-K156 PolarHBondContact O-N 3.18Å | ||
| 157 | F | 49.9 | Very low | 74.5 | Confident | 170 Ų | 170 | 90.6 Ų | 90.6 | 75% | 0.746 | 45% | 0.449 | S | S | * | . | trans | -160.4 | 124.3 | 132.4 | -128.9 | -104.4 | 0 | 0 | 0 | 104.3 | H155 R159 | H155-F157 PolarHBondContact O-N 3.31Å; F157-R159 PolarHBondContact O-N 3.12Å | ||
| 158 | K | 50.9 | Low | 74.8 | Confident | 202 Ų | 202 | 89.9 Ų | 89.9 | 88% | 0.878 | 45% | 0.445 | S | S | * | . | trans | -58.2 | 82.1 | 159 | -79 | -178.7 | 174.8 | -178.7 | 0 | 105.9 | E160 | K158-E160 PolarHBondContact O-N 3.44Å; K158-E160 VanDerWaalsContact O-N 3.09Å | ||
| 159 | R | 62.5 | Low | 75.2 | Confident | 29 Ų | 29 | 92.4 Ų | 92.4 | 11% | 0.109 | 47% | 0.467 | C | S | . | . | trans | -77.8 | 109.2 | -175 | -164 | 177.4 | -158.2 | 153.1 | -5.4 | 103.2 | F157 F204 D205 N261 Q265 M268 | F157-R159 PolarHBondContact O-N 3.12Å; R159-F204 PolarHBondContact NH2-O 3.35Å; R159-D205 IonicContact CZ-OD1 2.91Å; R159-D205 IonicContact NH1-OD1 2.64Å; R159-D205 PolarHBondContact NH1-OD1 3.13Å; R159-D205 VanDerWaalsContact NH2-CA 3.33Å; R159-D205 IonicContact NH2-OD1 3.91Å; R159-N261 VanDerWaalsContact CZ-OD1 3.24Å; R159-N261 PolarHBondContact NH1-OD1 2.62Å; R159-N261 PolarHBondContact NH2-ND2 3.05Å; R159-N261 PolarHBondContact NH2-OD1 2.96Å; R159-Q265 VanDerWaalsContact O-CD 3.31Å; R159-Q265 PolarHBondContact O-NE2 3.42Å; R159-Q265 PolarHBondContact O-OE1 2.63Å; R159-Q265 VanDerWaalsContact O-OE1 3.08Å; R159-M268 HydrophobicContact CB-CE 4.19Å | ||
| 160 | E | 78.6 | Confident | 75.8 | Confident | 137 Ų | 137 | 90.7 Ų | 90.7 | 64% | 0.64 | 45% | 0.453 | S | S | * | . | trans | -70.7 | 145.5 | 176.1 | -66.2 | 177.7 | 168.2 | 0 | 0 | 108.2 | K158 A162 S163 | K158-E160 PolarHBondContact O-N 3.44Å; K158-E160 VanDerWaalsContact O-N 3.09Å; E160-A162 HydrophobicContact CB-CB 4.2Å; E160-A162 PolarHBondContact O-N 3.31Å; E160-S163 WeakPolarHBondContact O-CB 3.32Å; E160-S163 PolarHBondContact O-N 2.89Å | ||
| 161 | W | 84.3 | Confident | 76.3 | Confident | 148 Ų | 148 | 83.3 Ų | 83.3 | 56% | 0.561 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -50.9 | -28.4 | 170.5 | -77.1 | 101.6 | 0 | 0 | 0 | 111.9 | S163 V164 M165 Q265 L266 | W161-S163 VanDerWaalsContact C-N 3.34Å; W161-S163 PolarHBondContact O-N 3.24Å; W161-V164 WeakPolarHBondContact O-CB 3.49Å; W161-V164 PolarHBondContact O-N 2.89Å; W161-M165 WeakPolarHBondContact O-CG 3.49Å; W161-M165 PolarHBondContact O-N 2.86Å; W161-Q265 HydrophobicContact CH2-CB 4.32Å; W161-Q265 HydrophobicContact CZ2-CB 4.45Å; W161-L266 HydrophobicContact CH2-CD2 3.93Å; W161-L266 HydrophobicContact CH2-CG 4.45Å; W161-L266 HydrophobicContact CZ2-CD2 4.49Å |
| 162 | A | 86.7 | Confident | 76.9 | Confident | 40 Ų | 40 | 80 Ų | 80 | 33% | 0.331 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -55.8 | -42.6 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | E160 V164 M165 R166 | E160-A162 HydrophobicContact CB-CB 4.2Å; E160-A162 PolarHBondContact O-N 3.31Å; A162-V164 VanDerWaalsContact C-N 3.33Å; A162-M165 PolarHBondContact O-N 3.37Å; A162-R166 VanDerWaalsContact O-CG 3.26Å; A162-R166 WeakPolarHBondContact O-CG 3.23Å; A162-R166 PolarHBondContact O-N 2.88Å |
| 163 | S | 85.3 | Confident | 78 | Confident | 25 Ų | 25 | 78.9 Ų | 78.9 | 18% | 0.175 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -66.3 | -37.6 | 177.6 | -177.7 | 0 | 0 | 0 | 0 | 111.6 | E160 W161 R166 C167 | E160-S163 WeakPolarHBondContact O-CB 3.32Å; E160-S163 PolarHBondContact O-N 2.89Å; W161-S163 VanDerWaalsContact C-N 3.34Å; W161-S163 PolarHBondContact O-N 3.24Å; S163-R166 PolarHBondContact O-N 3.34Å; S163-C167 WeakPolarHBondContact O-CB 3.4Å; S163-C167 PolarHBondContact O-N 3.05Å |
| 164 | V | 89.6 | Confident | 79.1 | Confident | 2 Ų | 2 | 76.2 Ų | 76.2 | 1% | 0.012 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.5 | -46.8 | 176.7 | -174.1 | 0 | 0 | 0 | 0 | 110.7 | W161 A162 R166 C167 I168 I262 Q265 | W161-V164 WeakPolarHBondContact O-CB 3.49Å; W161-V164 PolarHBondContact O-N 2.89Å; A162-V164 VanDerWaalsContact C-N 3.33Å; V164-R166 VanDerWaalsContact C-N 3.3Å; V164-R166 PolarHBondContact O-N 3.35Å; V164-C167 WeakPolarHBondContact O-CB 3.24Å; V164-C167 PolarHBondContact O-N 2.89Å; V164-C167 VanDerWaalsContact O-N 3.11Å; V164-I168 HydrophobicContact CG1-CD1 4.12Å; V164-I168 WeakPolarHBondContact O-CG1 3.39Å; V164-I168 PolarHBondContact O-N 3.46Å; V164-I262 HydrophobicContact CG1-CG1 3.56Å; V164-Q265 HydrophobicContact CG2-CB 4.46Å; V164-Q265 HydrophobicContact CG2-CG 3.55Å |
| 165 | M | 90.3 | Very high | 80.6 | Confident | 118 Ų | 118 | 72.6 Ų | 72.6 | 58% | 0.581 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -62.3 | -38.7 | 177.8 | -68.4 | -57.5 | -67.7 | 0 | 0 | 111.8 | W161 A162 I168 A169 | W161-M165 WeakPolarHBondContact O-CG 3.49Å; W161-M165 PolarHBondContact O-N 2.86Å; A162-M165 PolarHBondContact O-N 3.37Å; M165-I168 PolarHBondContact O-N 3.25Å; M165-I168 HydrophobicContact SD-CD1 4.14Å; M165-A169 WeakPolarHBondContact O-CB 3.23Å; M165-A169 PolarHBondContact O-N 2.9Å |
| 166 | R | 92 | Very high | 81.9 | Confident | 150 Ų | 150 | 71.6 Ų | 71.6 | 57% | 0.566 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -63.9 | -42 | 172.4 | -69.7 | 172.8 | -162.3 | 153 | 5.6 | 111.8 | A162 S163 V164 A169 V170 F204 | A162-R166 VanDerWaalsContact O-CG 3.26Å; A162-R166 WeakPolarHBondContact O-CG 3.23Å; A162-R166 PolarHBondContact O-N 2.88Å; S163-R166 PolarHBondContact O-N 3.34Å; V164-R166 VanDerWaalsContact C-N 3.3Å; V164-R166 PolarHBondContact O-N 3.35Å; R166-A169 PolarHBondContact O-N 3.22Å; R166-V170 WeakPolarHBondContact O-CG2 3.2Å; R166-V170 PolarHBondContact O-N 3.12Å; R166-F204 HydrophobicContact CB-CD1 4.34Å; R166-F204 HydrophobicContact CB-CE1 3.48Å; R166-F204 VanDerWaalsContact CB-CE1 3.48Å; R166-F204 HydrophobicContact CB-CZ 3.87Å |
| 167 | C | 91.1 | Very high | 83.7 | Confident | 0 Ų | 0 | 64.3 Ų | 64.3 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -60.5 | -45.3 | 175.9 | -170.3 | 0 | 0 | 0 | 0 | 111.5 | S163 V164 V170 F171 F204 T258 N261 | S163-C167 WeakPolarHBondContact O-CB 3.4Å; S163-C167 PolarHBondContact O-N 3.05Å; V164-C167 WeakPolarHBondContact O-CB 3.24Å; V164-C167 PolarHBondContact O-N 2.89Å; V164-C167 VanDerWaalsContact O-N 3.11Å; C167-V170 PolarHBondContact O-N 3.06Å; C167-F171 WeakPolarHBondContact O-CB 3.39Å; C167-F171 PolarHBondContact O-N 2.81Å; C167-F204 HydrophobicContact CB-CB 4.16Å; C167-F204 HydrophobicContact CB-CD1 4.41Å; C167-F204 HydrophobicContact CB-CD2 4.29Å; C167-F204 HydrophobicContact CB-CG 4.01Å; C167-T258 PolarHBondContact SG-OG1 3.17Å; C167-T258 VanDerWaalsContact SG-OG1 3.34Å; C167-N261 PolarHBondContact SG-ND2 2.76Å; C167-N261 VanDerWaalsContact SG-ND2 3.37Å |
| 168 | I | 93.1 | Very high | 85 | Confident | 31 Ų | 31 | 56.5 Ų | 56.5 | 16% | 0.159 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60.2 | -46.7 | 175.3 | -66.5 | 165.3 | 0 | 0 | 0 | 110.6 | L98 V164 M165 V170 F171 V172 T258 I262 | L98-I168 HydrophobicContact CD2-CG2 3.89Å; V164-I168 HydrophobicContact CG1-CD1 4.12Å; V164-I168 WeakPolarHBondContact O-CG1 3.39Å; V164-I168 PolarHBondContact O-N 3.46Å; M165-I168 PolarHBondContact O-N 3.25Å; M165-I168 HydrophobicContact SD-CD1 4.14Å; I168-V170 PolarHBondContact O-N 2.94Å; I168-F171 WeakPolarHBondContact O-CB 3.17Å; I168-F171 PolarHBondContact O-N 3.1Å; I168-V172 HydrophobicContact CG2-CG2 4.39Å; I168-V172 WeakPolarHBondContact O-CG2 3.36Å; I168-V172 PolarHBondContact O-N 2.91Å; I168-T258 HydrophobicContact CB-CG2 4.45Å; I168-T258 HydrophobicContact CG1-CG2 3.69Å; I168-I262 HydrophobicContact CD1-CD1 4.07Å; I168-I262 HydrophobicContact CD1-CG1 4.45Å; I168-I262 HydrophobicContact CG1-CD1 4.28Å |
| 169 | A | 92.5 | Very high | 86.1 | Confident | 64 Ų | 64 | 48 Ų | 48 | 53% | 0.529 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -61.8 | -43.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | M165 R166 G173 | M165-A169 WeakPolarHBondContact O-CB 3.23Å; M165-A169 PolarHBondContact O-N 2.9Å; R166-A169 PolarHBondContact O-N 3.22Å; A169-G173 PolarHBondContact O-N 3.23Å |
| 170 | V | 92.3 | Very high | 86.5 | Confident | 56 Ų | 56 | 53.7 Ų | 53.7 | 34% | 0.339 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -65.9 | -41.4 | 176 | 176.9 | 0 | 0 | 0 | 0 | 110.7 | R166 C167 I168 G173 I174 L200 F204 | R166-V170 WeakPolarHBondContact O-CG2 3.2Å; R166-V170 PolarHBondContact O-N 3.12Å; C167-V170 PolarHBondContact O-N 3.06Å; I168-V170 PolarHBondContact O-N 2.94Å; V170-G173 CarbonylContact O-C 3.54Å; V170-G173 WeakPolarHBondContact O-CA 3.35Å; V170-G173 PolarHBondContact O-N 3.32Å; V170-G173 VanDerWaalsContact O-N 3.16Å; V170-I174 HydrophobicContact CG1-CD1 4Å; V170-I174 HydrophobicContact CG1-CG1 4.28Å; V170-I174 VanDerWaalsContact O-CG1 3.29Å; V170-I174 WeakPolarHBondContact O-CG1 3.33Å; V170-I174 PolarHBondContact O-N 3.45Å; V170-L200 HydrophobicContact CB-CD1 4.24Å; V170-L200 HydrophobicContact CG1-CB 4.39Å; V170-L200 HydrophobicContact CG1-CD1 3.97Å; V170-F204 HydrophobicContact CB-CE2 4.24Å; V170-F204 HydrophobicContact CG2-CE2 3.86Å; V170-F204 HydrophobicContact CG2-CZ 4.04Å |
| 171 | F | 93.1 | Very high | 85.9 | Confident | 11 Ų | 11 | 50.3 Ų | 50.3 | 5% | 0.048 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.2 | -49.3 | 175.7 | 168.9 | -116 | 0 | 0 | 0 | 112.5 | L102 C167 I168 G173 I174 N175 L200 I251 S254 G255 T258 | L102-F171 HydrophobicContact CD1-CE1 3.7Å; L102-F171 HydrophobicContact CD1-CZ 3.56Å; C167-F171 WeakPolarHBondContact O-CB 3.39Å; C167-F171 PolarHBondContact O-N 2.81Å; I168-F171 WeakPolarHBondContact O-CB 3.17Å; I168-F171 PolarHBondContact O-N 3.1Å; F171-G173 VanDerWaalsContact C-N 3.26Å; F171-G173 PolarHBondContact O-N 3Å; F171-I174 PolarHBondContact O-N 3.38Å; F171-N175 PolarHBondContact O-N 2.95Å; F171-L200 HydrophobicContact CB-CD1 4.12Å; F171-I251 HydrophobicContact CE2-CG2 4.26Å; F171-S254 WeakPolarHBondContact CD2-OG 3.31Å; F171-G255 VanDerWaalsContact CE2-N 3.31Å; F171-T258 HydrophobicContact CB-CG2 4.43Å |
