| 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 | 39.5 | Very low | 45.5 | Very low | 250 Ų | 250 | 147.2 Ų | 147.2 | 100% | 1.232 | 82% | 0.817 | S | S | * | * | 0 | 118.8 | 0 | -96.6 | 157.8 | 163.4 | 0 | 0 | 106.7 | |||||
| 2 | S | 38.9 | Very low | 45.9 | Very low | 95 Ų | 95 | 143.3 Ų | 143.3 | 66% | 0.664 | 80% | 0.803 | S | S | * | * | trans | -72.1 | 129.6 | -175 | 43.8 | 0 | 0 | 0 | 0 | 112 | ||||
| 3 | D | 38.9 | Very low | 46.2 | Very low | 176 Ų | 176 | 144.7 Ų | 144.7 | 94% | 0.941 | 81% | 0.808 | S | S | * | * | trans | -115.1 | 104.4 | 150.5 | -94.4 | -26.5 | 0 | 0 | 0 | 107.2 | ||||
| 4 | F | 45.7 | Very low | 46 | Very low | 171 Ų | 171 | 146 Ų | 146 | 75% | 0.75 | 81% | 0.811 | S | S | * | * | trans | -91.6 | 143.5 | 176.3 | -105.1 | -89.3 | 0 | 0 | 0 | 109.8 | ||||
| 5 | D | 43.9 | Very low | 46.2 | Very low | 143 Ų | 143 | 146.5 Ų | 146.5 | 77% | 0.765 | 81% | 0.812 | S | S | * | * | trans | 49.5 | 96.5 | 146.2 | -75.1 | -22.1 | 0 | 0 | 0 | 119.5 | ||||
| 6 | S | 53.2 | Low | 46.4 | Very low | 123 Ų | 123 | 145.8 Ų | 145.8 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | trans | -103.7 | 101.7 | 149.6 | -60.1 | 0 | 0 | 0 | 0 | 108.7 | P8 | S6-P8 WeakPolarHBondContact O-CD 3.44Š| ||
| 7 | N | 53.3 | Low | 46.5 | Very low | 113 Ų | 113 | 143.9 Ų | 143.9 | 60% | 0.604 | 80% | 0.802 | S | S | * | * | trans | -73.8 | 120.6 | 175.8 | -178.1 | 1.9 | 0 | 0 | 0 | 110.2 | F9 | N7-F9 PolarHBondContact O-N 3.45Å; N7-F9 VanDerWaalsContact O-N 3.13Å; N7-F9 VanDerWaalsContact OD1-CD2 3.27Å; N7-F9 WeakPolarHBondContact OD1-CD2 3.46Å; N7-F9 PolarHBondContact OD1-N 3.47Å | ||
| 8 | P | 50.7 | Low | 46.4 | Very low | 116 Ų | 116 | 146 Ų | 146 | 75% | 0.753 | 80% | 0.802 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | 15.2 | -172.7 | 33.1 | -37.4 | 0 | 0 | 0 | 115.2 | S6 | S6-P8 WeakPolarHBondContact O-CD 3.44Š|
| 9 | F | 42 | Very low | 46.5 | Very low | 180 Ų | 180 | 148.6 Ų | 148.6 | 79% | 0.789 | 81% | 0.805 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.7 | 12.9 | 177.6 | -65.1 | -69.6 | 0 | 0 | 0 | 114.4 | N7 D11 | N7-F9 PolarHBondContact O-N 3.45Å; N7-F9 VanDerWaalsContact O-N 3.13Å; N7-F9 VanDerWaalsContact OD1-CD2 3.27Å; N7-F9 WeakPolarHBondContact OD1-CD2 3.46Å; N7-F9 PolarHBondContact OD1-N 3.47Å; F9-D11 PolarHBondContact O-N 3.44Å; F9-D11 VanDerWaalsContact O-N 3.14Å |
| 10 | A | 46.6 | Very low | 46.5 | Very low | 97 Ų | 97 | 146.8 Ų | 146.8 | 80% | 0.802 | 80% | 0.801 | S | S | * | * | trans | -83.3 | 85.2 | 174 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 11 | D | 48 | Very low | 46.8 | Very low | 155 Ų | 155 | 145.6 Ų | 145.6 | 83% | 0.829 | 80% | 0.8 | S | S | * | * | trans | -91.4 | 151.6 | 161.3 | -112.3 | -26.8 | 0 | 0 | 0 | 110.7 | F9 | F9-D11 PolarHBondContact O-N 3.44Å; F9-D11 VanDerWaalsContact O-N 3.14Å | ||
| 12 | P | 49.8 | Very low | 46.8 | Very low | 100 Ų | 100 | 139.8 Ų | 139.8 | 65% | 0.649 | 78% | 0.781 | S | S | * | * | trans | -89.3 | 154.3 | -164.7 | 36 | -34 | 0 | 0 | 0 | 113.6 | ||||
| 13 | D | 50.1 | Low | 46.6 | Very low | 162 Ų | 162 | 139.1 Ų | 139.1 | 87% | 0.866 | 79% | 0.789 | S | S | * | * | trans | 33 | 94.9 | 154 | -79.9 | -39.1 | 0 | 0 | 0 | 118.7 | ||||
| 14 | L | 43.4 | Very low | 46.4 | Very low | 163 Ų | 163 | 136.6 Ų | 136.6 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | trans | -135.3 | 105.7 | 147.6 | -88.4 | 167.5 | 0 | 0 | 0 | 110.3 | ||||
| 15 | N | 49.5 | Very low | 46.1 | Very low | 153 Ų | 153 | 134.7 Ų | 134.7 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | trans | 47.4 | 86.3 | 155.2 | -76 | -9.6 | 0 | 0 | 0 | 118.1 | ||||
| 16 | N | 48.3 | Very low | 45.7 | Very low | 135 Ų | 135 | 137.6 Ų | 137.6 | 72% | 0.722 | 79% | 0.793 | S | S | * | * | trans | -90.9 | 116.1 | 157.5 | -163.6 | -4.9 | 0 | 0 | 0 | 109.9 | F18 | N16-F18 PolarHBondContact O-N 3.19Š| ||
| 17 | P | 48.2 | Very low | 45 | Very low | 114 Ų | 114 | 140 Ų | 140 | 74% | 0.74 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -76.6 | 2.2 | -174 | -9.3 | 25.1 | 0 | 0 | 0 | 115 | ||
| 18 | F | 45.3 | Very low | 44.3 | Very low | 182 Ų | 182 | 140.5 Ų | 140.5 | 80% | 0.798 | 80% | 0.802 | S | S | * | * | trans | -112.9 | 51.2 | -167.8 | -73.7 | -81.5 | 0 | 0 | 0 | 114.4 | N16 | N16-F18 PolarHBondContact O-N 3.19Š| ||
| 19 | K | 47.4 | Very low | 43.5 | Very low | 196 Ų | 196 | 142.7 Ų | 142.7 | 85% | 0.852 | 81% | 0.808 | S | S | * | * | trans | -114.8 | 114.6 | 172 | -141.3 | 178.5 | -172.3 | 178.8 | 0 | 111.6 | ||||
| 20 | P | 47 | Very low | 43.4 | Very low | 111 Ų | 111 | 139.9 Ų | 139.9 | 72% | 0.721 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 147.3 | 175.4 | 29.7 | -31.7 | 0 | 0 | 0 | 111.5 | ||
| 21 | P | 53.4 | Low | 43.4 | Very low | 123 Ų | 123 | 141 Ų | 141 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 144 | 179.8 | 30.3 | -31.4 | 0 | 0 | 0 | 112.4 | ||
| 22 | P | 39.6 | Very low | 42.7 | Very low | 128 Ų | 128 | 140.6 Ų | 140.6 | 83% | 0.831 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 134.3 | 172.3 | 24.4 | -17.9 | 0 | 0 | 0 | 111.9 | ||
| 23 | G | 35.2 | Very low | 42.4 | Very low | 80 Ų | 80 | 141 Ų | 141 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 155.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 24 | S | 34.9 | Very low | 41.8 | Very low | 123 Ų | 123 | 142.3 Ų | 142.3 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | trans | -133.7 | 127.3 | 159.1 | 58.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 25 | V | 38.6 | Very low | 42.1 | Very low | 132 Ų | 132 | 140.3 Ų | 140.3 | 80% | 0.8 | 80% | 0.801 | S | S | * | * | trans | -83.6 | 134.3 | -174.6 | 179 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 26 | K | 34.5 | Very low | 41.5 | Very low | 204 Ų | 204 | 137.2 Ų | 137.2 | 89% | 0.887 | 80% | 0.796 | S | S | * | * | trans | -139.3 | 117.8 | 154.3 | -79.1 | -172 | 178.1 | 177.7 | 0 | 109.9 | ||||
| 27 | M | 38.8 | Very low | 40.8 | Very low | 174 Ų | 174 | 138.7 Ų | 138.7 | 86% | 0.857 | 80% | 0.802 | S | S | * | * | trans | -75.5 | 150.7 | 162.8 | -74.6 | -166 | -90.4 | 0 | 0 | 109.6 | ||||
| 28 | P | 40.1 | Very low | 40.2 | Very low | 122 Ų | 122 | 142 Ų | 142 | 79% | 0.792 | 81% | 0.81 | S | S | * | * | -146 | 143.9 | 111.3 | 28.8 | -9.3 | 0 | 0 | 0 | 116.3 | |||||
| 29 | N | 33 | Very low | 39.8 | Very low | 162 Ų | 162 | 142.7 Ų | 142.7 | 87% | 0.866 | 81% | 0.813 | S | S | * | * | trans | 56 | 117.5 | 140.2 | -128.5 | 29.4 | 0 | 0 | 0 | 121.4 | ||||
| 30 | V | 39.5 | Very low | 39.6 | Very low | 122 Ų | 122 | 139.5 Ų | 139.5 | 74% | 0.739 | 81% | 0.812 | S | S | * | * | trans | -82.7 | 156 | 159.9 | -135.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 31 | P | 46.8 | Very low | 39.3 | Very low | 121 Ų | 121 | 140.4 Ų | 140.4 | 79% | 0.786 | 82% | 0.816 | S | S | * | * | -148.2 | 154.7 | 68.7 | 33.6 | -12.2 | 0 | 0 | 0 | 115.7 | |||||
| 32 | N | 34.3 | Very low | 39.1 | Very low | 145 Ų | 145 | 143.2 Ų | 143.2 | 78% | 0.775 | 82% | 0.818 | S | S | * | * | 147.8 | 148.8 | 118.6 | -152.5 | 20.1 | 0 | 0 | 0 | 114.4 | |||||
| 33 | T | 43.4 | Very low | 39.2 | Very low | 110 Ų | 110 | 146 Ų | 146 | 68% | 0.675 | 82% | 0.82 | S | S | * | * | trans | -52.3 | 143.9 | -167.8 | 50.7 | 0 | 0 | 0 | 0 | 120 | ||||
| 34 | Q | 35.8 | Very low | 39.6 | Very low | 189 Ų | 189 | 150.5 Ų | 150.5 | 88% | 0.883 | 82% | 0.819 | S | S | * | * | -179.7 | 151.2 | 123.8 | -97.7 | 172.2 | 29.3 | 0 | 0 | 111.3 | |||||
| 35 | P | 51.3 | Low | 40.4 | Very low | 121 Ų | 121 | 149.1 Ų | 149.1 | 79% | 0.786 | 81% | 0.807 | S | S | * | * | trans | -95 | 156.2 | -177.5 | 36.1 | -30.5 | 0 | 0 | 0 | 113.8 | ||||
| 36 | A | 35.3 | Very low | 41.2 | Very low | 88 Ų | 88 | 146 Ų | 146 | 73% | 0.727 | 80% | 0.796 | S | S | * | * | trans | 94.6 | 116 | 151.1 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 37 | I | 34.2 | Very low | 42.2 | Very low | 165 Ų | 165 | 146 Ų | 146 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | 161.2 | 120.5 | 108.2 | -79.5 | 157.8 | 0 | 0 | 0 | 108.7 | |||||
| 38 | M | 34.8 | Very low | 43.2 | Very low | 184 Ų | 184 | 142.2 Ų | 142.2 | 91% | 0.906 | 78% | 0.778 | S | S | * | * | trans | -73.5 | 138.5 | 174.9 | -66.6 | -172.2 | -82.1 | 0 | 0 | 111.2 | ||||
| 39 | K | 37.6 | Very low | 44.1 | Very low | 196 Ų | 196 | 143.3 Ų | 143.3 | 85% | 0.852 | 77% | 0.773 | S | S | * | * | trans | -123.2 | 124.3 | 154.1 | -112.9 | -178.1 | 178.7 | -178.7 | 0 | 107.7 | T41 | K39-T41 PolarHBondContact O-N 3.42Š| ||
| 40 | P | 43.6 | Very low | 45.6 | Very low | 129 Ų | 129 | 140.2 Ų | 140.2 | 84% | 0.838 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 125.1 | 175.7 | -10.6 | 26 | 0 | 0 | 0 | 109.9 | ||
| 41 | T | 41.3 | Very low | 47 | Very low | 130 Ų | 130 | 137.5 Ų | 137.5 | 80% | 0.798 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -101.3 | 122.1 | 160.7 | -66.8 | 0 | 0 | 0 | 0 | 107 | K39 E43 | K39-T41 PolarHBondContact O-N 3.42Å; T41-E43 PolarHBondContact O-N 3.42Å |
| 42 | E | 47.4 | Very low | 48.2 | Very low | 182 Ų | 182 | 138.9 Ų | 138.9 | 85% | 0.85 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 125 | 172 | -80.7 | 174.4 | 128.3 | 0 | 0 | 110.5 | ||
| 43 | E | 42.6 | Very low | 50 | Low | 188 Ų | 188 | 138.3 Ų | 138.3 | 88% | 0.879 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -97.2 | 125.2 | 165.8 | -73.5 | -171 | 150.6 | 0 | 0 | 110.1 | T41 | T41-E43 PolarHBondContact O-N 3.42Š|
| 44 | H | 44.1 | Very low | 51.5 | Low | 174 Ų | 174 | 139 Ų | 139 | 81% | 0.806 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -80 | 137.5 | 166.9 | -73.9 | -70.8 | 0 | 0 | 0 | 110.4 | A46 | H44-A46 PolarHBondContact O-N 3.49Š|
| 45 | P | 50.9 | Low | 53.5 | Low | 93 Ų | 93 | 132.6 Ų | 132.6 | 60% | 0.604 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 120.7 | -172.7 | 29.6 | -31.6 | 0 | 0 | 0 | 112.7 | Y47 T48 | P45-Y47 PolarHBondContact O-N 3.14Å; P45-Y47 VanDerWaalsContact O-N 3.16Å; P45-T48 PolarHBondContact O-N 2.94Å |
| 46 | A | 56.7 | Low | 54.9 | Low | 68 Ų | 68 | 132.5 Ų | 132.5 | 56% | 0.562 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | -16.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | H44 T48 Q49 | H44-A46 PolarHBondContact O-N 3.49Å; A46-T48 VanDerWaalsContact C-N 3.34Å; A46-T48 PolarHBondContact O-N 3.49Å; A46-Q49 PolarHBondContact O-N 3.16Å |
| 47 | Y | 55 | Low | 57.1 | Low | 204 Ų | 204 | 130.6 Ų | 130.6 | 80% | 0.8 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -68.9 | -29.8 | -177.9 | -130.9 | -90.9 | 0 | 0 | 0 | 113.4 | P45 Q49 | P45-Y47 PolarHBondContact O-N 3.14Å; P45-Y47 VanDerWaalsContact O-N 3.16Å; Y47-Q49 VanDerWaalsContact C-N 3.33Å; Y47-Q49 PolarHBondContact O-N 3.3Å |
| 48 | T | 59 | Low | 59.3 | Low | 93 Ų | 93 | 128.9 Ų | 128.9 | 57% | 0.571 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -75.1 | -24 | -178.6 | -37.3 | 0 | 0 | 0 | 0 | 112.2 | P45 A46 K52 | P45-T48 PolarHBondContact O-N 2.94Å; A46-T48 VanDerWaalsContact C-N 3.34Å; A46-T48 PolarHBondContact O-N 3.49Å; T48-K52 PolarHBondContact O-N 3.2Å |
| 49 | Q | 60.2 | Low | 61.8 | Low | 145 Ų | 145 | 122.8 Ų | 122.8 | 68% | 0.678 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -74.4 | -44.8 | 177.8 | -80.6 | -179.6 | -36 | 0 | 0 | 111.9 | A46 Y47 A51 K52 E53 | A46-Q49 PolarHBondContact O-N 3.16Å; Y47-Q49 VanDerWaalsContact C-N 3.33Å; Y47-Q49 PolarHBondContact O-N 3.3Å; Q49-A51 PolarHBondContact O-N 2.93Å; Q49-K52 WeakPolarHBondContact O-CB 3.47Å; Q49-K52 PolarHBondContact O-N 3.43Å; Q49-E53 WeakPolarHBondContact O-CB 3.34Å; Q49-E53 PolarHBondContact O-N 3.13Å |
| 50 | I | 64.6 | Low | 64.1 | Low | 98 Ų | 98 | 118.6 Ų | 118.6 | 50% | 0.503 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -64.7 | -40.3 | -178.3 | -59.4 | 171.2 | 0 | 0 | 0 | 111.6 | K52 E53 H54 | I50-K52 VanDerWaalsContact C-N 3.34Å; I50-K52 PolarHBondContact O-N 3.44Å; I50-E53 PolarHBondContact O-N 3.02Å; I50-H54 PolarHBondContact O-N 3.39Å |
| 51 | A | 68 | Low | 66.1 | Low | 64 Ų | 64 | 117.9 Ų | 117.9 | 53% | 0.529 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -66.3 | -36.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q49 A55 | Q49-A51 PolarHBondContact O-N 2.93Å; A51-A55 WeakPolarHBondContact O-CB 3.27Å; A51-A55 PolarHBondContact O-N 3.49Å |
| 52 | K | 72.6 | Confident | 68.3 | Low | 150 Ų | 150 | 117.6 Ų | 117.6 | 65% | 0.652 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -66.6 | -40.5 | 173.9 | -121.1 | 175.5 | 179.8 | 176.7 | 0 | 111.4 | T48 Q49 I50 A55 L56 | T48-K52 PolarHBondContact O-N 3.2Å; Q49-K52 WeakPolarHBondContact O-CB 3.47Å; Q49-K52 PolarHBondContact O-N 3.43Å; I50-K52 VanDerWaalsContact C-N 3.34Å; I50-K52 PolarHBondContact O-N 3.44Å; K52-A55 PolarHBondContact O-N 3.44Å; K52-L56 WeakPolarHBondContact O-CB 3.43Å; K52-L56 WeakPolarHBondContact O-CG 3.2Å; K52-L56 PolarHBondContact O-N 2.9Å |
| 53 | E | 72.6 | Confident | 70.4 | Confident | 134 Ų | 134 | 116.3 Ų | 116.3 | 63% | 0.626 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -67.3 | -42 | 179.4 | -155.1 | 171.8 | -164.7 | 0 | 0 | 111.7 | Q49 I50 L56 A57 | Q49-E53 WeakPolarHBondContact O-CB 3.34Å; Q49-E53 PolarHBondContact O-N 3.13Å; I50-E53 PolarHBondContact O-N 3.02Å; E53-L56 PolarHBondContact O-N 2.88Å; E53-A57 WeakPolarHBondContact O-CB 3.4Å; E53-A57 PolarHBondContact O-N 2.94Å |
| 54 | H | 73.9 | Confident | 72.5 | Confident | 125 Ų | 125 | 114.1 Ų | 114.1 | 58% | 0.579 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -64.6 | -39.6 | 172.3 | -102.7 | -88 | 0 | 0 | 0 | 113.1 | I50 A57 Q58 | I50-H54 PolarHBondContact O-N 3.39Å; H54-A57 PolarHBondContact O-N 2.82Å; H54-Q58 PolarHBondContact O-N 3.34Å |
| 55 | A | 77.7 | Confident | 74.5 | Confident | 54 Ų | 54 | 110.6 Ų | 110.6 | 45% | 0.446 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.8 | -37.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A51 K52 A59 | A51-A55 WeakPolarHBondContact O-CB 3.27Å; A51-A55 PolarHBondContact O-N 3.49Å; K52-A55 PolarHBondContact O-N 3.44Å; A55-A59 WeakPolarHBondContact O-CB 3.48Å; A55-A59 PolarHBondContact O-N 3.33Å |
| 56 | L | 81.8 | Confident | 76.4 | Confident | 119 Ų | 119 | 112.8 Ų | 112.8 | 62% | 0.623 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.9 | -40.5 | 173.6 | -73.3 | 167.8 | 0 | 0 | 0 | 111.7 | K52 E53 A59 E60 | K52-L56 WeakPolarHBondContact O-CB 3.43Å; K52-L56 WeakPolarHBondContact O-CG 3.2Å; K52-L56 PolarHBondContact O-N 2.9Å; E53-L56 PolarHBondContact O-N 2.88Å; L56-A59 PolarHBondContact O-N 3.38Å; L56-E60 WeakPolarHBondContact O-CB 3.34Å; L56-E60 PolarHBondContact O-N 3.32Å |
| 57 | A | 81.3 | Confident | 78 | Confident | 47 Ų | 47 | 114.4 Ų | 114.4 | 39% | 0.388 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -65.3 | -40.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | E53 H54 E60 L61 | E53-A57 WeakPolarHBondContact O-CB 3.4Å; E53-A57 PolarHBondContact O-N 2.94Å; H54-A57 PolarHBondContact O-N 2.82Å; A57-E60 PolarHBondContact O-N 3.42Å; A57-L61 WeakPolarHBondContact O-CG 3.38Å; A57-L61 PolarHBondContact O-N 2.98Å |
| 58 | Q | 80.3 | Confident | 79.5 | Confident | 130 Ų | 130 | 109.8 Ų | 109.8 | 61% | 0.607 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -64.5 | -40.5 | 173.4 | -80.5 | -174.7 | -21.3 | 0 | 0 | 112.1 | H54 E60 L61 L62 | H54-Q58 PolarHBondContact O-N 3.34Å; Q58-E60 VanDerWaalsContact C-N 3.35Å; Q58-L61 PolarHBondContact O-N 3.05Å; Q58-L62 PolarHBondContact O-N 2.87Å |
| 59 | A | 85.8 | Confident | 81 | Confident | 56 Ų | 56 | 111 Ų | 111 | 46% | 0.463 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65 | -37.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | A55 L56 K63 | A55-A59 WeakPolarHBondContact O-CB 3.48Å; A55-A59 PolarHBondContact O-N 3.33Å; L56-A59 PolarHBondContact O-N 3.38Å; A59-K63 WeakPolarHBondContact O-CB 3.44Å; A59-K63 PolarHBondContact O-N 3.31Å; A59-K63 VanDerWaalsContact O-N 3.1Å |
| 60 | E | 87.6 | Confident | 82.5 | Confident | 107 Ų | 107 | 113.2 Ų | 113.2 | 50% | 0.5 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -67.4 | -40.4 | 175.8 | -169.5 | 178 | 160.6 | 0 | 0 | 112.2 | L56 A57 Q58 K63 R64 | L56-E60 WeakPolarHBondContact O-CB 3.34Å; L56-E60 PolarHBondContact O-N 3.32Å; A57-E60 PolarHBondContact O-N 3.42Å; Q58-E60 VanDerWaalsContact C-N 3.35Å; E60-K63 PolarHBondContact O-N 2.98Å; E60-R64 PolarHBondContact O-N 2.94Å; E60-R64 IonicContact OE1-CZ 2.74Å; E60-R64 IonicContact OE1-NE 3.41Å; E60-R64 IonicContact OE1-NH2 2.82Å; E60-R64 PolarHBondContact OE1-NH2 3.4Å |
| 61 | L | 84.7 | Confident | 83.7 | Confident | 114 Ų | 114 | 114 Ų | 114 | 60% | 0.597 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -63.9 | -44.7 | 175.9 | -72.6 | 173.3 | 0 | 0 | 0 | 112.3 | A57 Q58 K63 R64 Q65 | A57-L61 WeakPolarHBondContact O-CG 3.38Å; A57-L61 PolarHBondContact O-N 2.98Å; Q58-L61 PolarHBondContact O-N 3.05Å; L61-K63 VanDerWaalsContact C-N 3.27Å; L61-K63 PolarHBondContact O-N 3Å; L61-R64 PolarHBondContact O-N 3.06Å; L61-Q65 PolarHBondContact O-N 3.1Å |
| 62 | L | 87.6 | Confident | 84.6 | Confident | 125 Ų | 125 | 113.7 Ų | 113.7 | 65% | 0.654 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -59.5 | -40.5 | 174.8 | -86 | 161.9 | 0 | 0 | 0 | 111.5 | Q58 Q65 E66 | Q58-L62 PolarHBondContact O-N 2.87Å; L62-Q65 WeakPolarHBondContact O-CB 3.48Å; L62-Q65 PolarHBondContact O-N 2.71Å; L62-E66 PolarHBondContact O-N 3.22Å |
| 63 | K | 90.7 | Very high | 85.3 | Confident | 154 Ų | 154 | 109.4 Ų | 109.4 | 67% | 0.67 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -66.3 | -37.2 | 177.7 | -151.9 | 177.2 | -172.9 | -179.6 | 0 | 112.5 | A59 E60 L61 E67 | A59-K63 WeakPolarHBondContact O-CB 3.44Å; A59-K63 PolarHBondContact O-N 3.31Å; A59-K63 VanDerWaalsContact O-N 3.1Å; E60-K63 PolarHBondContact O-N 2.98Å; L61-K63 VanDerWaalsContact C-N 3.27Å; L61-K63 PolarHBondContact O-N 3Å; K63-E67 PolarHBondContact O-N 3.29Å; K63-E67 VanDerWaalsContact O-N 3.09Å |
| 64 | R | 88 | Confident | 86 | Confident | 142 Ų | 142 | 106.4 Ų | 106.4 | 54% | 0.536 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -68.7 | -38.1 | 173.1 | -74.4 | -170.9 | -169.8 | 171.2 | 9.1 | 112.4 | E60 L61 E67 L68 | E60-R64 PolarHBondContact O-N 2.94Å; E60-R64 IonicContact OE1-CZ 2.74Å; E60-R64 IonicContact OE1-NE 3.41Å; E60-R64 IonicContact OE1-NH2 2.82Å; E60-R64 PolarHBondContact OE1-NH2 3.4Å; L61-R64 PolarHBondContact O-N 3.06Å; R64-E67 PolarHBondContact O-N 3.09Å; R64-L68 WeakPolarHBondContact O-CB 3.44Å; R64-L68 VanDerWaalsContact O-CG 3.29Å; R64-L68 WeakPolarHBondContact O-CG 3.38Å; R64-L68 PolarHBondContact O-N 2.89Å |
| 65 | Q | 85.8 | Confident | 86.5 | Confident | 101 Ų | 101 | 106 Ų | 106 | 47% | 0.472 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.5 | -46.5 | 175.8 | -175.3 | 66.3 | 28.1 | 0 | 0 | 110.8 | L61 L62 E67 L68 E69 | L61-Q65 PolarHBondContact O-N 3.1Å; L62-Q65 WeakPolarHBondContact O-CB 3.48Å; L62-Q65 PolarHBondContact O-N 2.71Å; Q65-E67 VanDerWaalsContact C-N 3.35Å; Q65-E67 PolarHBondContact O-N 3.5Å; Q65-L68 PolarHBondContact O-N 3.46Å; Q65-E69 PolarHBondContact NE2-OE1 2.98Å; Q65-E69 PolarHBondContact O-N 2.98Å |
| 66 | E | 91.1 | Very high | 86.9 | Confident | 138 Ų | 138 | 106.5 Ų | 106.5 | 65% | 0.645 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.2 | -39.1 | 176.5 | -169.3 | -179.6 | -177.7 | 0 | 0 | 112 | L62 E69 R70 | L62-E66 PolarHBondContact O-N 3.22Å; E66-E69 PolarHBondContact O-N 3.26Å; E66-R70 WeakPolarHBondContact O-CB 3.32Å; E66-R70 PolarHBondContact O-N 3.48Å |
| 67 | E | 89.1 | Confident | 87.2 | Confident | 103 Ų | 103 | 106.5 Ų | 106.5 | 48% | 0.481 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -67.1 | -38 | 175.7 | -161.2 | -171.5 | 152.9 | 0 | 0 | 112.5 | K63 R64 Q65 R70 K71 | K63-E67 PolarHBondContact O-N 3.29Å; K63-E67 VanDerWaalsContact O-N 3.09Å; R64-E67 PolarHBondContact O-N 3.09Å; Q65-E67 VanDerWaalsContact C-N 3.35Å; Q65-E67 PolarHBondContact O-N 3.5Å; E67-R70 PolarHBondContact O-N 2.93Å; E67-K71 WeakPolarHBondContact O-CG 3.43Å; E67-K71 PolarHBondContact O-N 3.26Å; E67-K71 VanDerWaalsContact OE1-CE 3.32Å; E67-K71 WeakPolarHBondContact OE1-CE 3.29Å; E67-K71 IonicContact OE1-NZ 3.76Å; E67-K71 PolarHBondContact OE1-NZ 3.32Å |
| 68 | L | 86.9 | Confident | 87.2 | Confident | 107 Ų | 107 | 111.5 Ų | 111.5 | 56% | 0.56 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -66.7 | -44.4 | 175.7 | -76.1 | 171.2 | 0 | 0 | 0 | 111.4 | R64 Q65 R70 K71 A72 | R64-L68 WeakPolarHBondContact O-CB 3.44Å; R64-L68 VanDerWaalsContact O-CG 3.29Å; R64-L68 WeakPolarHBondContact O-CG 3.38Å; R64-L68 PolarHBondContact O-N 2.89Å; Q65-L68 PolarHBondContact O-N 3.46Å; L68-R70 VanDerWaalsContact C-N 3.31Å; L68-R70 PolarHBondContact O-N 3.3Å; L68-K71 PolarHBondContact O-N 2.92Å; L68-A72 WeakPolarHBondContact O-CB 3.43Å; L68-A72 PolarHBondContact O-N 2.82Å |
| 69 | E | 89.9 | Confident | 87.2 | Confident | 117 Ų | 117 | 111.3 Ų | 111.3 | 55% | 0.547 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.6 | -40.1 | 176.1 | -77.8 | 178.7 | -173.6 | 0 | 0 | 111.5 | Q65 E66 K71 A72 A73 | Q65-E69 PolarHBondContact NE2-OE1 2.98Å; Q65-E69 PolarHBondContact O-N 2.98Å; E66-E69 PolarHBondContact O-N 3.26Å; E69-K71 PolarHBondContact O-N 3.49Å; E69-A72 PolarHBondContact O-N 3.02Å; E69-A73 WeakPolarHBondContact O-CB 3.4Å; E69-A73 PolarHBondContact O-N 3.45Å |
| 70 | R | 91.7 | Very high | 86.9 | Confident | 192 Ų | 192 | 115.6 Ų | 115.6 | 73% | 0.725 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.5 | -42.4 | 173.9 | -171.2 | 177.5 | 175.1 | 178.8 | -0.6 | 112.1 | E66 E67 L68 E74 | E66-R70 WeakPolarHBondContact O-CB 3.32Å; E66-R70 PolarHBondContact O-N 3.48Å; E67-R70 PolarHBondContact O-N 2.93Å; L68-R70 VanDerWaalsContact C-N 3.31Å; L68-R70 PolarHBondContact O-N 3.3Å; R70-E74 WeakPolarHBondContact O-CB 3.47Å; R70-E74 PolarHBondContact O-N 3.42Å |
| 71 | K | 90.9 | Very high | 86.4 | Confident | 116 Ų | 116 | 114.9 Ų | 114.9 | 50% | 0.504 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -67.5 | -38.1 | 176 | -77.1 | 176.5 | -173.7 | 161.3 | 0 | 112.2 | E67 L68 E69 E74 L75 | E67-K71 WeakPolarHBondContact O-CG 3.43Å; E67-K71 PolarHBondContact O-N 3.26Å; E67-K71 VanDerWaalsContact OE1-CE 3.32Å; E67-K71 WeakPolarHBondContact OE1-CE 3.29Å; E67-K71 IonicContact OE1-NZ 3.76Å; E67-K71 PolarHBondContact OE1-NZ 3.32Å; L68-K71 PolarHBondContact O-N 2.92Å; E69-K71 PolarHBondContact O-N 3.49Å; K71-E74 PolarHBondContact O-N 3.21Å; K71-L75 WeakPolarHBondContact O-CB 3.39Å; K71-L75 PolarHBondContact O-N 2.91Å |
| 72 | A | 86 | Confident | 85.4 | Confident | 56 Ų | 56 | 116 Ų | 116 | 46% | 0.463 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.8 | -43.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L68 E69 L75 D76 | L68-A72 WeakPolarHBondContact O-CB 3.43Å; L68-A72 PolarHBondContact O-N 2.82Å; E69-A72 PolarHBondContact O-N 3.02Å; A72-L75 PolarHBondContact O-N 3.47Å; A72-D76 WeakPolarHBondContact O-CB 3.35Å; A72-D76 PolarHBondContact O-N 3.3Å |
| 73 | A | 87.4 | Confident | 84.4 | Confident | 61 Ų | 61 | 116 Ų | 116 | 50% | 0.504 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.2 | -37.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | E69 R77 | E69-A73 WeakPolarHBondContact O-CB 3.4Å; E69-A73 PolarHBondContact O-N 3.45Å; A73-R77 WeakPolarHBondContact O-CB 3.41Å; A73-R77 PolarHBondContact O-N 2.69Å |