| 172 | V | 91.7 | Very high | 84.9 | Confident | 31 Ų | 31 | 47.9 Ų | 47.9 | 19% | 0.188 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.2 | -39.7 | 174.4 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | L98 V101 L102 L105 I168 N175 H176 | L98-V172 HydrophobicContact CD2-CG2 4.21Å; V101-V172 HydrophobicContact CG1-CG1 4.38Å; L102-V172 HydrophobicContact CD2-CB 4.48Å; L102-V172 HydrophobicContact CD2-CG1 4.46Å; L102-V172 HydrophobicContact CD2-CG2 4.21Å; L105-V172 HydrophobicContact CD1-CG1 3.62Å; I168-V172 HydrophobicContact CG2-CG2 4.39Å; I168-V172 WeakPolarHBondContact O-CG2 3.36Å; I168-V172 PolarHBondContact O-N 2.91Å; V172-N175 PolarHBondContact O-N 3.38Å; V172-H176 WeakPolarHBondContact O-CB 3.38Å; V172-H176 PolarHBondContact O-N 3.26Å |
| 173 | G | 90 | Very high | 83.6 | Confident | 36 Ų | 36 | 49 Ų | 49 | 37% | 0.371 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -62.7 | -43.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | A169 V170 F171 N175 H176 A177 | A169-G173 PolarHBondContact O-N 3.23Å; V170-G173 CarbonylContact O-C 3.54Å; V170-G173 WeakPolarHBondContact O-CA 3.35Å; V170-G173 PolarHBondContact O-N 3.32Å; V170-G173 VanDerWaalsContact O-N 3.16Å; F171-G173 VanDerWaalsContact C-N 3.26Å; F171-G173 PolarHBondContact O-N 3Å; G173-N175 VanDerWaalsContact C-N 3.34Å; G173-H176 PolarHBondContact O-N 3.39Å; G173-A177 VanDerWaalsContact O-CB 3.28Å; G173-A177 WeakPolarHBondContact O-CB 3.19Å; G173-A177 PolarHBondContact O-N 3.44Å |
| 174 | I | 89 | Confident | 82.5 | Confident | 4 Ų | 4 | 53.5 Ų | 53.5 | 2% | 0.021 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -61.4 | -45.4 | 174.7 | -68.8 | 169.6 | 0 | 0 | 0 | 109.7 | V170 F171 A177 S178 L193 L196 L200 I251 | V170-I174 HydrophobicContact CG1-CD1 4Å; V170-I174 HydrophobicContact CG1-CG1 4.28Å; V170-I174 VanDerWaalsContact O-CG1 3.29Å; V170-I174 WeakPolarHBondContact O-CG1 3.33Å; V170-I174 PolarHBondContact O-N 3.45Å; F171-I174 PolarHBondContact O-N 3.38Å; I174-A177 PolarHBondContact O-N 2.64Å; I174-S178 PolarHBondContact O-N 2.95Å; I174-L193 HydrophobicContact CG2-CD2 3.64Å; I174-L196 HydrophobicContact CD1-CB 4Å; I174-L196 HydrophobicContact CG1-CB 3.97Å; I174-L196 HydrophobicContact CG1-CD1 4.43Å; I174-L200 HydrophobicContact CD1-CB 4.36Å; I174-L200 HydrophobicContact CD1-CD1 4Å; I174-I251 HydrophobicContact CG2-CD1 3.78Å |
| 175 | N | 86.6 | Confident | 81.7 | Confident | 2 Ų | 2 | 57.5 Ų | 57.5 | 1% | 0.011 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -64.4 | -43.9 | 178.9 | -164.8 | -85.9 | 0 | 0 | 0 | 111.5 | L102 Q106 F171 V172 G173 A177 S178 A179 I251 | L102-N175 HydrophobicContact CD1-CB 4.37Å; L102-N175 HydrophobicContact CD2-CB 3.49Å; L102-N175 VanDerWaalsContact CD2-CB 3.49Å; L102-N175 VanDerWaalsContact CD2-CG 3.49Å; L102-N175 HydrophobicContact CG-CB 4.42Å; Q106-N175 PolarHBondContact NE2-OD1 2.86Å; F171-N175 PolarHBondContact O-N 2.95Å; V172-N175 PolarHBondContact O-N 3.38Å; G173-N175 VanDerWaalsContact C-N 3.34Å; N175-A177 PolarHBondContact O-N 3.24Å; N175-S178 PolarHBondContact O-N 3.14Å; N175-S178 PolarHBondContact O-OG 2.9Å; N175-A179 PolarHBondContact O-N 3Å; N175-A179 VanDerWaalsContact O-N 3.1Å; N175-I251 HydrophobicContact CB-CD1 4.11Å; N175-I251 VanDerWaalsContact ND2-CG2 3.32Å; N175-I251 WeakPolarHBondContact ND2-CG2 3.38Å |
| 176 | H | 84.9 | Confident | 80.8 | Confident | 73 Ų | 73 | 54.9 Ų | 54.9 | 34% | 0.338 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -60.8 | -43.8 | 173.5 | -176.8 | 67.1 | 0 | 0 | 0 | 112 | V172 G173 S178 A179 K180 | V172-H176 WeakPolarHBondContact O-CB 3.38Å; V172-H176 PolarHBondContact O-N 3.26Å; G173-H176 PolarHBondContact O-N 3.39Å; H176-S178 VanDerWaalsContact C-N 3.34Å; H176-S178 PolarHBondContact O-N 3.27Å; H176-A179 PolarHBondContact O-N 3.47Å; H176-K180 VanDerWaalsContact O-CB 3.28Å; H176-K180 WeakPolarHBondContact O-CB 3.34Å; H176-K180 PolarHBondContact O-N 2.85Å |
| 177 | A | 83.6 | Confident | 80.1 | Confident | 22 Ų | 22 | 52.3 Ų | 52.3 | 18% | 0.182 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.6 | -39.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | G173 I174 N175 A179 K180 L181 | G173-A177 VanDerWaalsContact O-CB 3.28Å; G173-A177 WeakPolarHBondContact O-CB 3.19Å; G173-A177 PolarHBondContact O-N 3.44Å; I174-A177 PolarHBondContact O-N 2.64Å; N175-A177 PolarHBondContact O-N 3.24Å; A177-A179 VanDerWaalsContact C-N 3.27Å; A177-A179 PolarHBondContact O-N 3.39Å; A177-K180 PolarHBondContact O-N 3.35Å; A177-L181 HydrophobicContact CB-CD1 4.08Å; A177-L181 VanDerWaalsContact O-CB 3.29Å; A177-L181 WeakPolarHBondContact O-CB 3.3Å; A177-L181 VanDerWaalsContact O-CG 3.31Å; A177-L181 WeakPolarHBondContact O-CG 3.34Å; A177-L181 PolarHBondContact O-N 2.85Å |
| 178 | S | 77.8 | Confident | 79.6 | Confident | 6 Ų | 6 | 57.1 Ų | 57.1 | 4% | 0.042 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -64.9 | -29.9 | 175.6 | 69.3 | 0 | 0 | 0 | 0 | 113.5 | I174 N175 H176 | I174-S178 PolarHBondContact O-N 2.95Å; N175-S178 PolarHBondContact O-N 3.14Å; N175-S178 PolarHBondContact O-OG 2.9Å; H176-S178 VanDerWaalsContact C-N 3.34Å; H176-S178 PolarHBondContact O-N 3.27Å |
| 179 | A | 72.6 | Confident | 78.9 | Confident | 23 Ų | 23 | 55.9 Ų | 55.9 | 19% | 0.19 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -80.5 | -27.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q106 N175 H176 A177 | Q106-A179 HydrophobicContact CG-CB 4.24Å; N175-A179 PolarHBondContact O-N 3Å; N175-A179 VanDerWaalsContact O-N 3.1Å; H176-A179 PolarHBondContact O-N 3.47Å; A177-A179 VanDerWaalsContact C-N 3.27Å; A177-A179 PolarHBondContact O-N 3.39Å |
| 180 | K | 71.1 | Confident | 78.4 | Confident | 149 Ų | 149 | 54.1 Ų | 54.1 | 65% | 0.648 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -95.7 | -30.7 | -173.1 | -170.1 | 171.6 | -178.2 | 175.8 | 0 | 114.4 | H176 A177 D182 | H176-K180 VanDerWaalsContact O-CB 3.28Å; H176-K180 WeakPolarHBondContact O-CB 3.34Å; H176-K180 PolarHBondContact O-N 2.85Å; A177-K180 PolarHBondContact O-N 3.35Å; K180-D182 PolarHBondContact O-N 2.79Å |
| 181 | L | 67.5 | Low | 78.1 | Confident | 65 Ų | 65 | 57.4 Ų | 57.4 | 34% | 0.34 | 33% | 0.328 | S | S | . | . | trans | -90.2 | 91.1 | -177 | -62.8 | 172.9 | 0 | 0 | 0 | 110.2 | A177 F183 L189 | A177-L181 HydrophobicContact CB-CD1 4.08Å; A177-L181 VanDerWaalsContact O-CB 3.29Å; A177-L181 WeakPolarHBondContact O-CB 3.3Å; A177-L181 VanDerWaalsContact O-CG 3.31Å; A177-L181 WeakPolarHBondContact O-CG 3.34Å; A177-L181 PolarHBondContact O-N 2.85Å; L181-F183 VanDerWaalsContact C-N 3.31Å; L181-F183 HydrophobicContact CB-CD2 3.99Å; L181-F183 HydrophobicContact CB-CE2 3.74Å; L181-F183 HydrophobicContact CB-CZ 4.33Å; L181-F183 HydrophobicContact CD1-CE2 3.69Å; L181-F183 HydrophobicContact CD1-CZ 4Å; L181-F183 HydrophobicContact CD2-CE2 4.3Å; L181-F183 HydrophobicContact CD2-CZ 4.05Å; L181-F183 HydrophobicContact CG-CE2 4.11Å; L181-F183 HydrophobicContact CG-CZ 4.35Å; L181-F183 PolarHBondContact O-N 3.29Å; L181-L189 HydrophobicContact CB-CD1 3.79Å; L181-L189 VanDerWaalsContact O-CD1 3.23Å; L181-L189 WeakPolarHBondContact O-CD1 3.37Å | ||
| 182 | D | 63 | Low | 77.8 | Confident | 98 Ų | 98 | 59.3 Ų | 59.3 | 52% | 0.524 | 34% | 0.34 | S | S | . | . | trans | -85 | 79.1 | 162.2 | -113.7 | -35.2 | 0 | 0 | 0 | 107.7 | R109 K180 | R109-D182 IonicContact CZ-OD2 3.59Å; R109-D182 IonicContact NH1-OD2 3.51Å; R109-D182 IonicContact NH2-OD2 2.76Å; R109-D182 PolarHBondContact NH2-OD2 2.81Å; K180-D182 PolarHBondContact O-N 2.79Å | ||
| 183 | F | 59.7 | Low | 77.6 | Confident | 64 Ų | 64 | 57.9 Ų | 57.9 | 28% | 0.281 | 33% | 0.332 | S | S | . | . | trans | -67.5 | 141 | 169.6 | -71.1 | -67 | 0 | 0 | 0 | 108.9 | L181 N185 L189 | L181-F183 VanDerWaalsContact C-N 3.31Å; L181-F183 HydrophobicContact CB-CD2 3.99Å; L181-F183 HydrophobicContact CB-CE2 3.74Å; L181-F183 HydrophobicContact CB-CZ 4.33Å; L181-F183 HydrophobicContact CD1-CE2 3.69Å; L181-F183 HydrophobicContact CD1-CZ 4Å; L181-F183 HydrophobicContact CD2-CE2 4.3Å; L181-F183 HydrophobicContact CD2-CZ 4.05Å; L181-F183 HydrophobicContact CG-CE2 4.11Å; L181-F183 HydrophobicContact CG-CZ 4.35Å; L181-F183 PolarHBondContact O-N 3.29Å; F183-N185 PolarHBondContact O-N 3.16Å; F183-L189 HydrophobicContact CB-CB 4.49Å; F183-L189 HydrophobicContact CD2-CB 3.95Å; F183-L189 HydrophobicContact CD2-CD1 3.8Å; F183-L189 HydrophobicContact CE2-CD1 4.21Å | ||
| 184 | A | 60.3 | Low | 77.6 | Confident | 119 Ų | 119 | 57.8 Ų | 57.8 | 98% | 0.983 | 33% | 0.327 | S | S | * | . | S | Bend | trans | -56.9 | -14.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 185 | N | 73.3 | Confident | 77.7 | Confident | 85 Ų | 85 | 60.5 Ų | 60.5 | 46% | 0.455 | 35% | 0.35 | S | S | . | . | S | Bend | trans | -127.7 | 116.2 | 175.3 | -169.8 | -8.2 | 0 | 0 | 0 | 111.4 | F183 V187 Q188 L189 | F183-N185 PolarHBondContact O-N 3.16Å; N185-V187 PolarHBondContact O-N 2.92Å; N185-V187 VanDerWaalsContact O-N 3.14Å; N185-V187 WeakPolarHBondContact OD1-CB 3.32Å; N185-V187 PolarHBondContact OD1-N 3.01Å; N185-V187 VanDerWaalsContact OD1-N 3.13Å; N185-Q188 HydrophobicContact CB-CB 4.43Å; N185-Q188 WeakPolarHBondContact O-CB 3.4Å; N185-Q188 PolarHBondContact O-N 2.96Å; N185-L189 PolarHBondContact O-N 3.14Å |
| 186 | N | 72.1 | Confident | 77.9 | Confident | 64 Ų | 64 | 64.1 Ų | 64.1 | 34% | 0.342 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -57.1 | -27.1 | 177.7 | -69.5 | -54.8 | 0 | 0 | 0 | 113.3 | S190 | N186-S190 WeakPolarHBondContact O-CB 3.3Å; N186-S190 PolarHBondContact O-N 2.77Å; N186-S190 PolarHBondContact O-OG 2.87Å |
| 187 | V | 76.8 | Confident | 78.2 | Confident | 95 Ų | 95 | 60.7 Ų | 60.7 | 58% | 0.576 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -68 | -40.4 | 176.8 | -179.7 | 0 | 0 | 0 | 0 | 111.2 | N185 S190 L191 | N185-V187 PolarHBondContact O-N 2.92Å; N185-V187 VanDerWaalsContact O-N 3.14Å; N185-V187 WeakPolarHBondContact OD1-CB 3.32Å; N185-V187 PolarHBondContact OD1-N 3.01Å; N185-V187 VanDerWaalsContact OD1-N 3.13Å; V187-S190 PolarHBondContact O-N 3.19Å; V187-L191 VanDerWaalsContact O-CB 3.3Å; V187-L191 WeakPolarHBondContact O-CB 3.37Å; V187-L191 PolarHBondContact O-N 3.43Å |