| 74 | E | 87.4 | Confident | 83.2 | Confident | 70 Ų | 70 | 112.7 Ų | 112.7 | 33% | 0.327 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67 | -39.7 | 174.9 | -167.3 | 82.8 | -153.7 | 0 | 0 | 111.5 | R70 K71 R77 R78 | R70-E74 WeakPolarHBondContact O-CB 3.47Å; R70-E74 PolarHBondContact O-N 3.42Å; K71-E74 PolarHBondContact O-N 3.21Å; E74-R77 PolarHBondContact O-N 3Å; E74-R77 IonicContact OE1-CZ 3.62Å; E74-R77 IonicContact OE1-NH1 3.56Å; E74-R77 PolarHBondContact OE1-NH1 3.13Å; E74-R77 IonicContact OE1-NH2 2.71Å; E74-R77 PolarHBondContact OE1-NH2 3.15Å; E74-R77 IonicContact OE2-NH1 3.45Å; E74-R78 WeakPolarHBondContact O-CB 3.47Å; E74-R78 PolarHBondContact O-N 3.2Å |
| 75 | L | 84 | Confident | 81.9 | Confident | 118 Ų | 118 | 112.3 Ų | 112.3 | 62% | 0.618 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63.7 | -47 | 174.1 | -91.2 | 164.3 | 0 | 0 | 0 | 111.5 | K71 A72 R77 R78 E79 | K71-L75 WeakPolarHBondContact O-CB 3.39Å; K71-L75 PolarHBondContact O-N 2.91Å; A72-L75 PolarHBondContact O-N 3.47Å; L75-R77 VanDerWaalsContact C-N 3.33Å; L75-R77 PolarHBondContact O-N 3.33Å; L75-R78 CarbonylContact O-C 3.58Å; L75-R78 PolarHBondContact O-N 3.06Å; L75-E79 WeakPolarHBondContact O-CB 3.4Å; L75-E79 PolarHBondContact O-N 3.06Å |
| 76 | D | 87.5 | Confident | 80.5 | Confident | 63 Ų | 63 | 110 Ų | 110 | 34% | 0.337 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.8 | -37.9 | 176.9 | 177.6 | 48.6 | 0 | 0 | 0 | 111.5 | A72 E79 R80 | A72-D76 WeakPolarHBondContact O-CB 3.35Å; A72-D76 PolarHBondContact O-N 3.3Å; D76-E79 PolarHBondContact O-N 3.44Å; D76-R80 WeakPolarHBondContact O-CB 3.43Å; D76-R80 VanDerWaalsContact O-CG 3.25Å; D76-R80 WeakPolarHBondContact O-CG 3.32Å; D76-R80 PolarHBondContact O-N 3.38Å; D76-R80 IonicContact OD1-CZ 3.69Å; D76-R80 IonicContact OD1-NE 3.17Å; D76-R80 PolarHBondContact OD1-NE 2.94Å; D76-R80 IonicContact OD1-NH2 3.21Å; D76-R80 IonicContact OD2-CZ 3.94Å; D76-R80 IonicContact OD2-NE 2.75Å; D76-R80 PolarHBondContact OD2-NE 3.49Å; D76-R80 IonicContact OD2-NH1 3.01Å; D76-R80 IonicContact OD2-NH2 2.75Å; D76-R80 PolarHBondContact OD2-NH2 3.19Å |
| 77 | R | 87.1 | Confident | 78.8 | Confident | 119 Ų | 119 | 110.4 Ų | 110.4 | 45% | 0.449 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.2 | -47.1 | 172.2 | -163.1 | -175.8 | 82.5 | -132.7 | -10.2 | 111.4 | A73 E74 L75 E79 R80 E81 | A73-R77 WeakPolarHBondContact O-CB 3.41Å; A73-R77 PolarHBondContact O-N 2.69Å; E74-R77 PolarHBondContact O-N 3Å; E74-R77 IonicContact OE1-CZ 3.62Å; E74-R77 IonicContact OE1-NH1 3.56Å; E74-R77 PolarHBondContact OE1-NH1 3.13Å; E74-R77 IonicContact OE1-NH2 2.71Å; E74-R77 PolarHBondContact OE1-NH2 3.15Å; E74-R77 IonicContact OE2-NH1 3.45Å; L75-R77 VanDerWaalsContact C-N 3.33Å; L75-R77 PolarHBondContact O-N 3.33Å; R77-E79 VanDerWaalsContact C-N 3.33Å; R77-E79 PolarHBondContact O-N 3.36Å; R77-R80 PolarHBondContact O-N 2.89Å; R77-E81 IonicContact NE-OE1 2.88Å; R77-E81 PolarHBondContact NE-OE1 3.28Å; R77-E81 WeakPolarHBondContact O-CB 3.45Å; R77-E81 VanDerWaalsContact O-CG 3.31Å; R77-E81 WeakPolarHBondContact O-CG 3.44Å; R77-E81 PolarHBondContact O-N 3.12Å |
| 78 | R | 82.4 | Confident | 76.8 | Confident | 152 Ų | 152 | 112.1 Ų | 112.1 | 57% | 0.574 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.6 | -39.4 | 176.1 | -83.7 | -169.8 | 179.3 | 166.5 | 2.3 | 112.2 | E74 L75 E81 M82 | E74-R78 WeakPolarHBondContact O-CB 3.47Å; E74-R78 PolarHBondContact O-N 3.2Å; L75-R78 CarbonylContact O-C 3.58Å; L75-R78 PolarHBondContact O-N 3.06Å; R78-E81 PolarHBondContact O-N 3.47Å; R78-M82 WeakPolarHBondContact O-CB 3.45Å; R78-M82 PolarHBondContact O-N 3.09Å |
| 79 | E | 80.4 | Confident | 75.1 | Confident | 127 Ų | 127 | 110.2 Ų | 110.2 | 59% | 0.593 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65.2 | -43.6 | 177.8 | -170.6 | 171.2 | -169.1 | 0 | 0 | 110.4 | L75 D76 R77 M82 Q83 | L75-E79 WeakPolarHBondContact O-CB 3.4Å; L75-E79 PolarHBondContact O-N 3.06Å; D76-E79 PolarHBondContact O-N 3.44Å; R77-E79 VanDerWaalsContact C-N 3.33Å; R77-E79 PolarHBondContact O-N 3.36Å; E79-M82 PolarHBondContact O-N 2.93Å; E79-Q83 WeakPolarHBondContact O-CB 3.23Å; E79-Q83 PolarHBondContact O-N 3.2Å |
| 80 | R | 77.7 | Confident | 73.7 | Confident | 145 Ų | 145 | 108.5 Ų | 108.5 | 55% | 0.547 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.6 | -39.5 | 172.3 | -71.4 | 175.7 | -162.3 | 179 | 1.6 | 112.9 | D76 R77 Q83 N84 | D76-R80 WeakPolarHBondContact O-CB 3.43Å; D76-R80 VanDerWaalsContact O-CG 3.25Å; D76-R80 WeakPolarHBondContact O-CG 3.32Å; D76-R80 PolarHBondContact O-N 3.38Å; D76-R80 IonicContact OD1-CZ 3.69Å; D76-R80 IonicContact OD1-NE 3.17Å; D76-R80 PolarHBondContact OD1-NE 2.94Å; D76-R80 IonicContact OD1-NH2 3.21Å; D76-R80 IonicContact OD2-CZ 3.94Å; D76-R80 IonicContact OD2-NE 2.75Å; D76-R80 PolarHBondContact OD2-NE 3.49Å; D76-R80 IonicContact OD2-NH1 3.01Å; D76-R80 IonicContact OD2-NH2 2.75Å; D76-R80 PolarHBondContact OD2-NH2 3.19Å; R77-R80 PolarHBondContact O-N 2.89Å; R80-Q83 PolarHBondContact O-N 3.05Å; R80-N84 VanDerWaalsContact O-CB 3.23Å; R80-N84 WeakPolarHBondContact O-CB 3.42Å; R80-N84 PolarHBondContact O-N 2.91Å |
| 81 | E | 78 | Confident | 72.2 | Confident | 93 Ų | 93 | 108.4 Ų | 108.4 | 44% | 0.435 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.3 | -42.8 | 174.2 | -75.4 | 170.1 | -162.3 | 0 | 0 | 111 | R77 R78 N84 L85 | R77-E81 IonicContact NE-OE1 2.88Å; R77-E81 PolarHBondContact NE-OE1 3.28Å; R77-E81 WeakPolarHBondContact O-CB 3.45Å; R77-E81 VanDerWaalsContact O-CG 3.31Å; R77-E81 WeakPolarHBondContact O-CG 3.44Å; R77-E81 PolarHBondContact O-N 3.12Å; R78-E81 PolarHBondContact O-N 3.47Å; E81-N84 PolarHBondContact O-N 3.46Å; E81-L85 WeakPolarHBondContact O-CB 3.46Å; E81-L85 WeakPolarHBondContact O-CD1 3.35Å; E81-L85 PolarHBondContact O-N 2.9Å |
| 82 | M | 63.8 | Low | 70.9 | Confident | 136 Ų | 136 | 106.9 Ų | 106.9 | 67% | 0.67 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -67 | -39.1 | 176.4 | -139.3 | -177 | -56.2 | 0 | 0 | 111.6 | R78 E79 L85 S86 | R78-M82 WeakPolarHBondContact O-CB 3.45Å; R78-M82 PolarHBondContact O-N 3.09Å; E79-M82 PolarHBondContact O-N 2.93Å; M82-L85 PolarHBondContact O-N 2.75Å; M82-S86 WeakPolarHBondContact O-CB 3.32Å; M82-S86 PolarHBondContact O-N 3.22Å |
| 83 | Q | 67 | Low | 70.2 | Confident | 126 Ų | 126 | 108.8 Ų | 108.8 | 59% | 0.589 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -68.8 | -41.3 | 176 | -165 | 172.4 | 23.4 | 0 | 0 | 111.1 | E79 R80 S86 Q87 | E79-Q83 WeakPolarHBondContact O-CB 3.23Å; E79-Q83 PolarHBondContact O-N 3.2Å; R80-Q83 PolarHBondContact O-N 3.05Å; Q83-S86 PolarHBondContact O-N 3.46Å; Q83-Q87 VanDerWaalsContact O-CB 3.3Å; Q83-Q87 WeakPolarHBondContact O-CB 3.19Å; Q83-Q87 PolarHBondContact O-N 3.19Å |
| 84 | N | 65.6 | Low | 69.2 | Low | 85 Ų | 85 | 108.9 Ų | 108.9 | 46% | 0.455 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.3 | -40.8 | 172.2 | -93.2 | -14.7 | 0 | 0 | 0 | 111.9 | R80 E81 S86 Q87 H88 | R80-N84 VanDerWaalsContact O-CB 3.23Å; R80-N84 WeakPolarHBondContact O-CB 3.42Å; R80-N84 PolarHBondContact O-N 2.91Å; E81-N84 PolarHBondContact O-N 3.46Å; N84-S86 VanDerWaalsContact C-N 3.34Å; N84-Q87 CarbonylContact O-C 3.56Å; N84-Q87 PolarHBondContact O-N 3.35Å; N84-H88 WeakPolarHBondContact O-CB 3.42Å; N84-H88 PolarHBondContact O-N 3.25Å; N84-H88 PolarHBondContact O-ND1 3.41Å |
| 85 | L | 60.5 | Low | 67.8 | Low | 134 Ų | 134 | 106.9 Ų | 106.9 | 70% | 0.702 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.3 | -37.2 | 173.5 | -107 | 91.8 | 0 | 0 | 0 | 112.2 | E81 M82 Q87 | E81-L85 WeakPolarHBondContact O-CB 3.46Å; E81-L85 WeakPolarHBondContact O-CD1 3.35Å; E81-L85 PolarHBondContact O-N 2.9Å; M82-L85 PolarHBondContact O-N 2.75Å; L85-Q87 PolarHBondContact O-N 2.91Å |
| 86 | S | 56.9 | Low | 66.6 | Low | 51 Ų | 51 | 105.2 Ų | 105.2 | 36% | 0.357 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68.1 | -26.1 | 173.5 | -176 | 0 | 0 | 0 | 0 | 112.4 | M82 Q83 N84 | M82-S86 WeakPolarHBondContact O-CB 3.32Å; M82-S86 PolarHBondContact O-N 3.22Å; Q83-S86 PolarHBondContact O-N 3.46Å; N84-S86 VanDerWaalsContact C-N 3.34Å |
| 87 | Q | 53.7 | Low | 65.1 | Low | 147 Ų | 147 | 105.2 Ų | 105.2 | 69% | 0.687 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -91.6 | -29.8 | -178.8 | -154.8 | 179 | 66.3 | 0 | 0 | 112.4 | Q83 N84 L85 G89 | Q83-Q87 VanDerWaalsContact O-CB 3.3Å; Q83-Q87 WeakPolarHBondContact O-CB 3.19Å; Q83-Q87 PolarHBondContact O-N 3.19Å; N84-Q87 CarbonylContact O-C 3.56Å; N84-Q87 PolarHBondContact O-N 3.35Å; L85-Q87 PolarHBondContact O-N 2.91Å; Q87-G89 PolarHBondContact O-N 2.95Å |
| 88 | H | 47.1 | Very low | 63.8 | Low | 140 Ų | 140 | 103.9 Ų | 103.9 | 65% | 0.648 | 52% | 0.519 | S | S | * | . | S | Bend | trans | -93.4 | 79.1 | 177.5 | -68.7 | 80.4 | 0 | 0 | 0 | 111.6 | N84 | N84-H88 WeakPolarHBondContact O-CB 3.42Å; N84-H88 PolarHBondContact O-N 3.25Å; N84-H88 PolarHBondContact O-ND1 3.41Å |
| 89 | G | 52.8 | Low | 62.8 | Low | 66 Ų | 66 | 102.4 Ų | 102.4 | 68% | 0.68 | 53% | 0.532 | S | S | * | . | trans | 82.2 | 53.1 | 146.7 | 0 | 0 | 0 | 0 | 0 | 117.8 | Q87 K91 | Q87-G89 PolarHBondContact O-N 2.95Å; G89-K91 PolarHBondContact O-N 3.05Å | ||
| 90 | R | 59.9 | Low | 61.9 | Low | 82 Ų | 82 | 103.5 Ų | 103.5 | 31% | 0.309 | 54% | 0.543 | S | S | . | . | P | Polyproline II helix | trans | -60.3 | 118 | 158.6 | -78.2 | 168 | 164.5 | 179.4 | 8.4 | 109.2 | N92 Y108 D114 | R90-N92 PolarHBondContact O-N 3.2Å; R90-Y108 HydrophobicContact CB-CD1 3.99Å; R90-Y108 HydrophobicContact CB-CD2 3.61Å; R90-Y108 HydrophobicContact CB-CE1 4.27Å; R90-Y108 HydrophobicContact CB-CE2 3.87Å; R90-Y108 HydrophobicContact CB-CG 3.62Å; R90-Y108 VanDerWaalsContact CD-CE1 3.41Å; R90-Y108 HydrophobicContact CG-CD1 4.46Å; R90-Y108 HydrophobicContact CG-CD2 4.4Å; R90-Y108 HydrophobicContact CG-CE1 4.3Å; R90-Y108 HydrophobicContact CG-CE2 4.18Å; R90-Y108 HydrophobicContact CG-CG 4.49Å; R90-D114 IonicContact CZ-OD1 3.02Å; R90-D114 IonicContact NH1-OD1 2.62Å; R90-D114 PolarHBondContact NH1-OD1 3.39Å |
| 91 | K | 61 | Low | 60.6 | Low | 190 Ų | 190 | 102 Ų | 102 | 83% | 0.826 | 54% | 0.54 | S | S | * | . | P | Polyproline II helix | trans | -56.4 | 130.2 | -179 | -76.1 | -175.4 | 177.9 | 179.5 | 0 | 110.3 | G89 N93 Y108 | G89-K91 PolarHBondContact O-N 3.05Å; K91-N93 PolarHBondContact O-N 3.5Å; K91-Y108 WeakPolarHBondContact O-CD2 3.41Å |
| 92 | N | 63.1 | Low | 59.6 | Low | 83 Ų | 83 | 103.6 Ų | 103.6 | 44% | 0.444 | 56% | 0.559 | S | S | . | * | P | Polyproline II helix | trans | -55.7 | 129.6 | 175.5 | -68.1 | -26.5 | 0 | 0 | 0 | 110.5 | R90 P105 C106 F107 Y108 | R90-N92 PolarHBondContact O-N 3.2Å; N92-P105 HydrophobicContact CB-CB 3.99Å; N92-P105 WeakPolarHBondContact CB-O 3.15Å; N92-P105 PolarHBondContact ND2-O 3.02Å; N92-P105 VanDerWaalsContact O-CB 3.28Å; N92-P105 WeakPolarHBondContact O-CB 3.41Å; N92-C106 VanDerWaalsContact CG-O 3.3Å; N92-C106 VanDerWaalsContact ND2-C 3.32Å; N92-C106 PolarHBondContact ND2-O 3.48Å; N92-C106 PolarHBondContact OD1-O 2.91Å; N92-F107 CarbonylContact C-O 3.49Å; N92-F107 WeakPolarHBondContact CA-O 3.43Å; N92-F107 WeakPolarHBondContact OD1-CA 3.25Å; N92-Y108 PolarHBondContact OD1-N 2.96Å |
| 93 | N | 70.1 | Confident | 59.2 | Low | 97 Ų | 97 | 100.4 Ų | 100.4 | 52% | 0.519 | 55% | 0.547 | S | S | . | . | trans | -120.2 | -1.9 | -175 | -170.2 | 36.8 | 0 | 0 | 0 | 112.3 | K91 F107 | K91-N93 PolarHBondContact O-N 3.5Å; N93-F107 PolarHBondContact N-O 2.89Å | ||
| 94 | W | 66.5 | Low | 58.6 | Low | 63 Ų | 63 | 96.2 Ų | 96.2 | 24% | 0.239 | 54% | 0.537 | C | S | . | . | B | Isolated β-bridge | trans | -135.3 | 135.1 | -171 | -163.9 | -92 | 0 | 0 | 0 | 112.6 | P96 P105 C106 F107 Q109 Y127 | W94-P96 HydrophobicContact CE3-CG 4.13Å; W94-P96 VanDerWaalsContact CH2-CD 3.41Å; W94-P96 HydrophobicContact CH2-CG 3.9Å; W94-P96 HydrophobicContact CZ3-CG 3.64Å; W94-P105 CarbonylContact O-C 3.52Å; W94-P105 WeakPolarHBondContact O-CA 3.47Å; W94-C106 PolarHBondContact O-N 2.84Å; W94-F107 WeakPolarHBondContact CB-O 3.43Å; W94-F107 PolarHBondContact N-O 3.42Å; W94-F107 PolarHBondContact O-N 2.86Å; W94-Q109 HydrophobicContact CB-CB 4.32Å; W94-Y127 AromaticContact CE2-CZ 3.95Å; W94-Y127 VanDerWaalsContact CE2-OH 3.25Å; W94-Y127 HydrophobicContact CH2-CE1 4.34Å; W94-Y127 AromaticContact CH2-CZ 3.95Å; W94-Y127 WeakPolarHBondContact CH2-OH 3.46Å; W94-Y127 HydrophobicContact CZ2-CE1 4.49Å; W94-Y127 HydrophobicContact CZ2-CE2 4.44Å; W94-Y127 AromaticContact CZ2-CZ 3.66Å; W94-Y127 WeakPolarHBondContact CZ2-OH 3.18Å |
| 95 | P | 59.5 | Low | 58.4 | Low | 28 Ų | 28 | 95 Ų | 95 | 18% | 0.182 | 53% | 0.534 | C | S | . | . | S | Bend | cis | -73.6 | 145 | -6.7 | 32.5 | -35.9 | 0 | 0 | 0 | 111.6 | L97 V103 | P95-L97 HydrophobicContact CB-CD1 4.01Å; P95-L97 HydrophobicContact CB-CG 3.94Å; P95-L97 HydrophobicContact CG-CD1 3.52Å; P95-L97 HydrophobicContact CG-CG 3.91Å; P95-L97 PolarHBondContact O-N 3.43Å; P95-V103 HydrophobicContact CG-CG1 4.4Å |
| 96 | P | 58.5 | Low | 58.4 | Low | 83 Ų | 83 | 91.5 Ų | 91.5 | 54% | 0.539 | 52% | 0.52 | S | S | . | . | trans | -76.7 | 71.8 | 177.6 | 32.8 | -35.8 | 0 | 0 | 0 | 108.4 | W94 | W94-P96 HydrophobicContact CE3-CG 4.13Å; W94-P96 VanDerWaalsContact CH2-CD 3.41Å; W94-P96 HydrophobicContact CH2-CG 3.9Å; W94-P96 HydrophobicContact CZ3-CG 3.64Å | ||
| 97 | L | 55.8 | Low | 58.7 | Low | 63 Ų | 63 | 93.3 Ų | 93.3 | 33% | 0.33 | 52% | 0.521 | S | S | . | . | trans | -95 | 141.2 | 176.8 | -65.4 | 172.3 | 0 | 0 | 0 | 108.8 | P95 F101 V103 | P95-L97 HydrophobicContact CB-CD1 4.01Å; P95-L97 HydrophobicContact CB-CG 3.94Å; P95-L97 HydrophobicContact CG-CD1 3.52Å; P95-L97 HydrophobicContact CG-CG 3.91Å; P95-L97 PolarHBondContact O-N 3.43Å; L97-F101 HydrophobicContact CB-CB 3.94Å; L97-F101 HydrophobicContact CB-CG 4.46Å; L97-F101 HydrophobicContact CD1-CB 4.38Å; L97-F101 HydrophobicContact CD1-CD1 3.53Å; L97-F101 HydrophobicContact CD1-CE1 4.05Å; L97-F101 HydrophobicContact CD1-CG 4.11Å; L97-F101 HydrophobicContact CG-CD1 4.49Å; L97-V103 HydrophobicContact CD1-CB 4.08Å; L97-V103 WeakPolarHBondContact CD1-O 3.24Å | ||
| 98 | P | 58.4 | Low | 59.1 | Low | 90 Ų | 90 | 89.4 Ų | 89.4 | 58% | 0.584 | 50% | 0.501 | S | S | * | . | trans | -56.5 | 150.5 | 172.7 | 23.2 | -31 | 0 | 0 | 0 | 109.6 | N100 F101 | P98-N100 PolarHBondContact O-N 2.88Å; P98-F101 PolarHBondContact O-N 2.62Å | ||
| 99 | S | 62.6 | Low | 59.9 | Low | 121 Ų | 121 | 83.7 Ų | 83.7 | 85% | 0.846 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -11.1 | -174.4 | 48 | 0 | 0 | 0 | 0 | 115.5 | ||
| 100 | N | 61.5 | Low | 60.8 | Low | 151 Ų | 151 | 82.7 Ų | 82.7 | 81% | 0.807 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.5 | -4.4 | -179.6 | -62.2 | 74.9 | 0 | 0 | 0 | 113.8 | P98 | P98-N100 PolarHBondContact O-N 2.88Š|
| 101 | F | 50.8 | Low | 61.7 | Low | 114 Ų | 114 | 80.4 Ų | 80.4 | 50% | 0.5 | 45% | 0.446 | S | S | . | . | S | Bend | trans | -91.4 | 137.7 | 177.3 | -149.2 | -95.7 | 0 | 0 | 0 | 110.7 | L97 P98 V103 | L97-F101 HydrophobicContact CB-CB 3.94Å; L97-F101 HydrophobicContact CB-CG 4.46Å; L97-F101 HydrophobicContact CD1-CB 4.38Å; L97-F101 HydrophobicContact CD1-CD1 3.53Å; L97-F101 HydrophobicContact CD1-CE1 4.05Å; L97-F101 HydrophobicContact CD1-CG 4.11Å; L97-F101 HydrophobicContact CG-CD1 4.49Å; P98-F101 PolarHBondContact O-N 2.62Å; F101-V103 HydrophobicContact CD1-CB 4.05Å; F101-V103 HydrophobicContact CD1-CG2 3.97Å; F101-V103 HydrophobicContact CE1-CB 4.43Å; F101-V103 HydrophobicContact CE1-CG2 3.96Å; F101-V103 PolarHBondContact O-N 3.26Å |
| 102 | P | 55.5 | Low | 62.1 | Low | 126 Ų | 126 | 74.9 Ų | 74.9 | 82% | 0.818 | 43% | 0.431 | S | S | * | . | S | Bend | trans | -65.6 | -8.1 | -175.7 | 22.9 | -33 | 0 | 0 | 0 | 114.8 | ||
| 103 | V | 55.3 | Low | 62.6 | Low | 69 Ų | 69 | 74.7 Ų | 74.7 | 42% | 0.418 | 43% | 0.433 | S | S | . | . | S | Bend | trans | -108.6 | 90.6 | 178.8 | -164.7 | 0 | 0 | 0 | 0 | 107.8 | P95 L97 F101 | P95-V103 HydrophobicContact CG-CG1 4.4Å; L97-V103 HydrophobicContact CD1-CB 4.08Å; L97-V103 WeakPolarHBondContact CD1-O 3.24Å; F101-V103 HydrophobicContact CD1-CB 4.05Å; F101-V103 HydrophobicContact CD1-CG2 3.97Å; F101-V103 HydrophobicContact CE1-CB 4.43Å; F101-V103 HydrophobicContact CE1-CG2 3.96Å; F101-V103 PolarHBondContact O-N 3.26Å |
| 104 | G | 55 | Low | 62.9 | Low | 37 Ų | 37 | 70.7 Ų | 70.7 | 38% | 0.381 | 41% | 0.411 | S | S | . | . | trans | -67.9 | 171.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | C106 | G104-C106 PolarHBondContact O-N 3.21Å; G104-C106 PolarHBondContact O-SG 2.87Å | ||
| 105 | P | 61.8 | Low | 63.6 | Low | 61 Ų | 61 | 67.9 Ų | 67.9 | 40% | 0.396 | 40% | 0.401 | S | S | . | . | trans | -58.8 | 106.4 | 173.8 | -23.3 | 34.1 | 0 | 0 | 0 | 110.7 | N92 W94 | N92-P105 HydrophobicContact CB-CB 3.99Å; N92-P105 WeakPolarHBondContact CB-O 3.15Å; N92-P105 PolarHBondContact ND2-O 3.02Å; N92-P105 VanDerWaalsContact O-CB 3.28Å; N92-P105 WeakPolarHBondContact O-CB 3.41Å; W94-P105 CarbonylContact O-C 3.52Å; W94-P105 WeakPolarHBondContact O-CA 3.47Å | ||
| 106 | C | 60.4 | Low | 64.6 | Low | 60 Ų | 60 | 69.2 Ų | 69.2 | 41% | 0.405 | 41% | 0.41 | S | S | . | . | trans | -91 | -20.3 | -178 | -67.9 | 0 | 0 | 0 | 0 | 112.7 | N92 W94 G104 | N92-C106 VanDerWaalsContact CG-O 3.3Å; N92-C106 VanDerWaalsContact ND2-C 3.32Å; N92-C106 PolarHBondContact ND2-O 3.48Å; N92-C106 PolarHBondContact OD1-O 2.91Å; W94-C106 PolarHBondContact O-N 2.84Å; G104-C106 PolarHBondContact O-N 3.21Å; G104-C106 PolarHBondContact O-SG 2.87Å | ||
| 107 | F | 62.6 | Low | 65.6 | Low | 89 Ų | 89 | 70.3 Ų | 70.3 | 39% | 0.39 | 42% | 0.415 | S | S | . | . | B | Isolated β-bridge | trans | -141.3 | 144.3 | -171.4 | -54.1 | -66.6 | 0 | 0 | 0 | 113.6 | N92 N93 W94 | N92-F107 CarbonylContact C-O 3.49Å; N92-F107 WeakPolarHBondContact CA-O 3.43Å; N92-F107 WeakPolarHBondContact OD1-CA 3.25Å; N93-F107 PolarHBondContact N-O 2.89Å; W94-F107 WeakPolarHBondContact CB-O 3.43Å; W94-F107 PolarHBondContact N-O 3.42Å; W94-F107 PolarHBondContact O-N 2.86Å |
| 108 | Y | 62.1 | Low | 66.8 | Low | 64 Ų | 64 | 73.9 Ų | 73.9 | 25% | 0.251 | 43% | 0.43 | S | S | . | . | trans | -82.6 | 127.5 | 163.4 | 179.3 | -94 | 0 | 0 | 0 | 109.5 | R90 K91 N92 D110 | R90-Y108 HydrophobicContact CB-CD1 3.99Å; R90-Y108 HydrophobicContact CB-CD2 3.61Å; R90-Y108 HydrophobicContact CB-CE1 4.27Å; R90-Y108 HydrophobicContact CB-CE2 3.87Å; R90-Y108 HydrophobicContact CB-CG 3.62Å; R90-Y108 VanDerWaalsContact CD-CE1 3.41Å; R90-Y108 HydrophobicContact CG-CD1 4.46Å; R90-Y108 HydrophobicContact CG-CD2 4.4Å; R90-Y108 HydrophobicContact CG-CE1 4.3Å; R90-Y108 HydrophobicContact CG-CE2 4.18Å; R90-Y108 HydrophobicContact CG-CG 4.49Å; K91-Y108 WeakPolarHBondContact O-CD2 3.41Å; N92-Y108 PolarHBondContact OD1-N 2.96Å; Y108-D110 HydrophobicContact CE1-CB 3.68Å; Y108-D110 HydrophobicContact CE2-CB 4.36Å; Y108-D110 VanDerWaalsContact OH-CB 3.27Å; Y108-D110 WeakPolarHBondContact OH-CB 3.31Å; Y108-D110 PolarHBondContact OH-OD2 3.19Å | ||
| 109 | Q | 65.3 | Low | 68 | Low | 20 Ų | 20 | 71.1 Ų | 71.1 | 9% | 0.093 | 41% | 0.409 | C | S | . | . | trans | -141.1 | 117.7 | 174 | 179.5 | 143.7 | 53.6 | 0 | 0 | 109 | W94 F111 Y177 Y181 | W94-Q109 HydrophobicContact CB-CB 4.32Å; Q109-F111 HydrophobicContact CG-CE2 4.1Å; Q109-F111 HydrophobicContact CG-CZ 4.06Å; Q109-Y177 PolarHBondContact NE2-OH 3.18Å; Q109-Y181 HydrophobicContact CG-CE2 4.15Å | ||
| 110 | D | 71.9 | Confident | 69.1 | Low | 46 Ų | 46 | 66.7 Ų | 66.7 | 25% | 0.246 | 37% | 0.374 | C | S | . | . | trans | -138.1 | 103.6 | 176 | -169 | -27.8 | 0 | 0 | 0 | 110 | Y108 S112 V113 D114 Y181 | Y108-D110 HydrophobicContact CE1-CB 3.68Å; Y108-D110 HydrophobicContact CE2-CB 4.36Å; Y108-D110 VanDerWaalsContact OH-CB 3.27Å; Y108-D110 WeakPolarHBondContact OH-CB 3.31Å; Y108-D110 PolarHBondContact OH-OD2 3.19Å; D110-S112 PolarHBondContact O-N 2.87Å; D110-S112 WeakPolarHBondContact OD1-CB 3.34Å; D110-S112 PolarHBondContact OD1-N 3.49Å; D110-S112 PolarHBondContact OD1-OG 3.46Å; D110-V113 HydrophobicContact CB-CB 4.39Å; D110-V113 PolarHBondContact O-N 2.86Å; D110-V113 PolarHBondContact OD1-N 3.43Å; D110-V113 WeakPolarHBondContact OD2-CG2 3.22Å; D110-D114 VanDerWaalsContact O-CB 3.25Å; D110-D114 WeakPolarHBondContact O-CB 3.41Å; D110-D114 PolarHBondContact O-N 2.89Å; D110-Y181 PolarHBondContact N-OH 3.2Å; D110-Y181 PolarHBondContact O-OH 2.86Å | ||
| 111 | F | 77.8 | Confident | 70.3 | Confident | 33 Ų | 33 | 67.8 Ų | 67.8 | 15% | 0.145 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -64.5 | -26.8 | -179.9 | -59.6 | -82 | 0 | 0 | 0 | 113.2 | Q109 Q120 V123 K124 Y127 Y177 Y181 | Q109-F111 HydrophobicContact CG-CE2 4.1Å; Q109-F111 HydrophobicContact CG-CZ 4.06Å; F111-Q120 WeakPolarHBondContact O-CG 3.33Å; F111-Q120 PolarHBondContact O-NE2 3.39Å; F111-V123 HydrophobicContact CD1-CG1 4.04Å; F111-V123 HydrophobicContact CE1-CG1 3.93Å; F111-K124 HydrophobicContact CB-CD 4.45Å; F111-K124 VanDerWaalsContact CB-CE 3.47Å; F111-K124 HydrophobicContact CB-CG 4.12Å; F111-K124 HydrophobicContact CD1-CG 3.88Å; F111-K124 HydrophobicContact CD2-CG 4.09Å; F111-K124 HydrophobicContact CE1-CG 4.31Å; F111-K124 HydrophobicContact CG-CG 3.76Å; F111-Y127 HydrophobicContact CE2-CD1 4.42Å; F111-Y127 HydrophobicContact CZ-CD1 4.02Å; F111-Y127 HydrophobicContact CZ-CD2 4.39Å; F111-Y127 AromaticContact CZ-CG 3.81Å; F111-Y127 HydrophobicContact CZ-CG 3.81Å; F111-Y177 VanDerWaalsContact CE1-OH 3.29Å; F111-Y177 WeakPolarHBondContact CE1-OH 3.31Å; F111-Y177 WeakPolarHBondContact CZ-OH 3.33Å; F111-Y181 HydrophobicContact CD1-CE2 4.02Å; F111-Y181 HydrophobicContact CE1-CD2 4.25Å; F111-Y181 HydrophobicContact CE1-CE2 4.04Å |
| 112 | S | 68.8 | Low | 72.1 | Confident | 74 Ų | 74 | 62.5 Ų | 62.5 | 52% | 0.517 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -78.8 | -31.8 | -174.9 | 68 | 0 | 0 | 0 | 0 | 112.4 | D110 Q120 | D110-S112 PolarHBondContact O-N 2.87Å; D110-S112 WeakPolarHBondContact OD1-CB 3.34Å; D110-S112 PolarHBondContact OD1-N 3.49Å; D110-S112 PolarHBondContact OD1-OG 3.46Å; S112-Q120 PolarHBondContact O-NE2 2.98Å |
| 113 | V | 74.1 | Confident | 73.8 | Confident | 80 Ų | 80 | 56.5 Ų | 56.5 | 49% | 0.485 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -96.3 | -34.2 | -177.4 | -177.3 | 0 | 0 | 0 | 0 | 112 | D110 | D110-V113 HydrophobicContact CB-CB 4.39Å; D110-V113 PolarHBondContact O-N 2.86Å; D110-V113 PolarHBondContact OD1-N 3.43Å; D110-V113 WeakPolarHBondContact OD2-CG2 3.22Å |
| 114 | D | 77.4 | Confident | 75.4 | Confident | 12 Ų | 12 | 56.9 Ų | 56.9 | 6% | 0.064 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -93 | -19.6 | -172.4 | -66.9 | -27 | 0 | 0 | 0 | 114.7 | R90 D110 Y181 R185 | R90-D114 IonicContact CZ-OD1 3.02Å; R90-D114 IonicContact NH1-OD1 2.62Å; R90-D114 PolarHBondContact NH1-OD1 3.39Å; D110-D114 VanDerWaalsContact O-CB 3.25Å; D110-D114 WeakPolarHBondContact O-CB 3.41Å; D110-D114 PolarHBondContact O-N 2.89Å; D114-Y181 HydrophobicContact CB-CE1 4.46Å; D114-Y181 VanDerWaalsContact CB-OH 3.27Å; D114-Y181 WeakPolarHBondContact CB-OH 3.44Å; D114-Y181 PolarHBondContact OD2-OH 3.48Å; D114-R185 HydrophobicContact CB-CG 4.42Å; D114-R185 VanDerWaalsContact CG-CZ 3.49Å; D114-R185 WeakPolarHBondContact O-CG 3.34Å; D114-R185 IonicContact OD1-CZ 3.72Å; D114-R185 IonicContact OD1-NH1 3.83Å; D114-R185 PolarHBondContact OD1-NH1 2.83Å; D114-R185 IonicContact OD1-NH2 3.52Å; D114-R185 PolarHBondContact OD1-NH2 3.26Å; D114-R185 IonicContact OD2-CZ 3.56Å; D114-R185 IonicContact OD2-NH1 3.26Å; D114-R185 PolarHBondContact OD2-NH1 3.42Å |