| 188 | Q | 81.4 | Confident | 78.6 | Confident | 102 Ų | 102 | 64 Ų | 64 | 48% | 0.477 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -68.1 | -40 | 179.1 | -175.3 | 177.2 | -5.9 | 0 | 0 | 111.3 | N185 T192 | N185-Q188 HydrophobicContact CB-CB 4.43Å; N185-Q188 WeakPolarHBondContact O-CB 3.4Å; N185-Q188 PolarHBondContact O-N 2.96Å; Q188-T192 WeakPolarHBondContact O-CB 3.28Å; Q188-T192 PolarHBondContact O-N 3.36Å; Q188-T192 PolarHBondContact O-OG1 2.86Å |
| 189 | L | 78.1 | Confident | 79.3 | Confident | 5 Ų | 5 | 65 Ų | 65 | 3% | 0.026 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -60.3 | -50.8 | 173.6 | -178.8 | 66 | 0 | 0 | 0 | 111 | L181 F183 N185 L191 T192 L193 | L181-L189 HydrophobicContact CB-CD1 3.79Å; L181-L189 VanDerWaalsContact O-CD1 3.23Å; L181-L189 WeakPolarHBondContact O-CD1 3.37Å; F183-L189 HydrophobicContact CB-CB 4.49Å; F183-L189 HydrophobicContact CD2-CB 3.95Å; F183-L189 HydrophobicContact CD2-CD1 3.8Å; F183-L189 HydrophobicContact CE2-CD1 4.21Å; N185-L189 PolarHBondContact O-N 3.14Å; L189-L191 PolarHBondContact O-N 3.36Å; L189-T192 PolarHBondContact O-N 2.85Å; L189-L193 HydrophobicContact CD1-CD1 3.87Å; L189-L193 HydrophobicContact CD1-CG 4.43Å; L189-L193 HydrophobicContact CG-CD1 3.88Å; L189-L193 WeakPolarHBondContact O-CG 3.46Å; L189-L193 PolarHBondContact O-N 2.87Å |
| 190 | S | 82.3 | Confident | 80.1 | Confident | 26 Ų | 26 | 64.1 Ų | 64.1 | 18% | 0.182 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -62.1 | -45 | -178.2 | -60.7 | 0 | 0 | 0 | 0 | 112.3 | N186 V187 T192 L193 A194 S246 | N186-S190 WeakPolarHBondContact O-CB 3.3Å; N186-S190 PolarHBondContact O-N 2.77Å; N186-S190 PolarHBondContact O-OG 2.87Å; V187-S190 PolarHBondContact O-N 3.19Å; S190-T192 VanDerWaalsContact C-N 3.34Å; S190-T192 PolarHBondContact O-N 3.48Å; S190-L193 PolarHBondContact O-N 2.75Å; S190-A194 VanDerWaalsContact O-CB 3.26Å; S190-A194 WeakPolarHBondContact O-CB 3.48Å; S190-A194 PolarHBondContact O-N 2.99Å; S190-S246 WeakPolarHBondContact OG-CB 3.5Å; S190-S246 PolarHBondContact OG-OG 3.45Å; S190-S246 VanDerWaalsContact OG-OG 3.06Å |
| 191 | L | 84.9 | Confident | 81.1 | Confident | 126 Ų | 126 | 58.8 Ų | 58.8 | 66% | 0.66 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -63.8 | -41.1 | 178.2 | -171.3 | 69.6 | 0 | 0 | 0 | 111.5 | V187 L189 A194 A195 | V187-L191 VanDerWaalsContact O-CB 3.3Å; V187-L191 WeakPolarHBondContact O-CB 3.37Å; V187-L191 PolarHBondContact O-N 3.43Å; L189-L191 PolarHBondContact O-N 3.36Å; L191-A194 PolarHBondContact O-N 3.14Å; L191-A195 WeakPolarHBondContact O-CB 3.32Å; L191-A195 PolarHBondContact O-N 2.78Å |
| 192 | T | 88.1 | Confident | 82.2 | Confident | 51 Ų | 51 | 62.4 Ų | 62.4 | 31% | 0.313 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -64 | -46.3 | 177.8 | -57 | 0 | 0 | 0 | 0 | 111.1 | Q188 L189 S190 A195 L196 | Q188-T192 WeakPolarHBondContact O-CB 3.28Å; Q188-T192 PolarHBondContact O-N 3.36Å; Q188-T192 PolarHBondContact O-OG1 2.86Å; L189-T192 PolarHBondContact O-N 2.85Å; S190-T192 VanDerWaalsContact C-N 3.34Å; S190-T192 PolarHBondContact O-N 3.48Å; T192-A195 PolarHBondContact O-N 3.48Å; T192-L196 HydrophobicContact CG2-CD1 4.25Å; T192-L196 WeakPolarHBondContact O-CG 3.41Å; T192-L196 PolarHBondContact O-N 3.49Å |
| 193 | L | 86.6 | Confident | 83.3 | Confident | 1 Ų | 1 | 62.3 Ų | 62.3 | 1% | 0.005 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -68.7 | -35.3 | 179 | -71.8 | 167.7 | 0 | 0 | 0 | 112.3 | I174 L189 S190 L196 S197 W247 C250 | I174-L193 HydrophobicContact CG2-CD2 3.64Å; L189-L193 HydrophobicContact CD1-CD1 3.87Å; L189-L193 HydrophobicContact CD1-CG 4.43Å; L189-L193 HydrophobicContact CG-CD1 3.88Å; L189-L193 WeakPolarHBondContact O-CG 3.46Å; L189-L193 PolarHBondContact O-N 2.87Å; S190-L193 PolarHBondContact O-N 2.75Å; L193-L196 HydrophobicContact CD2-CD1 4.49Å; L193-L196 PolarHBondContact O-N 3.26Å; L193-S197 WeakPolarHBondContact O-CB 3.38Å; L193-S197 PolarHBondContact O-N 2.99Å; L193-S197 PolarHBondContact O-OG 2.96Å; L193-W247 HydrophobicContact CD1-CB 3.32Å; L193-W247 HydrophobicContact CD1-CG 4.22Å; L193-C250 HydrophobicContact CB-CB 4.15Å |
| 194 | A | 89.7 | Confident | 84.6 | Confident | 33 Ų | 33 | 61 Ų | 61 | 27% | 0.273 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -62 | -46.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | S190 L191 L196 S197 L198 | S190-A194 VanDerWaalsContact O-CB 3.26Å; S190-A194 WeakPolarHBondContact O-CB 3.48Å; S190-A194 PolarHBondContact O-N 2.99Å; L191-A194 PolarHBondContact O-N 3.14Å; A194-L196 PolarHBondContact O-N 3.08Å; A194-S197 PolarHBondContact O-N 3.26Å; A194-L198 WeakPolarHBondContact O-CB 3.31Å; A194-L198 VanDerWaalsContact O-CG 3.3Å; A194-L198 WeakPolarHBondContact O-CG 3.29Å; A194-L198 PolarHBondContact O-N 3.49Å |
| 195 | A | 91.3 | Very high | 85.6 | Confident | 62 Ų | 62 | 56.1 Ų | 56.1 | 51% | 0.512 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L191 T192 G199 | L191-A195 WeakPolarHBondContact O-CB 3.32Å; L191-A195 PolarHBondContact O-N 2.78Å; T192-A195 PolarHBondContact O-N 3.48Å; A195-G199 PolarHBondContact O-N 2.91Å |
| 196 | L | 90.9 | Very high | 86.1 | Confident | 77 Ų | 77 | 60.1 Ų | 60.1 | 40% | 0.403 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -65 | -39.4 | 175.9 | -70.4 | 173.3 | 0 | 0 | 0 | 112.2 | I174 T192 L193 A194 G199 L200 | I174-L196 HydrophobicContact CD1-CB 4Å; I174-L196 HydrophobicContact CG1-CB 3.97Å; I174-L196 HydrophobicContact CG1-CD1 4.43Å; T192-L196 HydrophobicContact CG2-CD1 4.25Å; T192-L196 WeakPolarHBondContact O-CG 3.41Å; T192-L196 PolarHBondContact O-N 3.49Å; L193-L196 HydrophobicContact CD2-CD1 4.49Å; L193-L196 PolarHBondContact O-N 3.26Å; A194-L196 PolarHBondContact O-N 3.08Å; L196-G199 PolarHBondContact O-N 3.21Å; L196-L200 WeakPolarHBondContact O-CB 3.41Å; L196-L200 PolarHBondContact O-N 3.33Å |
| 197 | S | 90.9 | Very high | 86.7 | Confident | 2 Ų | 2 | 57.7 Ų | 57.7 | 1% | 0.014 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -69.9 | -42 | 179.7 | -59 | 0 | 0 | 0 | 0 | 111.8 | L193 A194 L200 W201 C250 | L193-S197 WeakPolarHBondContact O-CB 3.38Å; L193-S197 PolarHBondContact O-N 2.99Å; L193-S197 PolarHBondContact O-OG 2.96Å; A194-S197 PolarHBondContact O-N 3.26Å; S197-L200 PolarHBondContact O-N 3.47Å; S197-W201 PolarHBondContact O-N 2.88Å; S197-W201 VanDerWaalsContact O-N 3.1Å; S197-C250 PolarHBondContact OG-O 3.04Å |
| 198 | L | 92 | Very high | 87.1 | Confident | 90 Ų | 90 | 62.5 Ų | 62.5 | 47% | 0.471 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -66.7 | -37.5 | 172.1 | -70.3 | 174.2 | 0 | 0 | 0 | 111.7 | A194 W201 W202 L211 F253 | A194-L198 WeakPolarHBondContact O-CB 3.31Å; A194-L198 VanDerWaalsContact O-CG 3.3Å; A194-L198 WeakPolarHBondContact O-CG 3.29Å; A194-L198 PolarHBondContact O-N 3.49Å; L198-W201 PolarHBondContact O-N 2.95Å; L198-W202 WeakPolarHBondContact O-CB 3.36Å; L198-W202 PolarHBondContact O-N 3.49Å; L198-L211 HydrophobicContact CD2-CD1 4.4Å; L198-F253 HydrophobicContact CD2-CE1 4.5Å; L198-F253 HydrophobicContact CD2-CZ 4.45Å |
| 199 | G | 91.8 | Very high | 87.2 | Confident | 29 Ų | 29 | 57.9 Ų | 57.9 | 30% | 0.299 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -60.9 | -44.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | A195 L196 W201 W202 T203 | A195-G199 PolarHBondContact O-N 2.91Å; L196-G199 PolarHBondContact O-N 3.21Å; G199-W201 PolarHBondContact O-N 3.29Å; G199-W202 PolarHBondContact O-N 2.69Å; G199-T203 VanDerWaalsContact O-CB 3.3Å; G199-T203 WeakPolarHBondContact O-CB 3.49Å; G199-T203 PolarHBondContact O-N 2.85Å; G199-T203 PolarHBondContact O-OG1 3.39Å |
| 200 | L | 91.2 | Very high | 87.6 | Confident | 3 Ų | 3 | 57.7 Ų | 57.7 | 2% | 0.016 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -57.9 | -48.2 | 173.9 | 176.9 | 158 | 0 | 0 | 0 | 111.1 | V170 F171 I174 L196 S197 F204 V257 | V170-L200 HydrophobicContact CB-CD1 4.24Å; V170-L200 HydrophobicContact CG1-CB 4.39Å; V170-L200 HydrophobicContact CG1-CD1 3.97Å; F171-L200 HydrophobicContact CB-CD1 4.12Å; I174-L200 HydrophobicContact CD1-CB 4.36Å; I174-L200 HydrophobicContact CD1-CD1 4Å; L196-L200 WeakPolarHBondContact O-CB 3.41Å; L196-L200 PolarHBondContact O-N 3.33Å; S197-L200 PolarHBondContact O-N 3.47Å; L200-F204 HydrophobicContact CG-CD2 4.06Å; L200-F204 WeakPolarHBondContact O-CB 3.42Å; L200-F204 WeakPolarHBondContact O-CD2 3.46Å; L200-F204 PolarHBondContact O-N 3.41Å; L200-V257 HydrophobicContact CD2-CB 4.22Å; L200-V257 HydrophobicContact CD2-CG1 3.79Å |
| 201 | W | 91.6 | Very high | 88 | Confident | 37 Ų | 37 | 58.8 Ų | 58.8 | 14% | 0.14 | 30% | 0.297 | C | S | . | . | I | π-helix | trans | -59.5 | -49.4 | 176 | 166.7 | 72.9 | 0 | 0 | 0 | 111.2 | S197 L198 G199 T203 D205 R206 S207 L211 F253 | S197-W201 PolarHBondContact O-N 2.88Å; S197-W201 VanDerWaalsContact O-N 3.1Å; L198-W201 PolarHBondContact O-N 2.95Å; G199-W201 PolarHBondContact O-N 3.29Å; W201-T203 PolarHBondContact O-N 2.9Å; W201-D205 CarbonylContact O-C 3.57Å; W201-D205 WeakPolarHBondContact O-CA 3.09Å; W201-D205 PolarHBondContact O-N 2.7Å; W201-R206 PolarHBondContact O-N 3.04Å; W201-S207 PolarHBondContact NE1-O 3.3Å; W201-L211 HydrophobicContact CD2-CB 4.39Å; W201-L211 HydrophobicContact CD2-CD1 3.75Å; W201-L211 HydrophobicContact CE3-CD1 3.84Å; W201-L211 HydrophobicContact CG-CD1 4.35Å; W201-L211 HydrophobicContact CH2-CB 4.39Å; W201-L211 HydrophobicContact CH2-CD1 4.06Å; W201-L211 HydrophobicContact CH2-CD2 3.93Å; W201-L211 HydrophobicContact CH2-CG 4.35Å; W201-L211 HydrophobicContact CZ2-CB 3.64Å; W201-L211 HydrophobicContact CZ2-CD1 4Å; W201-L211 HydrophobicContact CZ2-CD2 4Å; W201-L211 HydrophobicContact CZ2-CG 4.08Å; W201-L211 HydrophobicContact CZ3-CD1 3.98Å; W201-L211 HydrophobicContact CZ3-CD2 4.5Å; W201-F253 HydrophobicContact CB-CE1 3.94Å; W201-F253 HydrophobicContact CB-CZ 3.98Å; W201-F253 HydrophobicContact CG-CZ 4.24Å |
| 202 | W | 89.8 | Confident | 88.3 | Confident | 141 Ų | 141 | 54.5 Ų | 54.5 | 53% | 0.534 | 28% | 0.284 | S | S | . | . | I | π-helix | trans | -62 | -41.9 | -178.5 | -179.1 | -99.5 | 0 | 0 | 0 | 113.3 | L198 G199 | L198-W202 WeakPolarHBondContact O-CB 3.36Å; L198-W202 PolarHBondContact O-N 3.49Å; G199-W202 PolarHBondContact O-N 2.69Å |
| 203 | T | 87.4 | Confident | 88.4 | Confident | 96 Ų | 96 | 53 Ų | 53 | 59% | 0.589 | 27% | 0.274 | S | S | * | . | I | π-helix | trans | -78.4 | -44.4 | -175.7 | -62.2 | 0 | 0 | 0 | 0 | 112.4 | G199 W201 | G199-T203 VanDerWaalsContact O-CB 3.3Å; G199-T203 WeakPolarHBondContact O-CB 3.49Å; G199-T203 PolarHBondContact O-N 2.85Å; G199-T203 PolarHBondContact O-OG1 3.39Å; W201-T203 PolarHBondContact O-N 2.9Å |
| 204 | F | 85.2 | Confident | 88.6 | Confident | 36 Ų | 36 | 53 Ų | 53 | 16% | 0.158 | 27% | 0.274 | C | S | . | . | I | π-helix | trans | -97.5 | -38.1 | -171.2 | -63.3 | -70 | 0 | 0 | 0 | 112.6 | R159 R166 C167 V170 L200 | R159-F204 PolarHBondContact NH2-O 3.35Å; R166-F204 HydrophobicContact CB-CD1 4.34Å; R166-F204 HydrophobicContact CB-CE1 3.48Å; R166-F204 VanDerWaalsContact CB-CE1 3.48Å; R166-F204 HydrophobicContact CB-CZ 3.87Å; C167-F204 HydrophobicContact CB-CB 4.16Å; C167-F204 HydrophobicContact CB-CD1 4.41Å; C167-F204 HydrophobicContact CB-CD2 4.29Å; C167-F204 HydrophobicContact CB-CG 4.01Å; V170-F204 HydrophobicContact CB-CE2 4.24Å; V170-F204 HydrophobicContact CG2-CE2 3.86Å; V170-F204 HydrophobicContact CG2-CZ 4.04Å; L200-F204 HydrophobicContact CG-CD2 4.06Å; L200-F204 WeakPolarHBondContact O-CB 3.42Å; L200-F204 WeakPolarHBondContact O-CD2 3.46Å; L200-F204 PolarHBondContact O-N 3.41Å |
| 205 | D | 81.4 | Confident | 88.8 | Confident | 18 Ų | 18 | 56 Ų | 56 | 10% | 0.096 | 28% | 0.284 | C | S | . | . | I | π-helix | trans | -108 | -49.1 | -168.7 | -168.1 | 47 | 0 | 0 | 0 | 114.8 | R159 W201 S207 V257 N261 R264 | R159-D205 IonicContact CZ-OD1 2.91Å; R159-D205 IonicContact NH1-OD1 2.64Å; R159-D205 PolarHBondContact NH1-OD1 3.13Å; R159-D205 VanDerWaalsContact NH2-CA 3.33Å; R159-D205 IonicContact NH2-OD1 3.91Å; W201-D205 CarbonylContact O-C 3.57Å; W201-D205 WeakPolarHBondContact O-CA 3.09Å; W201-D205 PolarHBondContact O-N 2.7Å; D205-S207 PolarHBondContact O-N 3.03Å; D205-S207 PolarHBondContact OD2-OG 3.14Å; D205-V257 HydrophobicContact CB-CG1 3.79Å; D205-N261 PolarHBondContact OD1-OD1 3.39Å; D205-R264 IonicContact OD1-CZ 3.95Å; D205-R264 IonicContact OD1-NH1 3.99Å; D205-R264 PolarHBondContact OD1-NH1 2.78Å; D205-R264 IonicContact OD2-CZ 3.73Å; D205-R264 IonicContact OD2-NH1 3.1Å; D205-R264 PolarHBondContact OD2-NH1 2.86Å |
| 206 | R | 84.6 | Confident | 88.8 | Confident | 168 Ų | 168 | 57.3 Ų | 57.3 | 63% | 0.634 | 29% | 0.286 | S | S | * | . | trans | 52.8 | 7.9 | 178 | -157.1 | 176.9 | 173 | 121.3 | -1.7 | 115.4 | W201 | W201-R206 PolarHBondContact O-N 3.04Š| ||
| 207 | S | 84.4 | Confident | 88.9 | Confident | 13 Ų | 13 | 55.1 Ų | 55.1 | 9% | 0.091 | 27% | 0.274 | C | S | . | . | trans | -87.7 | 143.2 | -175.3 | 78 | 0 | 0 | 0 | 0 | 111.8 | W201 D205 S209 G210 L211 R264 | W201-S207 PolarHBondContact NE1-O 3.3Å; D205-S207 PolarHBondContact O-N 3.03Å; D205-S207 PolarHBondContact OD2-OG 3.14Å; S207-S209 PolarHBondContact OG-OG 3.04Å; S207-G210 PolarHBondContact O-N 2.96Å; S207-G210 VanDerWaalsContact OG-CA 3.26Å; S207-G210 WeakPolarHBondContact OG-CA 3.32Å; S207-G210 PolarHBondContact OG-N 3.32Å; S207-L211 PolarHBondContact O-N 2.97Å; S207-R264 PolarHBondContact OG-NH1 2.84Å; S207-R264 PolarHBondContact OG-NH2 3.49Å | ||
| 208 | R | 84.9 | Confident | 88.9 | Confident | 196 Ų | 196 | 55.4 Ų | 55.4 | 74% | 0.74 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -68.8 | -41.7 | 177.8 | -63.9 | 174.3 | 68.1 | -173.1 | 1.2 | 111.5 | G210 L211 G212 | R208-G210 VanDerWaalsContact C-N 3.32Å; R208-G210 PolarHBondContact O-N 3.36Å; R208-L211 PolarHBondContact O-N 3.23Å; R208-G212 PolarHBondContact O-N 3.13Å |
| 209 | S | 84.8 | Confident | 88.9 | Confident | 6 Ų | 6 | 57.7 Ų | 57.7 | 4% | 0.042 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61.1 | -40.2 | 174 | 50.8 | 0 | 0 | 0 | 0 | 111.8 | D148 S207 L211 G212 L213 R264 | D148-S209 WeakPolarHBondContact OD1-CB 3.35Å; D148-S209 PolarHBondContact OD1-OG 3.38Å; S207-S209 PolarHBondContact OG-OG 3.04Å; S209-L211 PolarHBondContact O-N 2.84Å; S209-G212 PolarHBondContact O-N 3.49Å; S209-L213 VanDerWaalsContact O-CB 3.27Å; S209-L213 WeakPolarHBondContact O-CB 3.32Å; S209-L213 VanDerWaalsContact O-CG 3.28Å; S209-L213 WeakPolarHBondContact O-CG 3.42Å; S209-L213 PolarHBondContact O-N 3.41Å; S209-R264 PolarHBondContact OG-NH2 3.43Å |
| 210 | G | 86.2 | Confident | 88.9 | Confident | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -67.6 | -34.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y144 S207 R208 G214 | Y144-G210 PolarHBondContact OH-O 3.46Å; S207-G210 PolarHBondContact O-N 2.96Å; S207-G210 VanDerWaalsContact OG-CA 3.26Å; S207-G210 WeakPolarHBondContact OG-CA 3.32Å; S207-G210 PolarHBondContact OG-N 3.32Å; R208-G210 VanDerWaalsContact C-N 3.32Å; R208-G210 PolarHBondContact O-N 3.36Å; G210-G214 WeakPolarHBondContact O-CA 3.26Å; G210-G214 PolarHBondContact O-N 3.04Å |
| 211 | L | 90.3 | Very high | 88.8 | Confident | 49 Ų | 49 | 61.7 Ų | 61.7 | 26% | 0.257 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -66.4 | -52.3 | 171.8 | -171.8 | 72.1 | 0 | 0 | 0 | 111.1 | L198 W201 S207 R208 S209 G214 I215 F253 | L198-L211 HydrophobicContact CD2-CD1 4.4Å; W201-L211 HydrophobicContact CD2-CB 4.39Å; W201-L211 HydrophobicContact CD2-CD1 3.75Å; W201-L211 HydrophobicContact CE3-CD1 3.84Å; W201-L211 HydrophobicContact CG-CD1 4.35Å; W201-L211 HydrophobicContact CH2-CB 4.39Å; W201-L211 HydrophobicContact CH2-CD1 4.06Å; W201-L211 HydrophobicContact CH2-CD2 3.93Å; W201-L211 HydrophobicContact CH2-CG 4.35Å; W201-L211 HydrophobicContact CZ2-CB 3.64Å; W201-L211 HydrophobicContact CZ2-CD1 4Å; W201-L211 HydrophobicContact CZ2-CD2 4Å; W201-L211 HydrophobicContact CZ2-CG 4.08Å; W201-L211 HydrophobicContact CZ3-CD1 3.98Å; W201-L211 HydrophobicContact CZ3-CD2 4.5Å; S207-L211 PolarHBondContact O-N 2.97Å; R208-L211 PolarHBondContact O-N 3.23Å; S209-L211 PolarHBondContact O-N 2.84Å; L211-G214 PolarHBondContact O-N 3.41Å; L211-I215 HydrophobicContact CD1-CD1 4.26Å; L211-I215 HydrophobicContact CG-CD1 3.99Å; L211-I215 VanDerWaalsContact O-CG1 3.31Å; L211-I215 WeakPolarHBondContact O-CG1 3.43Å; L211-I215 PolarHBondContact O-N 2.94Å; L211-F253 HydrophobicContact CD1-CE2 4.18Å; L211-F253 HydrophobicContact CD1-CZ 3.95Å |
| 212 | G | 90.9 | Very high | 88.7 | Confident | 36 Ų | 36 | 61.2 Ų | 61.2 | 37% | 0.371 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.8 | -46.5 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | R208 S209 T216 | R208-G212 PolarHBondContact O-N 3.13Å; S209-G212 PolarHBondContact O-N 3.49Å; G212-T216 WeakPolarHBondContact O-CB 3.46Å; G212-T216 PolarHBondContact O-N 2.92Å; G212-T216 PolarHBondContact O-OG1 3.29Å |
| 213 | L | 89.9 | Confident | 88.6 | Confident | 21 Ų | 21 | 58.6 Ų | 58.6 | 11% | 0.11 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -67.9 | -41.1 | 176.5 | -67 | 172 | 0 | 0 | 0 | 111.9 | L143 Y144 I147 S209 I215 T216 I217 | L143-L213 HydrophobicContact CD2-CD2 4.21Å; Y144-L213 HydrophobicContact CD1-CD1 4.43Å; Y144-L213 HydrophobicContact CD2-CB 4.15Å; Y144-L213 HydrophobicContact CD2-CD1 3.53Å; Y144-L213 HydrophobicContact CD2-CG 4.47Å; Y144-L213 HydrophobicContact CE2-CB 3.39Å; Y144-L213 HydrophobicContact CE2-CD1 3.67Å; Y144-L213 HydrophobicContact CE2-CG 4.17Å; Y144-L213 HydrophobicContact CG-CD1 3.93Å; I147-L213 HydrophobicContact CB-CD1 4.08Å; I147-L213 HydrophobicContact CD1-CD1 3.82Å; I147-L213 HydrophobicContact CD1-CD2 3.38Å; I147-L213 HydrophobicContact CD1-CG 4.13Å; I147-L213 HydrophobicContact CG1-CD1 4.49Å; I147-L213 HydrophobicContact CG2-CD1 4.08Å; S209-L213 VanDerWaalsContact O-CB 3.27Å; S209-L213 WeakPolarHBondContact O-CB 3.32Å; S209-L213 VanDerWaalsContact O-CG 3.28Å; S209-L213 WeakPolarHBondContact O-CG 3.42Å; S209-L213 PolarHBondContact O-N 3.41Å; L213-I215 VanDerWaalsContact C-N 3.34Å; L213-I215 PolarHBondContact O-N 3.45Å; L213-T216 PolarHBondContact O-N 2.77Å; L213-I217 HydrophobicContact CB-CD1 4.36Å; L213-I217 WeakPolarHBondContact O-CB 3.31Å; L213-I217 VanDerWaalsContact O-CD1 3.31Å; L213-I217 WeakPolarHBondContact O-CD1 3.27Å; L213-I217 WeakPolarHBondContact O-CG1 3.28Å; L213-I217 PolarHBondContact O-N 2.98Å |
| 214 | G | 91.4 | Very high | 88.6 | Confident | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -57.6 | -46.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | Y144 G210 L211 A218 | Y144-G214 PolarHBondContact OH-N 3.48Å; Y144-G214 VanDerWaalsContact OH-N 3.17Å; G210-G214 WeakPolarHBondContact O-CA 3.26Å; G210-G214 PolarHBondContact O-N 3.04Å; L211-G214 PolarHBondContact O-N 3.41Å; G214-A218 VanDerWaalsContact O-CB 3.23Å; G214-A218 WeakPolarHBondContact O-CB 3.3Å; G214-A218 PolarHBondContact O-N 3.29Å |
| 215 | I | 93.3 | Very high | 88.4 | Confident | 97 Ų | 97 | 57.4 Ų | 57.4 | 50% | 0.497 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63.9 | -45.3 | 177.3 | -68.9 | 167.9 | 0 | 0 | 0 | 110.6 | L211 L213 I217 A218 F219 F253 | L211-I215 HydrophobicContact CD1-CD1 4.26Å; L211-I215 HydrophobicContact CG-CD1 3.99Å; L211-I215 VanDerWaalsContact O-CG1 3.31Å; L211-I215 WeakPolarHBondContact O-CG1 3.43Å; L211-I215 PolarHBondContact O-N 2.94Å; L213-I215 VanDerWaalsContact C-N 3.34Å; L213-I215 PolarHBondContact O-N 3.45Å; I215-I217 PolarHBondContact O-N 3.04Å; I215-A218 PolarHBondContact O-N 3.38Å; I215-F219 WeakPolarHBondContact O-CB 3.48Å; I215-F219 PolarHBondContact O-N 2.96Å; I215-F253 HydrophobicContact CG1-CD2 4.11Å; I215-F253 HydrophobicContact CG1-CE2 3.91Å |
| 216 | T | 92.4 | Very high | 88.4 | Confident | 88 Ų | 88 | 59.1 Ų | 59.1 | 54% | 0.54 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -61.7 | -46.2 | -179.4 | -56.1 | 0 | 0 | 0 | 0 | 111.3 | G212 L213 F219 L220 | G212-T216 WeakPolarHBondContact O-CB 3.46Å; G212-T216 PolarHBondContact O-N 2.92Å; G212-T216 PolarHBondContact O-OG1 3.29Å; L213-T216 PolarHBondContact O-N 2.77Å; T216-F219 PolarHBondContact O-N 2.89Å; T216-L220 WeakPolarHBondContact O-CB 3.23Å; T216-L220 PolarHBondContact O-N 3.34Å |