| 115 | I | 80.3 | Confident | 77.2 | Confident | 5 Ų | 5 | 58.9 Ų | 58.9 | 3% | 0.026 | 31% | 0.308 | C | S | . | . | S | Bend | trans | -121.4 | 130.7 | -172.5 | -54 | -64.6 | 0 | 0 | 0 | 109.9 | F119 Q120 V123 Y181 F184 R185 | I115-F119 HydrophobicContact CG2-CB 3.84Å; I115-Q120 HydrophobicContact CB-CG 4.07Å; I115-Q120 HydrophobicContact CG2-CG 4.08Å; I115-Q120 VanDerWaalsContact O-CG 3.31Å; I115-Q120 WeakPolarHBondContact O-CG 3.45Å; I115-Q120 PolarHBondContact O-NE2 3.18Å; I115-V123 HydrophobicContact CG1-CG1 4.46Å; I115-V123 HydrophobicContact CG2-CG2 4.05Å; I115-Y181 HydrophobicContact CD1-CD2 4.23Å; I115-Y181 HydrophobicContact CD1-CE2 4.1Å; I115-Y181 HydrophobicContact CG1-CE2 4.05Å; I115-F184 HydrophobicContact CD1-CB 4.01Å; I115-F184 HydrophobicContact CG2-CB 4.41Å; I115-R185 HydrophobicContact CD1-CB 3.87Å |
| 116 | P | 80.7 | Confident | 78.7 | Confident | 56 Ų | 56 | 56 Ų | 56 | 36% | 0.364 | 29% | 0.289 | S | S | . | . | trans | -53.7 | 141.3 | 173.3 | -25.3 | 33.5 | 0 | 0 | 0 | 112.4 | E118 F119 Q120 | P116-E118 VanDerWaalsContact CB-OE2 3.23Å; P116-E118 WeakPolarHBondContact CB-OE2 3.32Å; P116-E118 PolarHBondContact O-N 2.83Å; P116-F119 HydrophobicContact CB-CD2 3.99Å; P116-F119 HydrophobicContact CB-CE2 4.4Å; P116-F119 HydrophobicContact CG-CD2 4.08Å; P116-F119 HydrophobicContact CG-CE2 4.45Å; P116-F119 PolarHBondContact O-N 3.29Å; P116-Q120 WeakPolarHBondContact O-CG 3.25Å; P116-Q120 PolarHBondContact O-N 3.03Å | ||
| 117 | V | 80.2 | Confident | 80.2 | Confident | 106 Ų | 106 | 53.5 Ų | 53.5 | 64% | 0.642 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -54.8 | -32.6 | -169.5 | 179.5 | 0 | 0 | 0 | 0 | 112.4 | F119 | V117-F119 VanDerWaalsContact C-N 3.29Å; V117-F119 PolarHBondContact O-N 3.39Å |
| 118 | E | 80.6 | Confident | 81.6 | Confident | 138 Ų | 138 | 56 Ų | 56 | 65% | 0.645 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -62.4 | -35.1 | 178.9 | -56.6 | 72.3 | -154.3 | 0 | 0 | 111.9 | P116 | P116-E118 VanDerWaalsContact CB-OE2 3.23Å; P116-E118 WeakPolarHBondContact CB-OE2 3.32Å; P116-E118 PolarHBondContact O-N 2.83Å |
| 119 | F | 84 | Confident | 83.1 | Confident | 32 Ų | 32 | 53.3 Ų | 53.3 | 14% | 0.14 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -101.2 | -16.2 | -173.5 | -52.5 | -41.4 | 0 | 0 | 0 | 113.7 | I115 P116 V117 K121 T122 V123 F184 L262 T266 | I115-F119 HydrophobicContact CG2-CB 3.84Å; P116-F119 HydrophobicContact CB-CD2 3.99Å; P116-F119 HydrophobicContact CB-CE2 4.4Å; P116-F119 HydrophobicContact CG-CD2 4.08Å; P116-F119 HydrophobicContact CG-CE2 4.45Å; P116-F119 PolarHBondContact O-N 3.29Å; V117-F119 VanDerWaalsContact C-N 3.29Å; V117-F119 PolarHBondContact O-N 3.39Å; F119-K121 VanDerWaalsContact C-N 3.29Å; F119-K121 PolarHBondContact O-N 2.92Å; F119-T122 PolarHBondContact O-N 3.38Å; F119-V123 PolarHBondContact O-N 2.81Å; F119-F184 HydrophobicContact CB-CD1 3.62Å; F119-F184 HydrophobicContact CB-CE1 4.03Å; F119-F184 HydrophobicContact CB-CG 4.35Å; F119-F184 HydrophobicContact CD1-CD1 4.2Å; F119-F184 AromaticContact CD1-CE1 3.98Å; F119-F184 HydrophobicContact CD1-CE1 3.98Å; F119-F184 AromaticContact CD2-CD1 3.78Å; F119-F184 HydrophobicContact CD2-CD1 3.78Å; F119-F184 HydrophobicContact CD2-CE1 4.33Å; F119-F184 AromaticContact CG-CD1 3.59Å; F119-F184 HydrophobicContact CG-CD1 3.59Å; F119-F184 AromaticContact CG-CE1 3.84Å; F119-F184 HydrophobicContact CG-CE1 3.84Å; F119-L262 HydrophobicContact CD1-CD2 3.4Å; F119-L262 HydrophobicContact CE1-CD2 3.43Å; F119-L262 VanDerWaalsContact CE1-CD2 3.43Å; F119-T266 HydrophobicContact CE1-CG2 4.27Å; F119-T266 HydrophobicContact CE2-CG2 4.07Å; F119-T266 HydrophobicContact CZ-CG2 3.47Å; F119-T266 VanDerWaalsContact CZ-CG2 3.47Å |
| 120 | Q | 85.5 | Confident | 84.5 | Confident | 27 Ų | 27 | 53.8 Ų | 53.8 | 13% | 0.126 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -51.8 | -44.1 | -176.2 | -71.9 | -176.6 | 13.2 | 0 | 0 | 113.3 | F111 S112 I115 P116 T122 V123 K124 | F111-Q120 WeakPolarHBondContact O-CG 3.33Å; F111-Q120 PolarHBondContact O-NE2 3.39Å; S112-Q120 PolarHBondContact O-NE2 2.98Å; I115-Q120 HydrophobicContact CB-CG 4.07Å; I115-Q120 HydrophobicContact CG2-CG 4.08Å; I115-Q120 VanDerWaalsContact O-CG 3.31Å; I115-Q120 WeakPolarHBondContact O-CG 3.45Å; I115-Q120 PolarHBondContact O-NE2 3.18Å; P116-Q120 WeakPolarHBondContact O-CG 3.25Å; P116-Q120 PolarHBondContact O-N 3.03Å; Q120-T122 VanDerWaalsContact C-N 3.34Å; Q120-T122 PolarHBondContact O-N 2.89Å; Q120-V123 PolarHBondContact O-N 3.44Å; Q120-K124 VanDerWaalsContact O-CB 3.32Å; Q120-K124 WeakPolarHBondContact O-CB 3.39Å; Q120-K124 VanDerWaalsContact O-CG 3.25Å; Q120-K124 WeakPolarHBondContact O-CG 3.31Å; Q120-K124 PolarHBondContact O-N 3.03Å |
| 121 | K | 86.9 | Confident | 85.5 | Confident | 174 Ų | 174 | 54.8 Ų | 54.8 | 76% | 0.757 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -61.8 | -42.7 | -179.9 | -68.4 | -177.1 | -178 | 175.1 | 0 | 111.8 | F119 L125 | F119-K121 VanDerWaalsContact C-N 3.29Å; F119-K121 PolarHBondContact O-N 2.92Å; K121-L125 WeakPolarHBondContact O-CB 3.49Å; K121-L125 PolarHBondContact O-N 3.44Å |
| 122 | T | 88.9 | Confident | 86.4 | Confident | 4 Ų | 4 | 56.2 Ų | 56.2 | 3% | 0.025 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -66.8 | -46.8 | 179.7 | -54.5 | 0 | 0 | 0 | 0 | 111.1 | F119 Q120 L125 M126 M255 K258 V259 L262 | F119-T122 PolarHBondContact O-N 3.38Å; Q120-T122 VanDerWaalsContact C-N 3.34Å; Q120-T122 PolarHBondContact O-N 2.89Å; T122-L125 PolarHBondContact O-N 3.02Å; T122-M126 WeakPolarHBondContact O-CG 3.26Å; T122-M126 PolarHBondContact O-N 3.38Å; T122-M255 HydrophobicContact CG2-CE 3.79Å; T122-M255 WeakPolarHBondContact O-CE 3.38Å; T122-K258 HydrophobicContact CG2-CD 4.28Å; T122-K258 HydrophobicContact CG2-CG 4.49Å; T122-K258 WeakPolarHBondContact OG1-CE 3.35Å; T122-V259 HydrophobicContact CG2-CG2 3.73Å; T122-L262 HydrophobicContact CG2-CD1 3.7Å; T122-L262 WeakPolarHBondContact OG1-CD1 3.48Å |
| 123 | V | 90.6 | Very high | 87.6 | Confident | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -67.1 | -38.6 | -178.8 | -176.2 | 0 | 0 | 0 | 0 | 111.4 | F111 I115 F119 Q120 M126 Y127 Y181 F184 | F111-V123 HydrophobicContact CD1-CG1 4.04Å; F111-V123 HydrophobicContact CE1-CG1 3.93Å; I115-V123 HydrophobicContact CG1-CG1 4.46Å; I115-V123 HydrophobicContact CG2-CG2 4.05Å; F119-V123 PolarHBondContact O-N 2.81Å; Q120-V123 PolarHBondContact O-N 3.44Å; V123-M126 PolarHBondContact O-N 3.19Å; V123-Y127 PolarHBondContact O-N 3.42Å; V123-Y181 HydrophobicContact CG1-CD2 3.81Å; V123-Y181 HydrophobicContact CG1-CE2 4.48Å; V123-F184 HydrophobicContact CG2-CB 3.74Å; V123-F184 HydrophobicContact CG2-CD1 4.41Å; V123-F184 HydrophobicContact CG2-CD2 3.51Å; V123-F184 HydrophobicContact CG2-CE2 4.18Å; V123-F184 HydrophobicContact CG2-CG 3.64Å |
| 124 | K | 89.4 | Confident | 88.6 | Confident | 76 Ų | 76 | 49.7 Ų | 49.7 | 33% | 0.33 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -62.9 | -43.3 | 172 | -75 | 176.4 | -173.9 | 176 | 0 | 112.1 | F111 Q120 M126 Y127 Y128 | F111-K124 HydrophobicContact CB-CD 4.45Å; F111-K124 VanDerWaalsContact CB-CE 3.47Å; F111-K124 HydrophobicContact CB-CG 4.12Å; F111-K124 HydrophobicContact CD1-CG 3.88Å; F111-K124 HydrophobicContact CD2-CG 4.09Å; F111-K124 HydrophobicContact CE1-CG 4.31Å; F111-K124 HydrophobicContact CG-CG 3.76Å; Q120-K124 VanDerWaalsContact O-CB 3.32Å; Q120-K124 WeakPolarHBondContact O-CB 3.39Å; Q120-K124 VanDerWaalsContact O-CG 3.25Å; Q120-K124 WeakPolarHBondContact O-CG 3.31Å; Q120-K124 PolarHBondContact O-N 3.03Å; K124-M126 VanDerWaalsContact C-N 3.34Å; K124-M126 PolarHBondContact O-N 3.32Å; K124-Y127 WeakPolarHBondContact O-CB 3.36Å; K124-Y127 PolarHBondContact O-N 2.74Å; K124-Y128 HydrophobicContact CB-CE2 4.45Å; K124-Y128 WeakPolarHBondContact O-CD2 3.42Å; K124-Y128 PolarHBondContact O-N 3.45Å |
| 125 | L | 91.9 | Very high | 89.5 | Confident | 80 Ų | 80 | 52.8 Ų | 52.8 | 42% | 0.419 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -66.1 | -37.9 | 178.5 | -174.1 | 57.3 | 0 | 0 | 0 | 111.9 | K121 T122 Y127 Y128 L129 M255 | K121-L125 WeakPolarHBondContact O-CB 3.49Å; K121-L125 PolarHBondContact O-N 3.44Å; T122-L125 PolarHBondContact O-N 3.02Å; L125-Y127 VanDerWaalsContact C-N 3.3Å; L125-Y127 PolarHBondContact O-N 3.44Å; L125-Y128 PolarHBondContact O-N 3.31Å; L125-L129 WeakPolarHBondContact O-CB 3.31Å; L125-L129 PolarHBondContact O-N 3.06Å; L125-M255 HydrophobicContact CB-CE 3.8Å; L125-M255 HydrophobicContact CB-SD 4.38Å; L125-M255 HydrophobicContact CD2-CE 3.85Å; L125-M255 HydrophobicContact CD2-SD 3.34Å; L125-M255 WeakPolarHBondContact CD2-SD 3.47Å; L125-M255 HydrophobicContact CG-CE 3.83Å; L125-M255 HydrophobicContact CG-SD 3.76Å |
| 126 | M | 92.8 | Very high | 90.3 | Very high | 0 Ų | 0 | 52.6 Ų | 52.6 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63.1 | -37.2 | 172.4 | -72.8 | -67.6 | -95.6 | 0 | 0 | 112.4 | T122 V123 K124 L129 W130 W176 L180 F195 Y199 M255 V259 | T122-M126 WeakPolarHBondContact O-CG 3.26Å; T122-M126 PolarHBondContact O-N 3.38Å; V123-M126 PolarHBondContact O-N 3.19Å; K124-M126 VanDerWaalsContact C-N 3.34Å; K124-M126 PolarHBondContact O-N 3.32Å; M126-L129 WeakPolarHBondContact O-CB 3.25Å; M126-L129 PolarHBondContact O-N 2.88Å; M126-L129 HydrophobicContact SD-CD2 4.19Å; M126-W130 PolarHBondContact O-N 3.46Å; M126-W176 HydrophobicContact CB-CZ3 4.36Å; M126-W176 HydrophobicContact CE-CE3 4.32Å; M126-W176 HydrophobicContact CE-CZ3 3.83Å; M126-W176 WeakPolarHBondContact O-CH2 3.36Å; M126-W176 HydrophobicContact SD-CZ3 4.42Å; M126-L180 HydrophobicContact CB-CD2 3.35Å; M126-L180 HydrophobicContact CE-CD1 4.2Å; M126-L180 HydrophobicContact CE-CD2 3.7Å; M126-L180 HydrophobicContact CG-CD2 3.48Å; M126-L180 VanDerWaalsContact CG-CD2 3.48Å; M126-L180 HydrophobicContact SD-CD2 4.4Å; M126-F195 HydrophobicContact CE-CE2 3.62Å; M126-F195 HydrophobicContact CE-CZ 3.4Å; M126-F195 VanDerWaalsContact CE-CZ 3.4Å; M126-Y199 HydrophobicContact CE-CD2 4.37Å; M126-Y199 HydrophobicContact CE-CE1 4.5Å; M126-Y199 HydrophobicContact CE-CE2 3.74Å; M126-M255 HydrophobicContact CG-CE 3.54Å; M126-M255 HydrophobicContact SD-CB 3.49Å; M126-M255 WeakPolarHBondContact SD-CB 3.16Å; M126-M255 HydrophobicContact SD-CE 3.79Å; M126-M255 HydrophobicContact SD-CG 4.01Å; M126-V259 HydrophobicContact CE-CG2 4.21Å; M126-V259 HydrophobicContact CG-CG2 4.45Å |