| 217 | I | 92.1 | Very high | 88.2 | Confident | 32 Ų | 32 | 57.5 Ų | 57.5 | 16% | 0.164 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -65.1 | -43.6 | 177.7 | -66.6 | 158.4 | 0 | 0 | 0 | 110.4 | V140 Y144 L213 I215 F219 L220 A221 | V140-I217 HydrophobicContact CB-CD1 4.18Å; V140-I217 HydrophobicContact CG1-CD1 3.57Å; V140-I217 HydrophobicContact CG2-CD1 3.51Å; V140-I217 HydrophobicContact CG2-CG1 4.07Å; V140-I217 HydrophobicContact CG2-CG2 4.34Å; Y144-I217 HydrophobicContact CE2-CD1 3.88Å; L213-I217 HydrophobicContact CB-CD1 4.36Å; L213-I217 WeakPolarHBondContact O-CB 3.31Å; L213-I217 VanDerWaalsContact O-CD1 3.31Å; L213-I217 WeakPolarHBondContact O-CD1 3.27Å; L213-I217 WeakPolarHBondContact O-CG1 3.28Å; L213-I217 PolarHBondContact O-N 2.98Å; I215-I217 PolarHBondContact O-N 3.04Å; I217-F219 VanDerWaalsContact C-N 3.33Å; I217-F219 PolarHBondContact O-N 3.08Å; I217-L220 PolarHBondContact O-N 3.15Å; I217-A221 WeakPolarHBondContact O-CB 3.48Å; I217-A221 PolarHBondContact O-N 2.93Å |
| 218 | A | 92.4 | Very high | 88 | Confident | 7 Ų | 7 | 58.7 Ų | 58.7 | 6% | 0.058 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.7 | -45 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112 | G214 I215 T222 P249 F252 F253 | G214-A218 VanDerWaalsContact O-CB 3.23Å; G214-A218 WeakPolarHBondContact O-CB 3.3Å; G214-A218 PolarHBondContact O-N 3.29Å; I215-A218 PolarHBondContact O-N 3.38Å; A218-T222 WeakPolarHBondContact O-CB 3.47Å; A218-T222 PolarHBondContact O-N 3.39Å; A218-T222 PolarHBondContact O-OG1 3.18Å; A218-P249 WeakPolarHBondContact CB-O 3.38Å; A218-F252 HydrophobicContact CB-CB 4.18Å; A218-F253 HydrophobicContact CB-CB 3.87Å |
| 219 | F | 91.3 | Very high | 87.6 | Confident | 138 Ų | 138 | 50.2 Ų | 50.2 | 61% | 0.605 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -64.3 | -50.6 | 176.7 | -176.6 | -106.2 | 0 | 0 | 0 | 111.7 | I215 T216 I217 A221 T222 L223 | I215-F219 WeakPolarHBondContact O-CB 3.48Å; I215-F219 PolarHBondContact O-N 2.96Å; T216-F219 PolarHBondContact O-N 2.89Å; I217-F219 VanDerWaalsContact C-N 3.33Å; I217-F219 PolarHBondContact O-N 3.08Å; F219-A221 PolarHBondContact O-N 2.87Å; F219-T222 PolarHBondContact O-N 2.91Å; F219-L223 HydrophobicContact CD1-CD1 3.92Å; F219-L223 HydrophobicContact CD1-CG 4.45Å; F219-L223 HydrophobicContact CE1-CD1 3.38Å; F219-L223 HydrophobicContact CE1-CG 4.13Å; F219-L223 HydrophobicContact CZ-CD1 3.73Å; F219-L223 HydrophobicContact CZ-CD2 4.33Å; F219-L223 HydrophobicContact CZ-CG 4.15Å; F219-L223 WeakPolarHBondContact O-CG 3.44Å; F219-L223 PolarHBondContact O-N 2.98Å |
| 220 | L | 91.8 | Very high | 87.1 | Confident | 97 Ų | 97 | 59.3 Ų | 59.3 | 51% | 0.508 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.1 | -45.5 | -179.6 | -178.2 | 61.5 | 0 | 0 | 0 | 112.2 | T216 I217 T222 L223 I224 | T216-L220 WeakPolarHBondContact O-CB 3.23Å; T216-L220 PolarHBondContact O-N 3.34Å; I217-L220 PolarHBondContact O-N 3.15Å; L220-T222 VanDerWaalsContact C-N 3.31Å; L220-T222 PolarHBondContact O-N 3.48Å; L220-L223 PolarHBondContact O-N 2.9Å; L220-I224 HydrophobicContact CD1-CD1 4.22Å; L220-I224 HydrophobicContact CD1-CG1 4.45Å; L220-I224 HydrophobicContact CG-CD1 3.94Å; L220-I224 VanDerWaalsContact O-CG1 3.29Å; L220-I224 WeakPolarHBondContact O-CG1 3.44Å; L220-I224 PolarHBondContact O-N 3.11Å |
| 221 | A | 89.3 | Confident | 86.7 | Confident | 20 Ų | 20 | 63.5 Ų | 63.5 | 17% | 0.165 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -63.9 | -37.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | I217 F219 I224 T225 F252 | I217-A221 WeakPolarHBondContact O-CB 3.48Å; I217-A221 PolarHBondContact O-N 2.93Å; F219-A221 PolarHBondContact O-N 2.87Å; A221-I224 PolarHBondContact O-N 2.92Å; A221-T225 WeakPolarHBondContact O-CB 3.45Å; A221-T225 PolarHBondContact O-N 3.24Å; A221-T225 PolarHBondContact O-OG1 3.33Å; A221-F252 HydrophobicContact CB-CB 4.12Å; A221-F252 HydrophobicContact CB-CD1 3.92Å; A221-F252 HydrophobicContact CB-CD2 3.6Å; A221-F252 HydrophobicContact CB-CE1 4.19Å; A221-F252 HydrophobicContact CB-CE2 3.88Å; A221-F252 HydrophobicContact CB-CG 3.63Å; A221-F252 HydrophobicContact CB-CZ 4.17Å |
| 222 | T | 88.6 | Confident | 85.7 | Confident | 26 Ų | 26 | 63.2 Ų | 63.2 | 16% | 0.16 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -65.3 | -43.2 | 174.7 | -55.1 | 0 | 0 | 0 | 0 | 111 | A218 F219 L220 T225 Q226 I244 P249 | A218-T222 WeakPolarHBondContact O-CB 3.47Å; A218-T222 PolarHBondContact O-N 3.39Å; A218-T222 PolarHBondContact O-OG1 3.18Å; F219-T222 PolarHBondContact O-N 2.91Å; L220-T222 VanDerWaalsContact C-N 3.31Å; L220-T222 PolarHBondContact O-N 3.48Å; T222-T225 PolarHBondContact O-N 2.93Å; T222-Q226 WeakPolarHBondContact O-CB 3.38Å; T222-Q226 PolarHBondContact O-N 3.2Å; T222-I244 HydrophobicContact CG2-CD1 3.88Å; T222-I244 HydrophobicContact CG2-CG2 4.34Å; T222-I244 VanDerWaalsContact O-CD1 3.31Å; T222-I244 WeakPolarHBondContact O-CD1 3.47Å; T222-P249 HydrophobicContact CG2-CG 4.13Å |
| 223 | L | 88.3 | Confident | 84.7 | Confident | 87 Ų | 87 | 65.9 Ų | 65.9 | 46% | 0.455 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.4 | -43.2 | 175.3 | -71.6 | -178.2 | 0 | 0 | 0 | 112.7 | F219 L220 T225 Q226 F227 | F219-L223 HydrophobicContact CD1-CD1 3.92Å; F219-L223 HydrophobicContact CD1-CG 4.45Å; F219-L223 HydrophobicContact CE1-CD1 3.38Å; F219-L223 HydrophobicContact CE1-CG 4.13Å; F219-L223 HydrophobicContact CZ-CD1 3.73Å; F219-L223 HydrophobicContact CZ-CD2 4.33Å; F219-L223 HydrophobicContact CZ-CG 4.15Å; F219-L223 WeakPolarHBondContact O-CG 3.44Å; F219-L223 PolarHBondContact O-N 2.98Å; L220-L223 PolarHBondContact O-N 2.9Å; L223-T225 VanDerWaalsContact C-N 3.34Å; L223-Q226 WeakPolarHBondContact O-CB 3.33Å; L223-Q226 PolarHBondContact O-N 3.03Å; L223-F227 PolarHBondContact O-N 2.93Å |
| 224 | I | 86.6 | Confident | 83.5 | Confident | 86 Ų | 86 | 68.4 Ų | 68.4 | 44% | 0.441 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -60.2 | -48.7 | 175.7 | -70.1 | 166.4 | 0 | 0 | 0 | 109.4 | L220 A221 Q226 F227 L228 | L220-I224 HydrophobicContact CD1-CD1 4.22Å; L220-I224 HydrophobicContact CD1-CG1 4.45Å; L220-I224 HydrophobicContact CG-CD1 3.94Å; L220-I224 VanDerWaalsContact O-CG1 3.29Å; L220-I224 WeakPolarHBondContact O-CG1 3.44Å; L220-I224 PolarHBondContact O-N 3.11Å; A221-I224 PolarHBondContact O-N 2.92Å; I224-Q226 PolarHBondContact O-N 2.96Å; I224-F227 WeakPolarHBondContact O-CB 3.36Å; I224-F227 PolarHBondContact O-N 2.77Å; I224-F227 VanDerWaalsContact O-N 3.12Å; I224-L228 HydrophobicContact CG2-CD1 3.6Å; I224-L228 WeakPolarHBondContact O-CD1 3.46Å; I224-L228 PolarHBondContact O-N 3.07Å |
| 225 | T | 81.7 | Confident | 82 | Confident | 20 Ų | 20 | 75.2 Ų | 75.2 | 12% | 0.123 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -57.6 | -41 | 176.8 | -54.1 | 0 | 0 | 0 | 0 | 111.1 | A221 T222 L223 F227 L228 V229 Y236 I244 | A221-T225 WeakPolarHBondContact O-CB 3.45Å; A221-T225 PolarHBondContact O-N 3.24Å; A221-T225 PolarHBondContact O-OG1 3.33Å; T222-T225 PolarHBondContact O-N 2.93Å; L223-T225 VanDerWaalsContact C-N 3.34Å; T225-F227 VanDerWaalsContact C-N 3.33Å; T225-F227 PolarHBondContact O-N 2.96Å; T225-L228 PolarHBondContact O-N 3.37Å; T225-V229 VanDerWaalsContact O-CG2 3.32Å; T225-V229 WeakPolarHBondContact O-CG2 3.41Å; T225-V229 PolarHBondContact O-N 2.9Å; T225-Y236 HydrophobicContact CG2-CE2 3.85Å; T225-I244 HydrophobicContact CG2-CD1 4.1Å; T225-I244 HydrophobicContact CG2-CG1 4.36Å |
| 226 | Q | 80.7 | Confident | 80.3 | Confident | 55 Ų | 55 | 72.8 Ų | 72.8 | 26% | 0.257 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -63.2 | -43.4 | 178.6 | -173.4 | 66.5 | 15.9 | 0 | 0 | 111 | T222 L223 I224 V229 Y230 L242 I244 | T222-Q226 WeakPolarHBondContact O-CB 3.38Å; T222-Q226 PolarHBondContact O-N 3.2Å; L223-Q226 WeakPolarHBondContact O-CB 3.33Å; L223-Q226 PolarHBondContact O-N 3.03Å; I224-Q226 PolarHBondContact O-N 2.96Å; Q226-V229 PolarHBondContact O-N 3.34Å; Q226-Y230 WeakPolarHBondContact O-CB 3.46Å; Q226-Y230 PolarHBondContact O-N 3.49Å; Q226-L242 VanDerWaalsContact CD-O 3.27Å; Q226-L242 PolarHBondContact NE2-O 3.27Å; Q226-L242 PolarHBondContact OE1-O 3.14Å; Q226-I244 HydrophobicContact CB-CD1 3.69Å; Q226-I244 HydrophobicContact CG-CD1 4.46Å |
| 227 | F | 81.6 | Confident | 78.3 | Confident | 133 Ų | 133 | 75.7 Ų | 75.7 | 58% | 0.583 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -63.7 | -42.2 | 176.9 | -175.6 | -99.4 | 0 | 0 | 0 | 111.6 | L223 I224 T225 V229 Y230 N231 | L223-F227 PolarHBondContact O-N 2.93Å; I224-F227 WeakPolarHBondContact O-CB 3.36Å; I224-F227 PolarHBondContact O-N 2.77Å; I224-F227 VanDerWaalsContact O-N 3.12Å; T225-F227 VanDerWaalsContact C-N 3.33Å; T225-F227 PolarHBondContact O-N 2.96Å; F227-V229 VanDerWaalsContact C-N 3.34Å; F227-V229 PolarHBondContact O-N 3.18Å; F227-Y230 PolarHBondContact O-N 3.26Å; F227-N231 WeakPolarHBondContact CD1-ND2 3.34Å; F227-N231 VanDerWaalsContact CE1-ND2 3.26Å; F227-N231 WeakPolarHBondContact CE1-ND2 3.29Å; F227-N231 VanDerWaalsContact CE2-ND2 3.34Å; F227-N231 WeakPolarHBondContact CE2-ND2 3.19Å; F227-N231 WeakPolarHBondContact CZ-ND2 3.35Å; F227-N231 PolarHBondContact O-N 3.39Å; F227-N231 PolarHBondContact O-ND2 2.92Å |
| 228 | L | 79.5 | Confident | 76.2 | Confident | 39 Ų | 39 | 76.7 Ų | 76.7 | 20% | 0.204 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -63.5 | -39.6 | 176.5 | -88.2 | 77.3 | 0 | 0 | 0 | 112.2 | W128 I224 T225 G232 V233 Y234 | W128-L228 HydrophobicContact CH2-CD2 3.39Å; W128-L228 HydrophobicContact CZ2-CD2 4.23Å; W128-L228 HydrophobicContact CZ3-CD2 3.71Å; I224-L228 HydrophobicContact CG2-CD1 3.6Å; I224-L228 WeakPolarHBondContact O-CD1 3.46Å; I224-L228 PolarHBondContact O-N 3.07Å; T225-L228 PolarHBondContact O-N 3.37Å; L228-G232 PolarHBondContact O-N 3.05Å; L228-V233 HydrophobicContact CD2-CG1 4.5Å; L228-V233 PolarHBondContact O-N 2.91Å; L228-Y234 PolarHBondContact O-N 2.66Å |
| 229 | V | 77.3 | Confident | 74.4 | Confident | 17 Ų | 17 | 79.7 Ų | 79.7 | 10% | 0.103 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -66.1 | -44 | 175.8 | 173.5 | 0 | 0 | 0 | 0 | 111 | T225 Q226 F227 N231 G232 Y234 Y236 | T225-V229 VanDerWaalsContact O-CG2 3.32Å; T225-V229 WeakPolarHBondContact O-CG2 3.41Å; T225-V229 PolarHBondContact O-N 2.9Å; Q226-V229 PolarHBondContact O-N 3.34Å; F227-V229 VanDerWaalsContact C-N 3.34Å; F227-V229 PolarHBondContact O-N 3.18Å; V229-N231 VanDerWaalsContact C-N 3.32Å; V229-N231 PolarHBondContact O-N 2.86Å; V229-G232 PolarHBondContact O-N 2.9Å; V229-Y234 WeakPolarHBondContact CA-O 3.38Å; V229-Y234 HydrophobicContact CG2-CD1 3.98Å; V229-Y236 HydrophobicContact CG2-CD2 3.9Å; V229-Y236 HydrophobicContact CG2-CE2 3.98Å |
| 230 | Y | 74.2 | Confident | 72.9 | Confident | 197 Ų | 197 | 75.1 Ų | 75.1 | 77% | 0.773 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -62.2 | -37.9 | 178.3 | -176.5 | -100.2 | 0 | 0 | 0 | 112.9 | Q226 F227 G232 | Q226-Y230 WeakPolarHBondContact O-CB 3.46Å; Q226-Y230 PolarHBondContact O-N 3.49Å; F227-Y230 PolarHBondContact O-N 3.26Å; Y230-G232 PolarHBondContact O-N 3.1Å |
| 231 | N | 77.9 | Confident | 70.8 | Confident | 88 Ų | 88 | 78.9 Ų | 78.9 | 47% | 0.471 | 41% | 0.41 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.7 | 2.6 | 175.8 | -72.9 | -87 | 0 | 0 | 0 | 113.5 | F227 V229 V233 | F227-N231 WeakPolarHBondContact CD1-ND2 3.34Å; F227-N231 VanDerWaalsContact CE1-ND2 3.26Å; F227-N231 WeakPolarHBondContact CE1-ND2 3.29Å; F227-N231 VanDerWaalsContact CE2-ND2 3.34Å; F227-N231 WeakPolarHBondContact CE2-ND2 3.19Å; F227-N231 WeakPolarHBondContact CZ-ND2 3.35Å; F227-N231 PolarHBondContact O-N 3.39Å; F227-N231 PolarHBondContact O-ND2 2.92Å; V229-N231 VanDerWaalsContact C-N 3.32Å; V229-N231 PolarHBondContact O-N 2.86Å; N231-V233 HydrophobicContact CB-CG2 4.25Å; N231-V233 PolarHBondContact O-N 3.19Å |
| 232 | G | 67.8 | Low | 68.7 | Low | 44 Ų | 44 | 84.5 Ų | 84.5 | 45% | 0.454 | 44% | 0.437 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.1 | 7.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | L228 V229 Y230 Y234 | L228-G232 PolarHBondContact O-N 3.05Å; V229-G232 PolarHBondContact O-N 2.9Å; Y230-G232 PolarHBondContact O-N 3.1Å; G232-Y234 VanDerWaalsContact C-N 3.31Å |
| 233 | V | 71.9 | Confident | 66.9 | Low | 91 Ų | 91 | 91.1 Ų | 91.1 | 55% | 0.552 | 46% | 0.46 | S | S | * | . | S | Bend | trans | -72.6 | -28.1 | 178.4 | -179.7 | 0 | 0 | 0 | 0 | 111.2 | W128 L228 N231 | W128-V233 HydrophobicContact CZ2-CG1 4.36Å; L228-V233 HydrophobicContact CD2-CG1 4.5Å; L228-V233 PolarHBondContact O-N 2.91Å; N231-V233 HydrophobicContact CB-CG2 4.25Å; N231-V233 PolarHBondContact O-N 3.19Å |
| 234 | Y | 64.6 | Low | 65.5 | Low | 74 Ų | 74 | 87.4 Ų | 87.4 | 29% | 0.29 | 44% | 0.441 | S | S | . | . | S | Bend | trans | -133 | 137.1 | 178.9 | -167.4 | -84.9 | 0 | 0 | 0 | 110.9 | W128 L228 V229 G232 Y236 | W128-Y234 HydrophobicContact CH2-CD2 4.1Å; W128-Y234 AromaticContact CZ2-CD2 3.99Å; W128-Y234 HydrophobicContact CZ2-CD2 3.99Å; L228-Y234 PolarHBondContact O-N 2.66Å; V229-Y234 WeakPolarHBondContact CA-O 3.38Å; V229-Y234 HydrophobicContact CG2-CD1 3.98Å; G232-Y234 VanDerWaalsContact C-N 3.31Å; Y234-Y236 AromaticContact CD1-CD2 3.83Å; Y234-Y236 HydrophobicContact CD1-CD2 3.83Å; Y234-Y236 HydrophobicContact CD1-CE1 4.5Å; Y234-Y236 AromaticContact CD1-CE2 3.57Å; Y234-Y236 HydrophobicContact CD1-CE2 3.57Å; Y234-Y236 HydrophobicContact CD1-CG 4.38Å; Y234-Y236 AromaticContact CD1-CZ 3.92Å; Y234-Y236 AromaticContact CE1-CD1 3.74Å; Y234-Y236 HydrophobicContact CE1-CD1 3.74Å; Y234-Y236 AromaticContact CE1-CD2 3.6Å; Y234-Y236 HydrophobicContact CE1-CD2 3.6Å; Y234-Y236 AromaticContact CE1-CE1 3.43Å; Y234-Y236 HydrophobicContact CE1-CE1 3.43Å; Y234-Y236 VanDerWaalsContact CE1-CE1 3.43Å; Y234-Y236 AromaticContact CE1-CE2 3.28Å; Y234-Y236 HydrophobicContact CE1-CE2 3.28Å; Y234-Y236 AromaticContact CE1-CG 3.8Å; Y234-Y236 HydrophobicContact CE1-CG 3.8Å; Y234-Y236 AromaticContact CE1-CZ 3.17Å; Y234-Y236 AromaticContact CZ-CE1 3.94Å; Y234-Y236 AromaticContact CZ-CZ 3.86Å |
| 235 | Q | 58.9 | Low | 64.6 | Low | 143 Ų | 143 | 85.2 Ų | 85.2 | 67% | 0.668 | 43% | 0.427 | S | S | * | . | trans | -126.5 | 125.9 | -179.5 | -71.1 | -75.7 | -29 | 0 | 0 | 109.8 | ||||
| 236 | Y | 57.3 | Low | 64.2 | Low | 46 Ų | 46 | 85.8 Ų | 85.8 | 18% | 0.18 | 43% | 0.431 | C | S | . | . | trans | -93.2 | 132.3 | 170.5 | -77 | -76.1 | 0 | 0 | 0 | 110 | T225 V229 Y234 S238 L248 | T225-Y236 HydrophobicContact CG2-CE2 3.85Å; V229-Y236 HydrophobicContact CG2-CD2 3.9Å; V229-Y236 HydrophobicContact CG2-CE2 3.98Å; Y234-Y236 AromaticContact CD1-CD2 3.83Å; Y234-Y236 HydrophobicContact CD1-CD2 3.83Å; Y234-Y236 HydrophobicContact CD1-CE1 4.5Å; Y234-Y236 AromaticContact CD1-CE2 3.57Å; Y234-Y236 HydrophobicContact CD1-CE2 3.57Å; Y234-Y236 HydrophobicContact CD1-CG 4.38Å; Y234-Y236 AromaticContact CD1-CZ 3.92Å; Y234-Y236 AromaticContact CE1-CD1 3.74Å; Y234-Y236 HydrophobicContact CE1-CD1 3.74Å; Y234-Y236 AromaticContact CE1-CD2 3.6Å; Y234-Y236 HydrophobicContact CE1-CD2 3.6Å; Y234-Y236 AromaticContact CE1-CE1 3.43Å; Y234-Y236 HydrophobicContact CE1-CE1 3.43Å; Y234-Y236 VanDerWaalsContact CE1-CE1 3.43Å; Y234-Y236 AromaticContact CE1-CE2 3.28Å; Y234-Y236 HydrophobicContact CE1-CE2 3.28Å; Y234-Y236 AromaticContact CE1-CG 3.8Å; Y234-Y236 HydrophobicContact CE1-CG 3.8Å; Y234-Y236 AromaticContact CE1-CZ 3.17Å; Y234-Y236 AromaticContact CZ-CE1 3.94Å; Y234-Y236 AromaticContact CZ-CZ 3.86Å; Y236-S238 PolarHBondContact O-N 2.91Å; Y236-L248 HydrophobicContact CE1-CD1 3.95Å; Y236-L248 HydrophobicContact CE2-CD1 4.03Å; Y236-L248 VanDerWaalsContact CZ-CD1 3.47Å; Y236-L248 VanDerWaalsContact OH-CD1 3.25Å; Y236-L248 WeakPolarHBondContact OH-CD1 3.32Å | ||
| 237 | T | 50.3 | Low | 64 | Low | 149 Ų | 149 | 84.3 Ų | 84.3 | 91% | 0.914 | 42% | 0.424 | S | S | * | . | S | Bend | trans | -62.9 | -22.6 | -179 | -41.5 | 0 | 0 | 0 | 0 | 113.4 | ||
| 238 | S | 48.1 | Very low | 63.9 | Low | 53 Ų | 53 | 78.5 Ų | 78.5 | 37% | 0.371 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -151.5 | 99.5 | 174.2 | 45.1 | 0 | 0 | 0 | 0 | 111.6 | Y236 R245 | Y236-S238 PolarHBondContact O-N 2.91Å; S238-R245 WeakPolarHBondContact O-CD 3.48Å; S238-R245 PolarHBondContact OG-NH1 2.64Å |
| 239 | P | 55.9 | Low | 64.3 | Low | 71 Ų | 71 | 78.8 Ų | 78.8 | 46% | 0.461 | 40% | 0.403 | S | S | . | . | trans | -74.1 | 140.9 | 173.7 | 27 | -30.5 | 0 | 0 | 0 | 111.6 | ||||
| 240 | D | 58.1 | Low | 64.8 | Low | 41 Ų | 41 | 78.9 Ų | 78.9 | 22% | 0.219 | 40% | 0.404 | C | S | . | . | trans | -98.5 | -100 | 177.2 | -58.7 | -25.8 | 0 | 0 | 0 | 110.6 | I244 R245 S246 | D240-I244 PolarHBondContact N-O 2.86Å; D240-R245 IonicContact OD1-NH1 2.76Å; D240-R245 PolarHBondContact OD1-NH1 3.49Å; D240-R245 WeakPolarHBondContact OD2-CD 3.34Å; D240-R245 IonicContact OD2-NH1 3.8Å; D240-S246 PolarHBondContact OD2-N 3.02Å; D240-S246 PolarHBondContact OD2-OG 3.17Å | ||
| 241 | F | 48.3 | Very low | 65.5 | Low | 176 Ų | 176 | 70.1 Ų | 70.1 | 77% | 0.772 | 37% | 0.37 | S | S | * | . | B | Isolated β-bridge | trans | -97.6 | 112.2 | 179 | -111.2 | -103.1 | 0 | 0 | 0 | 107.8 | ||
| 242 | L | 45.8 | Very low | 66.2 | Low | 138 Ų | 138 | 68.5 Ų | 68.5 | 72% | 0.723 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.8 | 32.8 | 175.7 | -49 | 166.9 | 0 | 0 | 0 | 117.4 | Q226 I244 | Q226-L242 VanDerWaalsContact CD-O 3.27Å; Q226-L242 PolarHBondContact NE2-O 3.27Å; Q226-L242 PolarHBondContact OE1-O 3.14Å; L242-I244 PolarHBondContact O-N 3.1Å |
| 243 | Y | 51 | Low | 67.4 | Low | 166 Ų | 166 | 67.1 Ų | 67.1 | 65% | 0.651 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.4 | 3.6 | -179 | -61.1 | -94.8 | 0 | 0 | 0 | 115.7 | ||
| 244 | I | 57.5 | Low | 68.4 | Low | 9 Ų | 9 | 62.8 Ų | 62.8 | 5% | 0.046 | 31% | 0.314 | C | S | . | . | B | Isolated β-bridge | trans | -123.4 | 152.1 | 174.6 | -80.3 | 174.4 | 0 | 0 | 0 | 110.5 | T222 T225 Q226 D240 L242 L248 | T222-I244 HydrophobicContact CG2-CD1 3.88Å; T222-I244 HydrophobicContact CG2-CG2 4.34Å; T222-I244 VanDerWaalsContact O-CD1 3.31Å; T222-I244 WeakPolarHBondContact O-CD1 3.47Å; T225-I244 HydrophobicContact CG2-CD1 4.1Å; T225-I244 HydrophobicContact CG2-CG1 4.36Å; Q226-I244 HydrophobicContact CB-CD1 3.69Å; Q226-I244 HydrophobicContact CG-CD1 4.46Å; D240-I244 PolarHBondContact N-O 2.86Å; L242-I244 PolarHBondContact O-N 3.1Å; I244-L248 HydrophobicContact CG2-CB 4.05Å; I244-L248 HydrophobicContact CG2-CD1 3.6Å; I244-L248 HydrophobicContact CG2-CG 4.45Å |
| 245 | R | 69.3 | Low | 69.8 | Low | 40 Ų | 40 | 59.8 Ų | 59.8 | 15% | 0.151 | 31% | 0.306 | C | S | . | . | trans | -73 | 126 | 175.5 | -151.6 | 69.9 | 147.8 | 151.1 | 0.3 | 110.6 | S238 D240 W247 L248 | S238-R245 WeakPolarHBondContact O-CD 3.48Å; S238-R245 PolarHBondContact OG-NH1 2.64Å; D240-R245 IonicContact OD1-NH1 2.76Å; D240-R245 PolarHBondContact OD1-NH1 3.49Å; D240-R245 WeakPolarHBondContact OD2-CD 3.34Å; D240-R245 IonicContact OD2-NH1 3.8Å; R245-W247 HydrophobicContact CB-CD2 4.4Å; R245-W247 HydrophobicContact CB-CZ2 4.23Å; R245-W247 VanDerWaalsContact CG-CD1 3.43Å; R245-W247 HydrophobicContact CG-CD2 4.08Å; R245-W247 HydrophobicContact CG-CG 4.12Å; R245-W247 HydrophobicContact CG-CZ2 3.83Å; R245-W247 PolarHBondContact O-N 3.28Å; R245-L248 HydrophobicContact CB-CD1 3.74Å; R245-L248 HydrophobicContact CB-CG 4.27Å; R245-L248 WeakPolarHBondContact O-CB 3.22Å; R245-L248 PolarHBondContact O-N 2.87Å | ||
| 246 | S | 71.4 | Confident | 71.4 | Confident | 31 Ų | 31 | 53.2 Ų | 53.2 | 22% | 0.217 | 28% | 0.277 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | -19.8 | -169.5 | 52.9 | 0 | 0 | 0 | 0 | 115.5 | S190 D240 | S190-S246 WeakPolarHBondContact OG-CB 3.5Å; S190-S246 PolarHBondContact OG-OG 3.45Å; S190-S246 VanDerWaalsContact OG-OG 3.06Å; D240-S246 PolarHBondContact OD2-N 3.02Å; D240-S246 PolarHBondContact OD2-OG 3.17Å |