| 127 | Y | 91.8 | Very high | 91.1 | Very high | 8 Ų | 8 | 49.9 Ų | 49.9 | 3% | 0.031 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63.5 | -47.5 | 173.7 | 175.7 | -108.2 | 0 | 0 | 0 | 112.1 | W94 F111 V123 K124 L125 L129 W130 M131 Y177 | W94-Y127 AromaticContact CE2-CZ 3.95Å; W94-Y127 VanDerWaalsContact CE2-OH 3.25Å; W94-Y127 HydrophobicContact CH2-CE1 4.34Å; W94-Y127 AromaticContact CH2-CZ 3.95Å; W94-Y127 WeakPolarHBondContact CH2-OH 3.46Å; W94-Y127 HydrophobicContact CZ2-CE1 4.49Å; W94-Y127 HydrophobicContact CZ2-CE2 4.44Å; W94-Y127 AromaticContact CZ2-CZ 3.66Å; W94-Y127 WeakPolarHBondContact CZ2-OH 3.18Å; F111-Y127 HydrophobicContact CE2-CD1 4.42Å; F111-Y127 HydrophobicContact CZ-CD1 4.02Å; F111-Y127 HydrophobicContact CZ-CD2 4.39Å; F111-Y127 AromaticContact CZ-CG 3.81Å; F111-Y127 HydrophobicContact CZ-CG 3.81Å; V123-Y127 PolarHBondContact O-N 3.42Å; K124-Y127 WeakPolarHBondContact O-CB 3.36Å; K124-Y127 PolarHBondContact O-N 2.74Å; L125-Y127 VanDerWaalsContact C-N 3.3Å; L125-Y127 PolarHBondContact O-N 3.44Å; Y127-L129 VanDerWaalsContact C-N 3.29Å; Y127-L129 PolarHBondContact O-N 2.94Å; Y127-W130 HydrophobicContact CD2-CE3 4.16Å; Y127-W130 AromaticContact CE2-CE3 3.69Å; Y127-W130 HydrophobicContact CE2-CE3 3.69Å; Y127-W130 AromaticContact CE2-CZ3 3.75Å; Y127-W130 HydrophobicContact CE2-CZ3 3.75Å; Y127-W130 WeakPolarHBondContact O-CB 3.32Å; Y127-W130 PolarHBondContact O-N 2.76Å; Y127-W130 VanDerWaalsContact O-N 3.17Å; Y127-M131 HydrophobicContact CD1-SD 4.11Å; Y127-M131 HydrophobicContact CE1-CG 3.99Å; Y127-M131 HydrophobicContact CE1-SD 3.24Å; Y127-M131 WeakPolarHBondContact CE1-SD 3.44Å; Y127-M131 HydrophobicContact CE2-CG 4.22Å; Y127-M131 HydrophobicContact CE2-SD 4.48Å; Y127-M131 PolarHBondContact O-N 3.28Å; Y127-M131 WeakPolarHBondContact OH-CG 3.47Å; Y127-M131 PolarHBondContact OH-SD 3.34Å; Y127-Y177 WeakPolarHBondContact CB-OH 3.48Å; Y127-Y177 AromaticContact CD2-CE1 3.96Å; Y127-Y177 HydrophobicContact CD2-CE1 3.96Å; Y127-Y177 AromaticContact CD2-CE2 3.91Å; Y127-Y177 HydrophobicContact CD2-CE2 3.91Å; Y127-Y177 AromaticContact CD2-CZ 3.49Å; Y127-Y177 VanDerWaalsContact CD2-CZ 3.49Å; Y127-Y177 WeakPolarHBondContact CD2-OH 3.4Å; Y127-Y177 HydrophobicContact CG-CE2 4.22Å |
| 128 | Y | 92.4 | Very high | 91.9 | Very high | 142 Ų | 142 | 49.5 Ų | 49.5 | 56% | 0.557 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -64.9 | -32.9 | 176 | -69.2 | -53.5 | 0 | 0 | 0 | 112.9 | K124 L125 M131 F132 | K124-Y128 HydrophobicContact CB-CE2 4.45Å; K124-Y128 WeakPolarHBondContact O-CD2 3.42Å; K124-Y128 PolarHBondContact O-N 3.45Å; L125-Y128 PolarHBondContact O-N 3.31Å; Y128-M131 HydrophobicContact CD1-SD 3.87Å; Y128-M131 HydrophobicContact CE1-SD 4.25Å; Y128-M131 PolarHBondContact O-N 3.39Å; Y128-F132 VanDerWaalsContact O-CB 3.24Å; Y128-F132 WeakPolarHBondContact O-CB 3.45Å; Y128-F132 PolarHBondContact O-N 3.06Å |
| 129 | L | 94.3 | Very high | 92.7 | Very high | 6 Ų | 6 | 46.1 Ų | 46.1 | 3% | 0.031 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.4 | -43.2 | 172.1 | 175.6 | 61.4 | 0 | 0 | 0 | 111.7 | L125 M126 Y127 F132 H133 Y199 I251 M255 | L125-L129 WeakPolarHBondContact O-CB 3.31Å; L125-L129 PolarHBondContact O-N 3.06Å; M126-L129 WeakPolarHBondContact O-CB 3.25Å; M126-L129 PolarHBondContact O-N 2.88Å; M126-L129 HydrophobicContact SD-CD2 4.19Å; Y127-L129 VanDerWaalsContact C-N 3.29Å; Y127-L129 PolarHBondContact O-N 2.94Å; L129-F132 PolarHBondContact O-N 2.89Å; L129-H133 WeakPolarHBondContact O-CB 3.28Å; L129-H133 PolarHBondContact O-N 3.39Å; L129-Y199 WeakPolarHBondContact CD2-OH 3.29Å; L129-I251 HydrophobicContact CD1-CB 3.96Å; L129-I251 HydrophobicContact CD1-CG2 3.75Å; L129-I251 HydrophobicContact CD2-CG2 4.23Å; L129-I251 HydrophobicContact CG-CG2 4.41Å; L129-M255 HydrophobicContact CD2-CB 4.45Å; L129-M255 HydrophobicContact CD2-CG 4.36Å |
| 130 | W | 94.6 | Very high | 93.4 | Very high | 30 Ų | 30 | 44.6 Ų | 44.6 | 11% | 0.114 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.1 | -45.5 | 173.6 | 170 | 78.4 | 0 | 0 | 0 | 111.7 | M126 Y127 F132 H133 A134 T169 S172 F173 W176 | M126-W130 PolarHBondContact O-N 3.46Å; Y127-W130 HydrophobicContact CD2-CE3 4.16Å; Y127-W130 AromaticContact CE2-CE3 3.69Å; Y127-W130 HydrophobicContact CE2-CE3 3.69Å; Y127-W130 AromaticContact CE2-CZ3 3.75Å; Y127-W130 HydrophobicContact CE2-CZ3 3.75Å; Y127-W130 WeakPolarHBondContact O-CB 3.32Å; Y127-W130 PolarHBondContact O-N 2.76Å; Y127-W130 VanDerWaalsContact O-N 3.17Å; W130-F132 PolarHBondContact O-N 3.48Å; W130-H133 PolarHBondContact O-N 2.85Å; W130-A134 PolarHBondContact O-N 2.83Å; W130-T169 HydrophobicContact CZ2-CG2 4.1Å; W130-T169 PolarHBondContact NE1-O 3.47Å; W130-S172 VanDerWaalsContact CD1-OG 3.26Å; W130-S172 PolarHBondContact NE1-OG 3.13Å; W130-S172 VanDerWaalsContact NE1-OG 3.12Å; W130-F173 AromaticContact CD2-CD2 3.99Å; W130-F173 HydrophobicContact CD2-CD2 3.99Å; W130-F173 AromaticContact CE2-CD2 3.7Å; W130-F173 HydrophobicContact CE3-CD2 4.23Å; W130-F173 AromaticContact CH2-CD2 3.97Å; W130-F173 HydrophobicContact CH2-CD2 3.97Å; W130-F173 HydrophobicContact CH2-CE2 4.48Å; W130-F173 HydrophobicContact CZ2-CB 3.85Å; W130-F173 AromaticContact CZ2-CD2 3.7Å; W130-F173 HydrophobicContact CZ2-CD2 3.7Å; W130-F173 HydrophobicContact CZ2-CG 4.06Å; W130-F173 HydrophobicContact CZ3-CD2 4.23Å; W130-W176 HydrophobicContact CB-CH2 3.79Å; W130-W176 HydrophobicContact CB-CZ2 3.71Å; W130-W176 HydrophobicContact CG-CZ2 4.33Å |
| 131 | M | 93.1 | Very high | 94 | Very high | 68 Ų | 68 | 44.5 Ų | 44.5 | 34% | 0.335 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -60.3 | -45.7 | 175.2 | -71.3 | 179.7 | 62.1 | 0 | 0 | 112 | Y127 Y128 H133 A134 V135 | Y127-M131 HydrophobicContact CD1-SD 4.11Å; Y127-M131 HydrophobicContact CE1-CG 3.99Å; Y127-M131 HydrophobicContact CE1-SD 3.24Å; Y127-M131 WeakPolarHBondContact CE1-SD 3.44Å; Y127-M131 HydrophobicContact CE2-CG 4.22Å; Y127-M131 HydrophobicContact CE2-SD 4.48Å; Y127-M131 PolarHBondContact O-N 3.28Å; Y127-M131 WeakPolarHBondContact OH-CG 3.47Å; Y127-M131 PolarHBondContact OH-SD 3.34Å; Y128-M131 HydrophobicContact CD1-SD 3.87Å; Y128-M131 HydrophobicContact CE1-SD 4.25Å; Y128-M131 PolarHBondContact O-N 3.39Å; M131-H133 VanDerWaalsContact C-N 3.28Å; M131-H133 PolarHBondContact O-N 3.37Å; M131-A134 PolarHBondContact O-N 2.96Å; M131-V135 WeakPolarHBondContact O-CG2 3.5Å; M131-V135 PolarHBondContact O-N 3.09Å |
| 132 | F | 95.6 | Very high | 94.5 | Very high | 63 Ų | 63 | 40.9 Ų | 40.9 | 28% | 0.276 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -59.8 | -41.2 | 178.8 | 179.1 | -106.2 | 0 | 0 | 0 | 111.3 | Y128 L129 W130 V135 T136 L244 A247 S248 | Y128-F132 VanDerWaalsContact O-CB 3.24Å; Y128-F132 WeakPolarHBondContact O-CB 3.45Å; Y128-F132 PolarHBondContact O-N 3.06Å; L129-F132 PolarHBondContact O-N 2.89Å; W130-F132 PolarHBondContact O-N 3.48Å; F132-V135 PolarHBondContact O-N 3.2Å; F132-T136 WeakPolarHBondContact O-CB 3.02Å; F132-T136 PolarHBondContact O-N 3.14Å; F132-T136 PolarHBondContact O-OG1 3.41Å; F132-L244 WeakPolarHBondContact CE1-O 3.36Å; F132-L244 HydrophobicContact CE2-CD2 3.82Å; F132-L244 HydrophobicContact CZ-CB 4.27Å; F132-L244 HydrophobicContact CZ-CD2 3.65Å; F132-A247 HydrophobicContact CE1-CB 4.14Å; F132-A247 HydrophobicContact CZ-CB 4.16Å; F132-S248 VanDerWaalsContact CD1-OG 3.31Å; F132-S248 WeakPolarHBondContact CD1-OG 3.42Å; F132-S248 WeakPolarHBondContact CE1-OG 3.27Å |
| 133 | H | 95 | Very high | 94.8 | Very high | 2 Ų | 2 | 40.7 Ų | 40.7 | 1% | 0.009 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -63.1 | -45.7 | 174 | -177.6 | 51 | 0 | 0 | 0 | 112.1 | L129 W130 M131 V135 T136 L137 H206 Q209 | L129-H133 WeakPolarHBondContact O-CB 3.28Å; L129-H133 PolarHBondContact O-N 3.39Å; W130-H133 PolarHBondContact O-N 2.85Å; M131-H133 VanDerWaalsContact C-N 3.28Å; M131-H133 PolarHBondContact O-N 3.37Å; H133-V135 PolarHBondContact O-N 2.94Å; H133-T136 WeakPolarHBondContact O-CB 3.43Å; H133-T136 PolarHBondContact O-N 3.46Å; H133-L137 WeakPolarHBondContact NE2-CD1 3.5Å; H133-L137 PolarHBondContact O-N 3.22Å; H133-H206 AromaticContact CD2-NE2 3.76Å; H133-H206 AromaticContact CE1-CD2 3.58Å; H133-H206 AromaticContact CE1-NE2 3.57Å; H133-H206 AromaticContact CG-NE2 3.46Å; H133-H206 AromaticContact ND1-CD2 3.57Å; H133-H206 AromaticContact ND1-NE2 3.33Å; H133-H206 PolarHBondContact ND1-NE2 2.93Å; H133-H206 AromaticContact NE2-NE2 3.82Å; H133-Q209 PolarHBondContact CE1-OE1 3.01Å |
| 134 | A | 95.3 | Very high | 95.1 | Very high | 14 Ų | 14 | 40.8 Ų | 40.8 | 12% | 0.116 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.7 | -42.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | W130 M131 T136 L137 F138 T169 | W130-A134 PolarHBondContact O-N 2.83Å; M131-A134 PolarHBondContact O-N 2.96Å; A134-T136 VanDerWaalsContact C-N 3.33Å; A134-L137 PolarHBondContact O-N 2.99Å; A134-F138 PolarHBondContact O-N 2.93Å; A134-T169 HydrophobicContact CB-CG2 3.87Å |
| 135 | V | 96.2 | Very high | 95.5 | Very high | 77 Ų | 77 | 40.1 Ų | 40.1 | 47% | 0.467 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -63.4 | -40.7 | 174.1 | 171.4 | 0 | 0 | 0 | 0 | 110.9 | M131 F132 H133 F138 L139 | M131-V135 WeakPolarHBondContact O-CG2 3.5Å; M131-V135 PolarHBondContact O-N 3.09Å; F132-V135 PolarHBondContact O-N 3.2Å; H133-V135 PolarHBondContact O-N 2.94Å; V135-F138 WeakPolarHBondContact O-CB 3.36Å; V135-F138 PolarHBondContact O-N 2.94Å; V135-L139 HydrophobicContact CG1-CD1 4.18Å; V135-L139 HydrophobicContact CG1-CG 4.42Å; V135-L139 WeakPolarHBondContact O-CG 3.26Å; V135-L139 PolarHBondContact O-N 3.25Å |
| 136 | T | 97.4 | Very high | 95.7 | Very high | 1 Ų | 1 | 37.3 Ų | 37.3 | 1% | 0.006 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64.1 | -42.6 | 177.4 | -56.5 | 0 | 0 | 0 | 0 | 111.3 | F132 H133 A134 F138 L139 N140 L244 F245 | F132-T136 WeakPolarHBondContact O-CB 3.02Å; F132-T136 PolarHBondContact O-N 3.14Å; F132-T136 PolarHBondContact O-OG1 3.41Å; H133-T136 WeakPolarHBondContact O-CB 3.43Å; H133-T136 PolarHBondContact O-N 3.46Å; A134-T136 VanDerWaalsContact C-N 3.33Å; T136-F138 VanDerWaalsContact C-N 3.31Å; T136-F138 PolarHBondContact O-N 2.79Å; T136-L139 PolarHBondContact O-N 3.29Å; T136-N140 VanDerWaalsContact O-CB 3.31Å; T136-N140 WeakPolarHBondContact O-CB 3.44Å; T136-N140 PolarHBondContact O-N 2.96Å; T136-L244 HydrophobicContact CG2-CB 3.64Å; T136-F245 HydrophobicContact CG2-CD1 3.57Å; T136-F245 HydrophobicContact CG2-CD2 4.2Å; T136-F245 HydrophobicContact CG2-CE1 3.6Å; T136-F245 HydrophobicContact CG2-CE2 4.23Å; T136-F245 HydrophobicContact CG2-CG 3.88Å; T136-F245 HydrophobicContact CG2-CZ 3.94Å |
| 137 | L | 97.1 | Very high | 95.8 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -62 | -38.4 | 173.4 | -75.1 | 173.4 | 0 | 0 | 0 | 112.2 | H133 A134 N140 I141 F165 F168 F245 | H133-L137 WeakPolarHBondContact NE2-CD1 3.5Å; H133-L137 PolarHBondContact O-N 3.22Å; A134-L137 PolarHBondContact O-N 2.99Å; L137-N140 WeakPolarHBondContact O-CB 3.33Å; L137-N140 PolarHBondContact O-N 3.28Å; L137-I141 PolarHBondContact O-N 3Å; L137-F165 HydrophobicContact CB-CB 4.34Å; L137-F165 HydrophobicContact CB-CD2 3.83Å; L137-F168 HydrophobicContact CD1-CB 3.99Å; L137-F245 HydrophobicContact CD2-CE1 4.14Å; L137-F245 HydrophobicContact CD2-CZ 4.2Å |
| 138 | F | 97.2 | Very high | 96 | Very high | 97 Ų | 97 | 40.4 Ų | 40.4 | 43% | 0.425 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -64.4 | -46.7 | 174.8 | 178.6 | -108.6 | 0 | 0 | 0 | 111.9 | A134 V135 T136 N140 I141 F142 F165 | A134-F138 PolarHBondContact O-N 2.93Å; V135-F138 WeakPolarHBondContact O-CB 3.36Å; V135-F138 PolarHBondContact O-N 2.94Å; T136-F138 VanDerWaalsContact C-N 3.31Å; T136-F138 PolarHBondContact O-N 2.79Å; F138-N140 VanDerWaalsContact C-N 3.26Å; F138-N140 PolarHBondContact O-N 3.42Å; F138-I141 WeakPolarHBondContact O-CB 3.49Å; F138-I141 PolarHBondContact O-N 3.46Å; F138-I141 VanDerWaalsContact O-N 3.16Å; F138-F142 AromaticContact CD1-CE2 3.96Å; F138-F142 HydrophobicContact CD1-CE2 3.96Å; F138-F142 HydrophobicContact CD2-CE2 4.33Å; F138-F142 AromaticContact CE1-CE2 3.49Å; F138-F142 HydrophobicContact CE1-CE2 3.49Å; F138-F142 VanDerWaalsContact CE1-CE2 3.49Å; F138-F142 HydrophobicContact CE1-CZ 4.14Å; F138-F142 AromaticContact CE2-CE2 3.89Å; F138-F142 HydrophobicContact CE2-CE2 3.89Å; F138-F142 HydrophobicContact CE2-CZ 4.24Å; F138-F142 HydrophobicContact CG-CE2 4.37Å; F138-F142 AromaticContact CZ-CE2 3.45Å; F138-F142 HydrophobicContact CZ-CE2 3.45Å; F138-F142 VanDerWaalsContact CZ-CE2 3.45Å; F138-F142 AromaticContact CZ-CZ 3.74Å; F138-F142 HydrophobicContact CZ-CZ 3.74Å; F138-F142 WeakPolarHBondContact O-CD2 3.16Å; F138-F165 HydrophobicContact CB-CD2 4.18Å; F138-F165 HydrophobicContact CB-CE2 3.79Å; F138-F165 HydrophobicContact CB-CZ 4.38Å; F138-F165 HydrophobicContact CD2-CE2 4.4Å; F138-F165 HydrophobicContact CD2-CZ 4.18Å |
| 139 | L | 97.6 | Very high | 96.1 | Very high | 68 Ų | 68 | 38.4 Ų | 38.4 | 36% | 0.356 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -62.2 | -35.1 | 174.8 | -68.3 | 175.5 | 0 | 0 | 0 | 112 | V135 T136 I141 F142 G143 I241 L244 | V135-L139 HydrophobicContact CG1-CD1 4.18Å; V135-L139 HydrophobicContact CG1-CG 4.42Å; V135-L139 WeakPolarHBondContact O-CG 3.26Å; V135-L139 PolarHBondContact O-N 3.25Å; T136-L139 PolarHBondContact O-N 3.29Å; L139-I141 PolarHBondContact O-N 3.14Å; L139-F142 PolarHBondContact O-N 3.46Å; L139-G143 PolarHBondContact O-N 3.38Å; L139-I241 HydrophobicContact CB-CG1 4.46Å; L139-I241 WeakPolarHBondContact O-CD1 3.4Å; L139-L244 HydrophobicContact CD1-CD1 3.7Å |
| 140 | N | 97.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60.4 | -32 | 175.6 | -179.3 | 72.7 | 0 | 0 | 0 | 112.8 | T136 L137 F138 F142 G143 C144 S161 G217 N218 C219 I241 F245 | T136-N140 VanDerWaalsContact O-CB 3.31Å; T136-N140 WeakPolarHBondContact O-CB 3.44Å; T136-N140 PolarHBondContact O-N 2.96Å; L137-N140 WeakPolarHBondContact O-CB 3.33Å; L137-N140 PolarHBondContact O-N 3.28Å; F138-N140 VanDerWaalsContact C-N 3.26Å; F138-N140 PolarHBondContact O-N 3.42Å; N140-F142 VanDerWaalsContact C-N 3.31Å; N140-F142 PolarHBondContact O-N 2.63Å; N140-G143 PolarHBondContact O-N 3.06Å; N140-C144 WeakPolarHBondContact O-CB 3.19Å; N140-C144 PolarHBondContact O-N 3.05Å; N140-S161 WeakPolarHBondContact ND2-CB 3.31Å; N140-G217 PolarHBondContact ND2-O 3.33Å; N140-N218 WeakPolarHBondContact OD1-CA 3.34Å; N140-C219 WeakPolarHBondContact OD1-CB 3.44Å; N140-C219 PolarHBondContact OD1-N 3.24Å; N140-I241 HydrophobicContact CB-CG2 4.02Å; N140-F245 HydrophobicContact CB-CE2 4.01Å; N140-F245 HydrophobicContact CB-CZ 3.86Å |
| 141 | I | 97.9 | Very high | 96 | Very high | 24 Ų | 24 | 41.3 Ų | 41.3 | 12% | 0.123 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.1 | -44.5 | 172.6 | -62.9 | 170.4 | 0 | 0 | 0 | 110.6 | L137 F138 L139 C144 L145 F158 I162 F165 | L137-I141 PolarHBondContact O-N 3Å; F138-I141 WeakPolarHBondContact O-CB 3.49Å; F138-I141 PolarHBondContact O-N 3.46Å; F138-I141 VanDerWaalsContact O-N 3.16Å; L139-I141 PolarHBondContact O-N 3.14Å; I141-C144 PolarHBondContact O-N 3.09Å; I141-L145 VanDerWaalsContact O-CB 3.24Å; I141-L145 WeakPolarHBondContact O-CB 3.46Å; I141-L145 PolarHBondContact O-N 3.19Å; I141-F158 HydrophobicContact CG2-CD2 4.47Å; I141-F158 HydrophobicContact CG2-CE2 3.82Å; I141-I162 HydrophobicContact CD1-CG1 4.36Å; I141-I162 HydrophobicContact CG1-CG1 4.31Å; I141-I162 HydrophobicContact CG2-CG1 3.98Å; I141-F165 HydrophobicContact CD1-CB 3.76Å; I141-F165 HydrophobicContact CD1-CD1 3.85Å; I141-F165 HydrophobicContact CD1-CG 3.81Å; I141-F165 HydrophobicContact CG1-CB 4.33Å |
| 142 | F | 97.2 | Very high | 95.9 | Very high | 98 Ų | 98 | 42.7 Ų | 42.7 | 43% | 0.43 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -69.5 | -37 | 178.4 | -62.2 | -81.4 | 0 | 0 | 0 | 112.3 | F138 L139 N140 L145 A146 | F138-F142 AromaticContact CD1-CE2 3.96Å; F138-F142 HydrophobicContact CD1-CE2 3.96Å; F138-F142 HydrophobicContact CD2-CE2 4.33Å; F138-F142 AromaticContact CE1-CE2 3.49Å; F138-F142 HydrophobicContact CE1-CE2 3.49Å; F138-F142 VanDerWaalsContact CE1-CE2 3.49Å; F138-F142 HydrophobicContact CE1-CZ 4.14Å; F138-F142 AromaticContact CE2-CE2 3.89Å; F138-F142 HydrophobicContact CE2-CE2 3.89Å; F138-F142 HydrophobicContact CE2-CZ 4.24Å; F138-F142 HydrophobicContact CG-CE2 4.37Å; F138-F142 AromaticContact CZ-CE2 3.45Å; F138-F142 HydrophobicContact CZ-CE2 3.45Å; F138-F142 VanDerWaalsContact CZ-CE2 3.45Å; F138-F142 AromaticContact CZ-CZ 3.74Å; F138-F142 HydrophobicContact CZ-CZ 3.74Å; F138-F142 WeakPolarHBondContact O-CD2 3.16Å; L139-F142 PolarHBondContact O-N 3.46Å; N140-F142 VanDerWaalsContact C-N 3.31Å; N140-F142 PolarHBondContact O-N 2.63Å; F142-L145 PolarHBondContact O-N 3.07Å; F142-A146 WeakPolarHBondContact O-CB 3.31Å; F142-A146 PolarHBondContact O-N 3.05Å |
| 143 | G | 96.4 | Very high | 95.7 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.6 | -48.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L139 N140 A146 W147 | L139-G143 PolarHBondContact O-N 3.38Å; N140-G143 PolarHBondContact O-N 3.06Å; G143-A146 PolarHBondContact O-N 3.5Å; G143-W147 WeakPolarHBondContact O-CB 3.3Å; G143-W147 PolarHBondContact O-N 2.83Å |
| 144 | C | 96.6 | Very high | 95.6 | Very high | 2 Ų | 2 | 44.2 Ų | 44.2 | 1% | 0.014 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -68.3 | -33.5 | 177.6 | -71.3 | 0 | 0 | 0 | 0 | 112.4 | N140 I141 W147 F148 F158 C219 | N140-C144 WeakPolarHBondContact O-CB 3.19Å; N140-C144 PolarHBondContact O-N 3.05Å; I141-C144 PolarHBondContact O-N 3.09Å; C144-W147 PolarHBondContact O-N 3.22Å; C144-F148 WeakPolarHBondContact O-CB 3.39Å; C144-F148 PolarHBondContact O-N 3.4Å; C144-F158 HydrophobicContact CB-CB 4.39Å; C144-C219 PolarHBondContact N-SG 3.09Å; C144-C219 PolarHBondContact SG-SG 2.9Å |
| 145 | L | 96.9 | Very high | 95.5 | Very high | 63 Ų | 63 | 45.7 Ų | 45.7 | 33% | 0.33 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.9 | -48.8 | 172.8 | 178.1 | 59 | 0 | 0 | 0 | 111.3 | I141 F142 W147 F148 C149 F158 | I141-L145 VanDerWaalsContact O-CB 3.24Å; I141-L145 WeakPolarHBondContact O-CB 3.46Å; I141-L145 PolarHBondContact O-N 3.19Å; F142-L145 PolarHBondContact O-N 3.07Å; L145-W147 PolarHBondContact O-N 3.44Å; L145-F148 HydrophobicContact CD1-CD1 4.39Å; L145-F148 WeakPolarHBondContact O-CB 3.3Å; L145-F148 PolarHBondContact O-N 3.28Å; L145-C149 PolarHBondContact O-N 2.87Å; L145-C149 PolarHBondContact O-SG 3.5Å; L145-F158 HydrophobicContact CB-CD2 3.79Å; L145-F158 HydrophobicContact CB-CE2 3.67Å; L145-F158 HydrophobicContact CB-CZ 4.48Å; L145-F158 HydrophobicContact CD1-CD2 4.26Å; L145-F158 HydrophobicContact CD1-CE1 4.22Å; L145-F158 HydrophobicContact CD1-CE2 3.87Å; L145-F158 HydrophobicContact CD1-CZ 3.84Å; L145-F158 HydrophobicContact CG-CE2 4.21Å |
| 146 | A | 95.9 | Very high | 95.5 | Very high | 20 Ų | 20 | 45.9 Ų | 45.9 | 17% | 0.165 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -60.2 | -38.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | F142 G143 C149 V150 V234 M237 | F142-A146 WeakPolarHBondContact O-CB 3.31Å; F142-A146 PolarHBondContact O-N 3.05Å; G143-A146 PolarHBondContact O-N 3.5Å; A146-C149 PolarHBondContact O-N 2.83Å; A146-V150 PolarHBondContact O-N 3.37Å; A146-V234 HydrophobicContact CB-CG1 3.94Å; A146-V234 HydrophobicContact CB-CG2 4.14Å; A146-M237 HydrophobicContact CB-CE 4.13Å; A146-M237 HydrophobicContact CB-SD 3.96Å |
| 147 | W | 94.8 | Very high | 95.4 | Very high | 3 Ų | 3 | 46 Ų | 46 | 1% | 0.011 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -66.2 | -41.5 | 175.4 | -165.3 | -128.5 | 0 | 0 | 0 | 112.7 | G143 C144 L145 C149 V150 D151 R154 T226 Q230 V234 M238 | G143-W147 WeakPolarHBondContact O-CB 3.3Å; G143-W147 PolarHBondContact O-N 2.83Å; C144-W147 PolarHBondContact O-N 3.22Å; L145-W147 PolarHBondContact O-N 3.44Å; W147-C149 VanDerWaalsContact C-N 3.3Å; W147-C149 PolarHBondContact O-N 2.77Å; W147-V150 HydrophobicContact CZ3-CG1 4.37Å; W147-V150 PolarHBondContact O-N 3.32Å; W147-V150 VanDerWaalsContact O-N 3.12Å; W147-D151 PolarHBondContact O-N 2.62Å; W147-R154 HydrophobicContact CG-CB 4.39Å; W147-R154 HydrophobicContact CG-CG 4.21Å; W147-R154 VanDerWaalsContact NE1-CD 3.32Å; W147-R154 VanDerWaalsContact NE1-CG 3.34Å; W147-R154 VanDerWaalsContact NE1-NE 3.15Å; W147-T226 HydrophobicContact CZ2-CG2 4.09Å; W147-Q230 HydrophobicContact CH2-CB 3.78Å; W147-Q230 HydrophobicContact CH2-CG 3.89Å; W147-Q230 HydrophobicContact CZ3-CB 4.1Å; W147-V234 HydrophobicContact CB-CG1 4.29Å; W147-V234 HydrophobicContact CE3-CB 4.46Å; W147-V234 HydrophobicContact CE3-CG1 3.7Å; W147-M238 HydrophobicContact CB-CE 4.35Å; W147-M238 HydrophobicContact CB-SD 4.12Å; W147-M238 HydrophobicContact CD2-CE 4.07Å; W147-M238 HydrophobicContact CD2-SD 3.78Å; W147-M238 HydrophobicContact CE3-SD 3.77Å; W147-M238 HydrophobicContact CG-CE 3.93Å; W147-M238 HydrophobicContact CG-SD 3.95Å |
| 148 | F | 95.8 | Very high | 95.3 | Very high | 70 Ų | 70 | 48.4 Ų | 48.4 | 31% | 0.307 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.4 | -34 | 173 | 171 | -123 | 0 | 0 | 0 | 113.3 | C144 L145 V150 D151 A155 F158 | C144-F148 WeakPolarHBondContact O-CB 3.39Å; C144-F148 PolarHBondContact O-N 3.4Å; L145-F148 HydrophobicContact CD1-CD1 4.39Å; L145-F148 WeakPolarHBondContact O-CB 3.3Å; L145-F148 PolarHBondContact O-N 3.28Å; F148-V150 PolarHBondContact O-N 3.39Å; F148-D151 CarbonylContact O-C 3.38Å; F148-A155 HydrophobicContact CD2-CB 3.79Å; F148-A155 HydrophobicContact CE2-CB 3.55Å; F148-A155 HydrophobicContact CZ-CB 4.27Å; F148-F158 HydrophobicContact CB-CB 4.16Å; F148-F158 HydrophobicContact CD1-CD1 4.32Å |
| 149 | C | 95 | Very high | 95.3 | Very high | 101 Ų | 101 | 45.6 Ų | 45.6 | 68% | 0.682 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -68.2 | -21.5 | 174.9 | -67.6 | 0 | 0 | 0 | 0 | 113.6 | L145 A146 W147 | L145-C149 PolarHBondContact O-N 2.87Å; L145-C149 PolarHBondContact O-SG 3.5Å; A146-C149 PolarHBondContact O-N 2.83Å; W147-C149 VanDerWaalsContact C-N 3.3Å; W147-C149 PolarHBondContact O-N 2.77Å |
| 150 | V | 94.3 | Very high | 95.2 | Very high | 57 Ų | 57 | 44.2 Ų | 44.2 | 35% | 0.345 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -89.8 | -43.3 | 176 | 175.1 | 0 | 0 | 0 | 0 | 111 | A146 W147 F148 Q230 N231 V234 | A146-V150 PolarHBondContact O-N 3.37Å; W147-V150 HydrophobicContact CZ3-CG1 4.37Å; W147-V150 PolarHBondContact O-N 3.32Å; W147-V150 VanDerWaalsContact O-N 3.12Å; F148-V150 PolarHBondContact O-N 3.39Å; V150-Q230 HydrophobicContact CG1-CB 4.46Å; V150-N231 HydrophobicContact CG1-CB 3.91Å; V150-N231 HydrophobicContact CG2-CB 3.89Å; V150-V234 HydrophobicContact CG2-CB 4.37Å; V150-V234 HydrophobicContact CG2-CG2 3.73Å |
| 151 | D | 91.9 | Very high | 95.2 | Very high | 39 Ų | 39 | 44.2 Ų | 44.2 | 21% | 0.209 | 27% | 0.27 | C | S | . | . | trans | -132 | 109.9 | -178.2 | 178.1 | 7.3 | 0 | 0 | 0 | 110.2 | W147 F148 A153 R154 | W147-D151 PolarHBondContact O-N 2.62Å; F148-D151 CarbonylContact O-C 3.38Å; D151-A153 PolarHBondContact O-N 3.37Å; D151-A153 VanDerWaalsContact O-N 3.16Å; D151-A153 VanDerWaalsContact OD1-CB 3.24Å; D151-A153 WeakPolarHBondContact OD1-CB 3.44Å; D151-A153 PolarHBondContact OD1-N 2.88Å; D151-R154 HydrophobicContact CB-CG 3.82Å; D151-R154 VanDerWaalsContact O-CB 3.24Å; D151-R154 WeakPolarHBondContact O-CB 3.49Å; D151-R154 WeakPolarHBondContact O-CG 3.48Å; D151-R154 PolarHBondContact O-N 3.36Å; D151-R154 IonicContact OD2-NE 3.21Å | ||
| 152 | S | 92.2 | Very high | 95.2 | Very high | 97 Ų | 97 | 45.9 Ų | 45.9 | 68% | 0.678 | 28% | 0.278 | S | S | * | . | G | 310 helix | trans | -64.7 | -19.4 | -177.9 | 59.1 | 0 | 0 | 0 | 0 | 113.3 | R154 A155 | S152-R154 PolarHBondContact O-N 3.26Å; S152-R154 VanDerWaalsContact O-N 3.16Å; S152-A155 PolarHBondContact O-N 3.2Å |