| 247 | W | 76.5 | Confident | 73.1 | Confident | 25 Ų | 25 | 51 Ų | 51 | 10% | 0.095 | 27% | 0.268 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.8 | -14.6 | 176.6 | 53.9 | -108.3 | 0 | 0 | 0 | 115.9 | L193 R245 C250 I251 | L193-W247 HydrophobicContact CD1-CB 3.32Å; L193-W247 HydrophobicContact CD1-CG 4.22Å; R245-W247 HydrophobicContact CB-CD2 4.4Å; R245-W247 HydrophobicContact CB-CZ2 4.23Å; R245-W247 VanDerWaalsContact CG-CD1 3.43Å; R245-W247 HydrophobicContact CG-CD2 4.08Å; R245-W247 HydrophobicContact CG-CG 4.12Å; R245-W247 HydrophobicContact CG-CZ2 3.83Å; R245-W247 PolarHBondContact O-N 3.28Å; W247-C250 WeakPolarHBondContact O-CB 3.33Å; W247-C250 PolarHBondContact O-N 2.89Å; W247-C250 VanDerWaalsContact O-N 3.12Å; W247-I251 HydrophobicContact CE3-CB 4.44Å; W247-I251 HydrophobicContact CE3-CG1 3.55Å; W247-I251 HydrophobicContact CZ3-CG1 3.91Å; W247-I251 PolarHBondContact O-N 3.27Å |
| 248 | L | 81.1 | Confident | 75.1 | Confident | 10 Ų | 10 | 44 Ų | 44 | 5% | 0.052 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -58.6 | -44.2 | -174.5 | -84.8 | 157.5 | 0 | 0 | 0 | 114.3 | Y236 I244 R245 C250 I251 F252 | Y236-L248 HydrophobicContact CE1-CD1 3.95Å; Y236-L248 HydrophobicContact CE2-CD1 4.03Å; Y236-L248 VanDerWaalsContact CZ-CD1 3.47Å; Y236-L248 VanDerWaalsContact OH-CD1 3.25Å; Y236-L248 WeakPolarHBondContact OH-CD1 3.32Å; I244-L248 HydrophobicContact CG2-CB 4.05Å; I244-L248 HydrophobicContact CG2-CD1 3.6Å; I244-L248 HydrophobicContact CG2-CG 4.45Å; R245-L248 HydrophobicContact CB-CD1 3.74Å; R245-L248 HydrophobicContact CB-CG 4.27Å; R245-L248 WeakPolarHBondContact O-CB 3.22Å; R245-L248 PolarHBondContact O-N 2.87Å; L248-C250 PolarHBondContact O-N 2.9Å; L248-I251 PolarHBondContact O-N 3.45Å; L248-I251 VanDerWaalsContact O-N 3.1Å; L248-F252 HydrophobicContact CB-CE2 4.21Å; L248-F252 HydrophobicContact CD2-CE2 4.18Å; L248-F252 HydrophobicContact CD2-CZ 4.09Å; L248-F252 WeakPolarHBondContact O-CD2 3.49Å; L248-F252 PolarHBondContact O-N 3.01Å |
| 249 | P | 86.8 | Confident | 77.2 | Confident | 46 Ų | 46 | 42.2 Ų | 42.2 | 30% | 0.299 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -58.1 | -35.4 | 176.7 | -24.6 | 33.6 | 0 | 0 | 0 | 112.8 | A218 T222 F252 F253 | A218-P249 WeakPolarHBondContact CB-O 3.38Å; T222-P249 HydrophobicContact CG2-CG 4.13Å; P249-F252 PolarHBondContact O-N 2.95Å; P249-F253 WeakPolarHBondContact O-CB 3.48Å; P249-F253 PolarHBondContact O-N 2.88Å |
| 250 | C | 88.6 | Confident | 78.9 | Confident | 19 Ų | 19 | 38.8 Ų | 38.8 | 13% | 0.128 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -68.9 | -38.9 | 178.3 | -62 | 0 | 0 | 0 | 0 | 111.7 | L193 S197 W247 L248 F253 S254 | L193-C250 HydrophobicContact CB-CB 4.15Å; S197-C250 PolarHBondContact OG-O 3.04Å; W247-C250 WeakPolarHBondContact O-CB 3.33Å; W247-C250 PolarHBondContact O-N 2.89Å; W247-C250 VanDerWaalsContact O-N 3.12Å; L248-C250 PolarHBondContact O-N 2.9Å; C250-F253 PolarHBondContact O-N 3.21Å; C250-S254 WeakPolarHBondContact O-CB 3.39Å; C250-S254 PolarHBondContact O-N 3.45Å; C250-S254 PolarHBondContact O-OG 3.42Å |
| 251 | I | 88.9 | Confident | 80.5 | Confident | 12 Ų | 12 | 36.9 Ų | 36.9 | 6% | 0.062 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -66.5 | -44 | 174.9 | -62.7 | -55.3 | 0 | 0 | 0 | 110.9 | F171 I174 N175 W247 L248 F253 S254 G255 | F171-I251 HydrophobicContact CE2-CG2 4.26Å; I174-I251 HydrophobicContact CG2-CD1 3.78Å; N175-I251 HydrophobicContact CB-CD1 4.11Å; N175-I251 VanDerWaalsContact ND2-CG2 3.32Å; N175-I251 WeakPolarHBondContact ND2-CG2 3.38Å; W247-I251 HydrophobicContact CE3-CB 4.44Å; W247-I251 HydrophobicContact CE3-CG1 3.55Å; W247-I251 HydrophobicContact CZ3-CG1 3.91Å; W247-I251 PolarHBondContact O-N 3.27Å; L248-I251 PolarHBondContact O-N 3.45Å; L248-I251 VanDerWaalsContact O-N 3.1Å; I251-F253 VanDerWaalsContact C-N 3.35Å; I251-F253 PolarHBondContact O-N 3.41Å; I251-S254 WeakPolarHBondContact CA-OG 3.3Å; I251-S254 PolarHBondContact O-N 3.35Å; I251-S254 PolarHBondContact O-OG 2.86Å; I251-S254 VanDerWaalsContact O-OG 3.14Å; I251-G255 PolarHBondContact O-N 3.4Å |
| 252 | F | 92.1 | Very high | 82.5 | Confident | 55 Ų | 55 | 28.8 Ų | 28.8 | 24% | 0.241 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -64.8 | -39.9 | 176.7 | -66.4 | -44.8 | 0 | 0 | 0 | 112.2 | A218 A221 L248 P249 G256 | A218-F252 HydrophobicContact CB-CB 4.18Å; A221-F252 HydrophobicContact CB-CB 4.12Å; A221-F252 HydrophobicContact CB-CD1 3.92Å; A221-F252 HydrophobicContact CB-CD2 3.6Å; A221-F252 HydrophobicContact CB-CE1 4.19Å; A221-F252 HydrophobicContact CB-CE2 3.88Å; A221-F252 HydrophobicContact CB-CG 3.63Å; A221-F252 HydrophobicContact CB-CZ 4.17Å; L248-F252 HydrophobicContact CB-CE2 4.21Å; L248-F252 HydrophobicContact CD2-CE2 4.18Å; L248-F252 HydrophobicContact CD2-CZ 4.09Å; L248-F252 WeakPolarHBondContact O-CD2 3.49Å; L248-F252 PolarHBondContact O-N 3.01Å; P249-F252 PolarHBondContact O-N 2.95Å; F252-G256 PolarHBondContact O-N 3.17Å |
| 253 | F | 93.8 | Very high | 84.6 | Confident | 14 Ų | 14 | 22.3 Ų | 22.3 | 6% | 0.061 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -60.7 | -54.3 | 175 | 176 | -91.9 | 0 | 0 | 0 | 111.6 | L198 W201 L211 I215 A218 P249 C250 I251 G255 G256 V257 | L198-F253 HydrophobicContact CD2-CE1 4.5Å; L198-F253 HydrophobicContact CD2-CZ 4.45Å; W201-F253 HydrophobicContact CB-CE1 3.94Å; W201-F253 HydrophobicContact CB-CZ 3.98Å; W201-F253 HydrophobicContact CG-CZ 4.24Å; L211-F253 HydrophobicContact CD1-CE2 4.18Å; L211-F253 HydrophobicContact CD1-CZ 3.95Å; I215-F253 HydrophobicContact CG1-CD2 4.11Å; I215-F253 HydrophobicContact CG1-CE2 3.91Å; A218-F253 HydrophobicContact CB-CB 3.87Å; P249-F253 WeakPolarHBondContact O-CB 3.48Å; P249-F253 PolarHBondContact O-N 2.88Å; C250-F253 PolarHBondContact O-N 3.21Å; I251-F253 VanDerWaalsContact C-N 3.35Å; I251-F253 PolarHBondContact O-N 3.41Å; F253-G255 VanDerWaalsContact C-N 3.33Å; F253-G255 PolarHBondContact O-N 3.49Å; F253-G256 PolarHBondContact O-N 3.39Å; F253-V257 HydrophobicContact CD1-CG2 4.49Å; F253-V257 HydrophobicContact CE1-CG2 4.06Å; F253-V257 HydrophobicContact CE2-CG2 4.31Å; F253-V257 HydrophobicContact CZ-CG2 3.94Å; F253-V257 WeakPolarHBondContact O-CG2 3.31Å; F253-V257 PolarHBondContact O-N 2.85Å |
| 254 | S | 93.1 | Very high | 86.4 | Confident | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -65.6 | -35.5 | -178 | 53.5 | 0 | 0 | 0 | 0 | 112.7 | F171 C250 I251 T258 | F171-S254 WeakPolarHBondContact CD2-OG 3.31Å; C250-S254 WeakPolarHBondContact O-CB 3.39Å; C250-S254 PolarHBondContact O-N 3.45Å; C250-S254 PolarHBondContact O-OG 3.42Å; I251-S254 WeakPolarHBondContact CA-OG 3.3Å; I251-S254 PolarHBondContact O-N 3.35Å; I251-S254 PolarHBondContact O-OG 2.86Å; I251-S254 VanDerWaalsContact O-OG 3.14Å; S254-T258 WeakPolarHBondContact O-CB 3.44Å; S254-T258 PolarHBondContact O-N 3.3Å; S254-T258 PolarHBondContact O-OG1 3.5Å |
| 255 | G | 92.7 | Very high | 87.8 | Confident | 12 Ų | 12 | 15 Ų | 15 | 12% | 0.124 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -65.3 | -45.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | F171 I251 F253 V257 T258 V259 | F171-G255 VanDerWaalsContact CE2-N 3.31Å; I251-G255 PolarHBondContact O-N 3.4Å; F253-G255 VanDerWaalsContact C-N 3.33Å; F253-G255 PolarHBondContact O-N 3.49Å; G255-V257 PolarHBondContact O-N 3.03Å; G255-T258 PolarHBondContact O-N 3.34Å; G255-V259 WeakPolarHBondContact O-CG2 3.26Å; G255-V259 PolarHBondContact O-N 3.01Å |
| 256 | G | 92.8 | Very high | 88.6 | Confident | 5 Ų | 5 | 14.7 Ų | 14.7 | 5% | 0.052 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -58.9 | -46.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | F252 F253 T258 G260 | F252-G256 PolarHBondContact O-N 3.17Å; F253-G256 PolarHBondContact O-N 3.39Å; G256-T258 PolarHBondContact O-N 3.03Å; G256-G260 PolarHBondContact O-N 3.39Å |
| 257 | V | 92.2 | Very high | 89.2 | Confident | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -61.6 | -44.5 | 174.6 | 173.7 | 0 | 0 | 0 | 0 | 111.1 | L200 D205 F253 G255 G260 N261 | L200-V257 HydrophobicContact CD2-CB 4.22Å; L200-V257 HydrophobicContact CD2-CG1 3.79Å; D205-V257 HydrophobicContact CB-CG1 3.79Å; F253-V257 HydrophobicContact CD1-CG2 4.49Å; F253-V257 HydrophobicContact CE1-CG2 4.06Å; F253-V257 HydrophobicContact CE2-CG2 4.31Å; F253-V257 HydrophobicContact CZ-CG2 3.94Å; F253-V257 WeakPolarHBondContact O-CG2 3.31Å; F253-V257 PolarHBondContact O-N 2.85Å; G255-V257 PolarHBondContact O-N 3.03Å; V257-G260 PolarHBondContact O-N 2.96Å; V257-N261 PolarHBondContact O-N 3.08Å; V257-N261 PolarHBondContact O-ND2 2.95Å; V257-N261 PolarHBondContact O-OD1 3.03Å |
| 258 | T | 93.1 | Very high | 89.1 | Confident | 1 Ų | 1 | 16.3 Ų | 16.3 | 1% | 0.006 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -62.6 | -47 | -179.9 | -59.9 | 0 | 0 | 0 | 0 | 112.1 | C167 I168 F171 S254 G255 G256 N261 I262 | C167-T258 PolarHBondContact SG-OG1 3.17Å; C167-T258 VanDerWaalsContact SG-OG1 3.34Å; I168-T258 HydrophobicContact CB-CG2 4.45Å; I168-T258 HydrophobicContact CG1-CG2 3.69Å; F171-T258 HydrophobicContact CB-CG2 4.43Å; S254-T258 WeakPolarHBondContact O-CB 3.44Å; S254-T258 PolarHBondContact O-N 3.3Å; S254-T258 PolarHBondContact O-OG1 3.5Å; G255-T258 PolarHBondContact O-N 3.34Å; G256-T258 PolarHBondContact O-N 3.03Å; T258-N261 WeakPolarHBondContact O-CB 3.42Å; T258-N261 PolarHBondContact O-N 2.69Å; T258-I262 HydrophobicContact CG2-CD1 4.38Å; T258-I262 WeakPolarHBondContact O-CG1 3.41Å; T258-I262 PolarHBondContact O-N 2.82Å; T258-I262 VanDerWaalsContact O-N 3.14Å |
| 259 | V | 93.2 | Very high | 88.1 | Confident | 15 Ų | 15 | 19 Ų | 19 | 9% | 0.091 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -67 | -39.6 | 177.3 | 175.6 | 0 | 0 | 0 | 0 | 111.4 | L91 A137 V140 G255 N261 I262 G263 | L91-V259 HydrophobicContact CD2-CG1 4.24Å; A137-V259 HydrophobicContact CB-CG1 3.87Å; A137-V259 HydrophobicContact CB-CG2 4.07Å; A137-V259 WeakPolarHBondContact O-CG1 3.31Å; V140-V259 HydrophobicContact CB-CG1 4.38Å; V140-V259 HydrophobicContact CG1-CB 4.45Å; V140-V259 HydrophobicContact CG1-CG1 4.36Å; G255-V259 WeakPolarHBondContact O-CG2 3.26Å; G255-V259 PolarHBondContact O-N 3.01Å; V259-N261 VanDerWaalsContact C-N 3.26Å; V259-N261 PolarHBondContact O-N 3.4Å; V259-I262 WeakPolarHBondContact O-CB 3.48Å; V259-I262 PolarHBondContact O-N 3.41Å; V259-I262 VanDerWaalsContact O-N 3.14Å; V259-G263 PolarHBondContact O-N 2.88Å |
| 260 | G | 91.2 | Very high | 86.6 | Confident | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -57.7 | -39.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y144 G256 V257 G263 R264 | Y144-G260 VanDerWaalsContact CG-CA 3.47Å; G256-G260 PolarHBondContact O-N 3.39Å; V257-G260 PolarHBondContact O-N 2.96Å; G260-G263 PolarHBondContact O-N 3.47Å; G260-R264 WeakPolarHBondContact O-CG 3.06Å; G260-R264 PolarHBondContact O-N 2.91Å |
| 261 | N | 90.3 | Very high | 84.4 | Confident | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -64.1 | -41.2 | 175.2 | -60.8 | -25.7 | 0 | 0 | 0 | 112.2 | R159 C167 D205 V257 T258 V259 Q265 | R159-N261 VanDerWaalsContact CZ-OD1 3.24Å; R159-N261 PolarHBondContact NH1-OD1 2.62Å; R159-N261 PolarHBondContact NH2-ND2 3.05Å; R159-N261 PolarHBondContact NH2-OD1 2.96Å; C167-N261 PolarHBondContact SG-ND2 2.76Å; C167-N261 VanDerWaalsContact SG-ND2 3.37Å; D205-N261 PolarHBondContact OD1-OD1 3.39Å; V257-N261 PolarHBondContact O-N 3.08Å; V257-N261 PolarHBondContact O-ND2 2.95Å; V257-N261 PolarHBondContact O-OD1 3.03Å; T258-N261 WeakPolarHBondContact O-CB 3.42Å; T258-N261 PolarHBondContact O-N 2.69Å; V259-N261 VanDerWaalsContact C-N 3.26Å; V259-N261 PolarHBondContact O-N 3.4Å; N261-Q265 WeakPolarHBondContact O-CG 3.33Å; N261-Q265 PolarHBondContact O-N 2.5Å |
| 262 | I | 91.2 | Very high | 82.4 | Confident | 6 Ų | 6 | 30.9 Ų | 30.9 | 3% | 0.031 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.2 | -43.9 | 174.7 | -62.5 | 158.5 | 0 | 0 | 0 | 109.9 | L91 V94 V164 I168 T258 V259 R264 Q265 L266 | L91-I262 HydrophobicContact CD2-CB 4.21Å; L91-I262 HydrophobicContact CD2-CG2 3.76Å; V94-I262 HydrophobicContact CG1-CD1 3.93Å; V164-I262 HydrophobicContact CG1-CG1 3.56Å; I168-I262 HydrophobicContact CD1-CD1 4.07Å; I168-I262 HydrophobicContact CD1-CG1 4.45Å; I168-I262 HydrophobicContact CG1-CD1 4.28Å; T258-I262 HydrophobicContact CG2-CD1 4.38Å; T258-I262 WeakPolarHBondContact O-CG1 3.41Å; T258-I262 PolarHBondContact O-N 2.82Å; T258-I262 VanDerWaalsContact O-N 3.14Å; V259-I262 WeakPolarHBondContact O-CB 3.48Å; V259-I262 PolarHBondContact O-N 3.41Å; V259-I262 VanDerWaalsContact O-N 3.14Å; I262-R264 PolarHBondContact O-N 3.26Å; I262-Q265 WeakPolarHBondContact O-CB 3.45Å; I262-Q265 PolarHBondContact O-N 3.46Å; I262-Q265 VanDerWaalsContact O-N 3.15Å; I262-L266 HydrophobicContact CG2-CD1 3.93Å; I262-L266 HydrophobicContact CG2-CG 4.35Å; I262-L266 WeakPolarHBondContact O-CG 3.09Å; I262-L266 PolarHBondContact O-N 3.09Å |
| 263 | G | 90.3 | Very high | 79.9 | Confident | 3 Ų | 3 | 37.3 Ų | 37.3 | 3% | 0.031 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -56.9 | -49.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | G141 V259 G260 Q265 L266 A267 | G141-G263 WeakPolarHBondContact O-CA 3.3Å; V259-G263 PolarHBondContact O-N 2.88Å; G260-G263 PolarHBondContact O-N 3.47Å; G263-Q265 VanDerWaalsContact C-N 3.26Å; G263-Q265 PolarHBondContact O-N 3.27Å; G263-L266 PolarHBondContact O-N 3.17Å; G263-A267 WeakPolarHBondContact O-CB 3.24Å; G263-A267 PolarHBondContact O-N 3.44Å |
| 264 | R | 88.1 | Confident | 77.4 | Confident | 12 Ų | 12 | 42 Ų | 42 | 5% | 0.045 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -56.9 | -39.5 | 174.2 | -71.8 | 163.8 | 171.4 | 154.2 | -5.3 | 112.6 | D148 D205 S207 S209 G260 I262 A267 M268 | D148-R264 IonicContact OD1-CZ 2.98Å; D148-R264 IonicContact OD1-NE 2.66Å; D148-R264 IonicContact OD1-NH2 3.85Å; D148-R264 PolarHBondContact OD1-NH2 3.33Å; D148-R264 IonicContact OD2-CZ 3.98Å; D148-R264 VanDerWaalsContact OD2-CZ 3.29Å; D148-R264 IonicContact OD2-NE 2.91Å; D148-R264 PolarHBondContact OD2-NE 2.81Å; D148-R264 IonicContact OD2-NH2 3.29Å; D148-R264 PolarHBondContact OD2-NH2 2.81Å; D148-R264 VanDerWaalsContact OD2-NH2 3.1Å; D205-R264 IonicContact OD1-CZ 3.95Å; D205-R264 IonicContact OD1-NH1 3.99Å; D205-R264 PolarHBondContact OD1-NH1 2.78Å; D205-R264 IonicContact OD2-CZ 3.73Å; D205-R264 IonicContact OD2-NH1 3.1Å; D205-R264 PolarHBondContact OD2-NH1 2.86Å; S207-R264 PolarHBondContact OG-NH1 2.84Å; S207-R264 PolarHBondContact OG-NH2 3.49Å; S209-R264 PolarHBondContact OG-NH2 3.43Å; G260-R264 WeakPolarHBondContact O-CG 3.06Å; G260-R264 PolarHBondContact O-N 2.91Å; I262-R264 PolarHBondContact O-N 3.26Å; R264-A267 WeakPolarHBondContact O-CB 3.47Å; R264-A267 PolarHBondContact O-N 2.64Å; R264-M268 WeakPolarHBondContact O-CG 3.26Å; R264-M268 PolarHBondContact O-N 2.6Å |
| 265 | Q | 87.4 | Confident | 75.1 | Confident | 10 Ų | 10 | 50.6 Ų | 50.6 | 5% | 0.047 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -72 | -41.6 | -178 | -70.2 | -86.5 | 43.8 | 0 | 0 | 112.5 | R159 W161 V164 N261 I262 G263 A267 M268 G269 | R159-Q265 VanDerWaalsContact O-CD 3.31Å; R159-Q265 PolarHBondContact O-NE2 3.42Å; R159-Q265 PolarHBondContact O-OE1 2.63Å; R159-Q265 VanDerWaalsContact O-OE1 3.08Å; W161-Q265 HydrophobicContact CH2-CB 4.32Å; W161-Q265 HydrophobicContact CZ2-CB 4.45Å; V164-Q265 HydrophobicContact CG2-CB 4.46Å; V164-Q265 HydrophobicContact CG2-CG 3.55Å; N261-Q265 WeakPolarHBondContact O-CG 3.33Å; N261-Q265 PolarHBondContact O-N 2.5Å; I262-Q265 WeakPolarHBondContact O-CB 3.45Å; I262-Q265 PolarHBondContact O-N 3.46Å; I262-Q265 VanDerWaalsContact O-N 3.15Å; G263-Q265 VanDerWaalsContact C-N 3.26Å; G263-Q265 PolarHBondContact O-N 3.27Å; Q265-A267 PolarHBondContact O-N 3.37Å; Q265-M268 HydrophobicContact CG-CE 4.38Å; Q265-M268 PolarHBondContact O-N 3.14Å; Q265-G269 PolarHBondContact O-N 3.23Å; Q265-G269 VanDerWaalsContact O-N 3.08Å |
| 266 | L | 87 | Confident | 72.7 | Confident | 33 Ų | 33 | 55.4 Ų | 55.4 | 17% | 0.173 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -65.4 | -27.7 | 171.6 | -66.7 | 173 | 0 | 0 | 0 | 111.8 | R87 V90 L91 W161 I262 G263 | R87-L266 HydrophobicContact CG-CB 4.31Å; R87-L266 VanDerWaalsContact CZ-O 3.28Å; R87-L266 PolarHBondContact NE-O 3.26Å; R87-L266 PolarHBondContact NH2-O 2.91Å; V90-L266 HydrophobicContact CB-CD1 4.32Å; V90-L266 HydrophobicContact CG1-CD1 3.89Å; V90-L266 HydrophobicContact CG1-CD2 4.27Å; L91-L266 HydrophobicContact CD1-CD1 4.47Å; L91-L266 HydrophobicContact CD2-CD1 3.94Å; L91-L266 HydrophobicContact CG-CD1 3.81Å; W161-L266 HydrophobicContact CH2-CD2 3.93Å; W161-L266 HydrophobicContact CH2-CG 4.45Å; W161-L266 HydrophobicContact CZ2-CD2 4.49Å; I262-L266 HydrophobicContact CG2-CD1 3.93Å; I262-L266 HydrophobicContact CG2-CG 4.35Å; I262-L266 WeakPolarHBondContact O-CG 3.09Å; I262-L266 PolarHBondContact O-N 3.09Å; G263-L266 PolarHBondContact O-N 3.17Å |
| 267 | A | 83.8 | Confident | 70.4 | Confident | 21 Ų | 21 | 66 Ų | 66 | 17% | 0.174 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -68.6 | -44.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | R87 P145 G263 R264 Q265 | R87-A267 PolarHBondContact NH2-O 3.26Å; P145-A267 HydrophobicContact CB-CB 3.91Å; P145-A267 HydrophobicContact CG-CB 3.91Å; G263-A267 WeakPolarHBondContact O-CB 3.24Å; G263-A267 PolarHBondContact O-N 3.44Å; R264-A267 WeakPolarHBondContact O-CB 3.47Å; R264-A267 PolarHBondContact O-N 2.64Å; Q265-A267 PolarHBondContact O-N 3.37Å |
| 268 | M | 73.4 | Confident | 69.3 | Low | 69 Ų | 69 | 69.4 Ų | 69.4 | 34% | 0.34 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -77 | -26.8 | -178.1 | -69.1 | -172.6 | -61.3 | 0 | 0 | 115.1 | H155 R159 R264 Q265 V270 | H155-M268 HydrophobicContact CB-SD 4.31Å; R159-M268 HydrophobicContact CB-CE 4.19Å; R264-M268 WeakPolarHBondContact O-CG 3.26Å; R264-M268 PolarHBondContact O-N 2.6Å; Q265-M268 HydrophobicContact CG-CE 4.38Å; Q265-M268 PolarHBondContact O-N 3.14Å; M268-V270 PolarHBondContact O-N 3.28Å |
| 269 | G | 59.6 | Low | 68 | Low | 66 Ų | 66 | 72.9 Ų | 72.9 | 68% | 0.68 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.7 | 6.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | Q265 | Q265-G269 PolarHBondContact O-N 3.23Å; Q265-G269 VanDerWaalsContact O-N 3.08Å |
| 270 | V | 55.2 | Low | 66.6 | Low | 41 Ų | 41 | 76.2 Ų | 76.2 | 25% | 0.248 | 43% | 0.429 | C | S | . | . | S | Bend | trans | -109.1 | 116.6 | 178.6 | 174.3 | 0 | 0 | 0 | 0 | 108.2 | M268 E272 | M268-V270 PolarHBondContact O-N 3.28Å; V270-E272 PolarHBondContact O-N 3.2Å |
| 271 | P | 42.6 | Very low | 65.2 | Low | 115 Ų | 115 | 80.6 Ų | 80.6 | 75% | 0.747 | 45% | 0.454 | S | S | * | . | trans | -66.2 | 110.5 | 174.9 | 25.5 | -29.9 | 0 | 0 | 0 | 108.7 | K273 | P271-K273 PolarHBondContact O-N 3.16Š| ||
| 272 | E | 46.8 | Very low | 63.6 | Low | 171 Ų | 171 | 85.7 Ų | 85.7 | 80% | 0.799 | 48% | 0.482 | S | S | * | . | P | Polyproline II helix | trans | -65.7 | 119.7 | 152.7 | -95.3 | -179.3 | 115.9 | 0 | 0 | 106.7 | V270 | V270-E272 PolarHBondContact O-N 3.2Š|
| 273 | K | 40.2 | Very low | 61.8 | Low | 190 Ų | 190 | 91 Ų | 91 | 83% | 0.826 | 51% | 0.512 | S | S | * | . | P | Polyproline II helix | trans | -60.2 | 131 | 168.7 | -109.6 | -178 | 174.8 | -177.1 | 0 | 107.2 | P271 H275 | P271-K273 PolarHBondContact O-N 3.16Å; K273-H275 PolarHBondContact O-N 3.19Å |
| 274 | P | 41.7 | Very low | 59.7 | Low | 112 Ų | 112 | 97.3 Ų | 97.3 | 73% | 0.727 | 55% | 0.547 | S | S | * | . | P | Polyproline II helix | trans | -62.4 | 127.6 | 172.5 | 25.9 | -29.3 | 0 | 0 | 0 | 107.7 | S276 | P274-S276 PolarHBondContact O-N 3.03Å; P274-S276 VanDerWaalsContact O-N 3.17Å |
| 275 | H | 43.7 | Very low | 57.6 | Low | 181 Ų | 181 | 103.8 Ų | 103.8 | 84% | 0.838 | 59% | 0.585 | S | S | * | * | trans | -62.4 | 113.7 | 161.9 | -86.6 | 67.3 | 0 | 0 | 0 | 106.3 | K273 | K273-H275 PolarHBondContact O-N 3.19Š| ||
| 276 | S | 42.2 | Very low | 55.1 | Low | 113 Ų | 113 | 111.7 Ų | 111.7 | 79% | 0.79 | 63% | 0.63 | S | S | * | * | trans | -86.4 | 111.6 | 163.1 | -72 | 0 | 0 | 0 | 0 | 106.5 | P274 | P274-S276 PolarHBondContact O-N 3.03Å; P274-S276 VanDerWaalsContact O-N 3.17Å | ||
| 277 | D | 44.8 | Very low | 52.2 | Low | 228 Ų | 228 | 118.8 Ų | 118.8 | 100% | 1.219 | 67% | 0.672 | S | S | * | * | trans | -71.9 | 0 | 159.5 | -66.4 | -31.2 | 0 | 0 | 0 | 110.1 |
Retrieved 277 of 277 residues in 1043.7 ms
(Link to these results)