| 153 | A | 91.3 | Very high | 95.1 | Very high | 67 Ų | 67 | 45.4 Ų | 45.4 | 55% | 0.554 | 28% | 0.28 | S | S | * | . | G | 310 helix | trans | -64.1 | -16.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | D151 A155 | D151-A153 PolarHBondContact O-N 3.37Å; D151-A153 VanDerWaalsContact O-N 3.16Å; D151-A153 VanDerWaalsContact OD1-CB 3.24Å; D151-A153 WeakPolarHBondContact OD1-CB 3.44Å; D151-A153 PolarHBondContact OD1-N 2.88Å; A153-A155 VanDerWaalsContact C-N 3.3Å; A153-A155 PolarHBondContact O-N 2.96Å |
| 154 | R | 92.5 | Very high | 95 | Very high | 30 Ų | 30 | 47.1 Ų | 47.1 | 11% | 0.113 | 29% | 0.286 | C | S | . | . | G | 310 helix | trans | -88.5 | 10.3 | -178.5 | -53.3 | -64.9 | -170.2 | 174.8 | 1.5 | 113.9 | W147 D151 S152 V156 D157 F158 | W147-R154 HydrophobicContact CG-CB 4.39Å; W147-R154 HydrophobicContact CG-CG 4.21Å; W147-R154 VanDerWaalsContact NE1-CD 3.32Å; W147-R154 VanDerWaalsContact NE1-CG 3.34Å; W147-R154 VanDerWaalsContact NE1-NE 3.15Å; D151-R154 HydrophobicContact CB-CG 3.82Å; D151-R154 VanDerWaalsContact O-CB 3.24Å; D151-R154 WeakPolarHBondContact O-CB 3.49Å; D151-R154 WeakPolarHBondContact O-CG 3.48Å; D151-R154 PolarHBondContact O-N 3.36Å; D151-R154 IonicContact OD2-NE 3.21Å; S152-R154 PolarHBondContact O-N 3.26Å; S152-R154 VanDerWaalsContact O-N 3.16Å; R154-V156 PolarHBondContact O-N 3.01Å; R154-D157 WeakPolarHBondContact CD-OD2 3.33Å; R154-D157 IonicContact NH1-OD2 3.51Å; R154-D157 WeakPolarHBondContact O-CB 3.15Å; R154-D157 PolarHBondContact O-N 3.48Å; R154-F158 PolarHBondContact O-N 3.4Å |
| 155 | A | 93.8 | Very high | 95 | Very high | 45 Ų | 45 | 49.5 Ų | 49.5 | 37% | 0.372 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -54.4 | -36.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | F148 S152 A153 F158 G159 | F148-A155 HydrophobicContact CD2-CB 3.79Å; F148-A155 HydrophobicContact CE2-CB 3.55Å; F148-A155 HydrophobicContact CZ-CB 4.27Å; S152-A155 PolarHBondContact O-N 3.2Å; A153-A155 VanDerWaalsContact C-N 3.3Å; A153-A155 PolarHBondContact O-N 2.96Å; A155-F158 PolarHBondContact O-N 2.93Å; A155-G159 PolarHBondContact O-N 3.48Å |
| 156 | V | 95.1 | Very high | 94.9 | Very high | 82 Ų | 82 | 51.9 Ų | 51.9 | 50% | 0.497 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -63 | -43.2 | 177.1 | 178.7 | 0 | 0 | 0 | 0 | 110.9 | R154 F158 G159 L160 | R154-V156 PolarHBondContact O-N 3.01Å; V156-F158 VanDerWaalsContact C-N 3.33Å; V156-F158 PolarHBondContact O-N 3.17Å; V156-G159 PolarHBondContact O-N 3.49Å; V156-L160 HydrophobicContact CG1-CD1 3.83Å; V156-L160 HydrophobicContact CG1-CG 4.27Å; V156-L160 WeakPolarHBondContact O-CB 3.5Å; V156-L160 VanDerWaalsContact O-CG 3.3Å; V156-L160 WeakPolarHBondContact O-CG 3.48Å; V156-L160 PolarHBondContact O-N 3.31Å |
| 157 | D | 95.1 | Very high | 94.7 | Very high | 3 Ų | 3 | 55 Ų | 55 | 2% | 0.016 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.4 | -40.9 | 177.8 | -72.1 | -55.7 | 0 | 0 | 0 | 111.2 | R154 S161 N215 W216 G217 | R154-D157 WeakPolarHBondContact CD-OD2 3.33Å; R154-D157 IonicContact NH1-OD2 3.51Å; R154-D157 WeakPolarHBondContact O-CB 3.15Å; R154-D157 PolarHBondContact O-N 3.48Å; D157-S161 WeakPolarHBondContact O-CB 3.29Å; D157-S161 PolarHBondContact O-N 2.75Å; D157-N215 WeakPolarHBondContact OD1-CA 3.32Å; D157-N215 PolarHBondContact OD1-N 2.82Å; D157-N215 VanDerWaalsContact OD1-N 3.15Å; D157-W216 PolarHBondContact OD1-N 3.38Å; D157-G217 WeakPolarHBondContact O-CA 3.15Å; D157-G217 PolarHBondContact OD1-N 3.46Å |
| 158 | F | 96.8 | Very high | 94.6 | Very high | 51 Ų | 51 | 56.5 Ų | 56.5 | 22% | 0.224 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -63.2 | -49.5 | 174.4 | 176.4 | -121.2 | 0 | 0 | 0 | 112.6 | I141 C144 L145 F148 R154 A155 V156 L160 S161 I162 | I141-F158 HydrophobicContact CG2-CD2 4.47Å; I141-F158 HydrophobicContact CG2-CE2 3.82Å; C144-F158 HydrophobicContact CB-CB 4.39Å; L145-F158 HydrophobicContact CB-CD2 3.79Å; L145-F158 HydrophobicContact CB-CE2 3.67Å; L145-F158 HydrophobicContact CB-CZ 4.48Å; L145-F158 HydrophobicContact CD1-CD2 4.26Å; L145-F158 HydrophobicContact CD1-CE1 4.22Å; L145-F158 HydrophobicContact CD1-CE2 3.87Å; L145-F158 HydrophobicContact CD1-CZ 3.84Å; L145-F158 HydrophobicContact CG-CE2 4.21Å; F148-F158 HydrophobicContact CB-CB 4.16Å; F148-F158 HydrophobicContact CD1-CD1 4.32Å; R154-F158 PolarHBondContact O-N 3.4Å; A155-F158 PolarHBondContact O-N 2.93Å; V156-F158 VanDerWaalsContact C-N 3.33Å; V156-F158 PolarHBondContact O-N 3.17Å; F158-L160 PolarHBondContact O-N 2.89Å; F158-S161 PolarHBondContact O-N 3.35Å; F158-S161 PolarHBondContact O-OG 3.42Å; F158-I162 HydrophobicContact CD2-CD1 4.43Å; F158-I162 HydrophobicContact CE1-CD1 4.02Å; F158-I162 HydrophobicContact CE2-CD1 3.85Å; F158-I162 HydrophobicContact CE2-CG1 4.31Å; F158-I162 HydrophobicContact CZ-CD1 3.63Å; F158-I162 PolarHBondContact O-N 3.43Å |
| 159 | G | 96 | Very high | 94.4 | Very high | 38 Ų | 38 | 54.3 Ų | 54.3 | 39% | 0.392 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -60.2 | -43.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | A155 V156 I162 L163 | A155-G159 PolarHBondContact O-N 3.48Å; V156-G159 PolarHBondContact O-N 3.49Å; G159-I162 PolarHBondContact O-N 2.9Å; G159-L163 PolarHBondContact O-N 3.47Å; G159-L163 VanDerWaalsContact O-N 3.1Å |
| 160 | L | 96.4 | Very high | 94.1 | Very high | 39 Ų | 39 | 53 Ų | 53 | 20% | 0.204 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -65.4 | -36.9 | 176.4 | -73.7 | 176.8 | 0 | 0 | 0 | 112.3 | V156 F158 I162 L163 W164 N215 | V156-L160 HydrophobicContact CG1-CD1 3.83Å; V156-L160 HydrophobicContact CG1-CG 4.27Å; V156-L160 WeakPolarHBondContact O-CB 3.5Å; V156-L160 VanDerWaalsContact O-CG 3.3Å; V156-L160 WeakPolarHBondContact O-CG 3.48Å; V156-L160 PolarHBondContact O-N 3.31Å; F158-L160 PolarHBondContact O-N 2.89Å; L160-I162 VanDerWaalsContact C-N 3.29Å; L160-I162 PolarHBondContact O-N 3.47Å; L160-L163 HydrophobicContact CD2-CD2 4.09Å; L160-L163 PolarHBondContact O-N 3.07Å; L160-W164 HydrophobicContact CD2-CZ2 4.15Å; L160-W164 WeakPolarHBondContact O-CB 3.27Å; L160-W164 PolarHBondContact O-N 2.75Å; L160-N215 WeakPolarHBondContact CD1-O 3.43Å |
| 161 | S | 97 | Very high | 93.9 | Very high | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.4 | -39.7 | 177.1 | 75.5 | 0 | 0 | 0 | 0 | 112.5 | N140 D157 F158 F165 G217 | N140-S161 WeakPolarHBondContact ND2-CB 3.31Å; D157-S161 WeakPolarHBondContact O-CB 3.29Å; D157-S161 PolarHBondContact O-N 2.75Å; F158-S161 PolarHBondContact O-N 3.35Å; F158-S161 PolarHBondContact O-OG 3.42Å; S161-F165 WeakPolarHBondContact O-CB 3.42Å; S161-F165 PolarHBondContact O-N 3.17Å; S161-G217 WeakPolarHBondContact CB-O 3.31Å |
| 162 | I | 97.4 | Very high | 93.9 | Very high | 59 Ų | 59 | 51.1 Ų | 51.1 | 30% | 0.303 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -68.5 | -47.2 | 175.9 | -62.6 | 169.8 | 0 | 0 | 0 | 110.1 | I141 F158 G159 L160 W164 F165 L166 | I141-I162 HydrophobicContact CD1-CG1 4.36Å; I141-I162 HydrophobicContact CG1-CG1 4.31Å; I141-I162 HydrophobicContact CG2-CG1 3.98Å; F158-I162 HydrophobicContact CD2-CD1 4.43Å; F158-I162 HydrophobicContact CE1-CD1 4.02Å; F158-I162 HydrophobicContact CE2-CD1 3.85Å; F158-I162 HydrophobicContact CE2-CG1 4.31Å; F158-I162 HydrophobicContact CZ-CD1 3.63Å; F158-I162 PolarHBondContact O-N 3.43Å; G159-I162 PolarHBondContact O-N 2.9Å; L160-I162 VanDerWaalsContact C-N 3.29Å; L160-I162 PolarHBondContact O-N 3.47Å; I162-W164 VanDerWaalsContact C-N 3.32Å; I162-W164 PolarHBondContact O-N 3Å; I162-F165 PolarHBondContact O-N 3.29Å; I162-L166 HydrophobicContact CG2-CD1 4Å; I162-L166 HydrophobicContact CG2-CG 4.42Å; I162-L166 WeakPolarHBondContact O-CG 3.25Å; I162-L166 PolarHBondContact O-N 2.88Å |
| 163 | L | 96.4 | Very high | 93.7 | Very high | 88 Ų | 88 | 47.4 Ų | 47.4 | 46% | 0.461 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -56.7 | -46.9 | 177.2 | 178 | 65.2 | 0 | 0 | 0 | 111.2 | G159 L160 L166 L167 | G159-L163 PolarHBondContact O-N 3.47Å; G159-L163 VanDerWaalsContact O-N 3.1Å; L160-L163 HydrophobicContact CD2-CD2 4.09Å; L160-L163 PolarHBondContact O-N 3.07Å; L163-L166 PolarHBondContact O-N 3.42Å; L163-L167 WeakPolarHBondContact O-CB 3.45Å; L163-L167 PolarHBondContact O-N 3.42Å |
| 164 | W | 94.8 | Very high | 93.6 | Very high | 36 Ų | 36 | 48.6 Ų | 48.6 | 14% | 0.136 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -65.4 | -41 | 179 | -62.8 | 141.9 | 0 | 0 | 0 | 112.5 | L160 I162 L166 L167 F168 W216 | L160-W164 HydrophobicContact CD2-CZ2 4.15Å; L160-W164 WeakPolarHBondContact O-CB 3.27Å; L160-W164 PolarHBondContact O-N 2.75Å; I162-W164 VanDerWaalsContact C-N 3.32Å; I162-W164 PolarHBondContact O-N 3Å; W164-L166 PolarHBondContact O-N 2.85Å; W164-L167 HydrophobicContact CE3-CD2 4.21Å; W164-L167 HydrophobicContact CZ3-CD2 3.99Å; W164-L167 PolarHBondContact O-N 3.01Å; W164-F168 HydrophobicContact CB-CD2 3.83Å; W164-F168 HydrophobicContact CB-CE2 3.97Å; W164-F168 HydrophobicContact CD2-CD2 4.4Å; W164-F168 AromaticContact CD2-CE2 3.7Å; W164-F168 HydrophobicContact CD2-CE2 3.7Å; W164-F168 AromaticContact CD2-CZ 3.91Å; W164-F168 HydrophobicContact CD2-CZ 3.91Å; W164-F168 HydrophobicContact CE3-CD1 4.46Å; W164-F168 HydrophobicContact CE3-CD2 4.23Å; W164-F168 AromaticContact CE3-CE1 3.82Å; W164-F168 HydrophobicContact CE3-CE1 3.82Å; W164-F168 AromaticContact CE3-CE2 3.56Å; W164-F168 HydrophobicContact CE3-CE2 3.56Å; W164-F168 AromaticContact CE3-CZ 3.32Å; W164-F168 HydrophobicContact CE3-CZ 3.32Å; W164-F168 HydrophobicContact CG-CD2 4.27Å; W164-F168 AromaticContact CG-CE2 3.88Å; W164-F168 HydrophobicContact CG-CE2 3.88Å; W164-F168 HydrophobicContact CH2-CZ 4.5Å; W164-F168 HydrophobicContact CZ3-CE1 4.08Å; W164-F168 HydrophobicContact CZ3-CE2 4.34Å; W164-F168 AromaticContact CZ3-CZ 3.68Å; W164-F168 HydrophobicContact CZ3-CZ 3.68Å; W164-F168 WeakPolarHBondContact O-CA 3.36Å; W164-F168 WeakPolarHBondContact O-CB 3.2Å; W164-F168 PolarHBondContact O-N 2.67Å; W164-W216 PolarHBondContact NE1-O 3.32Å |
| 165 | F | 96 | Very high | 93.3 | Very high | 51 Ų | 51 | 49.5 Ų | 49.5 | 22% | 0.224 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -59.2 | -47.3 | 173.8 | 173.8 | -107.8 | 0 | 0 | 0 | 111.7 | L137 F138 I141 S161 I162 T169 | L137-F165 HydrophobicContact CB-CB 4.34Å; L137-F165 HydrophobicContact CB-CD2 3.83Å; F138-F165 HydrophobicContact CB-CD2 4.18Å; F138-F165 HydrophobicContact CB-CE2 3.79Å; F138-F165 HydrophobicContact CB-CZ 4.38Å; F138-F165 HydrophobicContact CD2-CE2 4.4Å; F138-F165 HydrophobicContact CD2-CZ 4.18Å; I141-F165 HydrophobicContact CD1-CB 3.76Å; I141-F165 HydrophobicContact CD1-CD1 3.85Å; I141-F165 HydrophobicContact CD1-CG 3.81Å; I141-F165 HydrophobicContact CG1-CB 4.33Å; S161-F165 WeakPolarHBondContact O-CB 3.42Å; S161-F165 PolarHBondContact O-N 3.17Å; I162-F165 PolarHBondContact O-N 3.29Å; F165-T169 WeakPolarHBondContact O-CB 3.42Å; F165-T169 PolarHBondContact O-N 2.93Å; F165-T169 PolarHBondContact O-OG1 2.97Å |
| 166 | L | 94.1 | Very high | 93.2 | Very high | 114 Ų | 114 | 47.5 Ų | 47.5 | 60% | 0.597 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -71.5 | -32.7 | -178.4 | -67 | 179.1 | 0 | 0 | 0 | 113.3 | I162 L163 W164 P170 | I162-L166 HydrophobicContact CG2-CD1 4Å; I162-L166 HydrophobicContact CG2-CG 4.42Å; I162-L166 WeakPolarHBondContact O-CG 3.25Å; I162-L166 PolarHBondContact O-N 2.88Å; L163-L166 PolarHBondContact O-N 3.42Å; W164-L166 PolarHBondContact O-N 2.85Å; L166-P170 WeakPolarHBondContact O-CD 3.17Å; L166-P170 WeakPolarHBondContact O-CG 3.48Å |
| 167 | L | 92.9 | Very high | 93 | Very high | 86 Ų | 86 | 43.6 Ų | 43.6 | 45% | 0.45 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -85.1 | -53.8 | -179.3 | -176.9 | 67.4 | 0 | 0 | 0 | 111.8 | L163 W164 P170 C171 | L163-L167 WeakPolarHBondContact O-CB 3.45Å; L163-L167 PolarHBondContact O-N 3.42Å; W164-L167 HydrophobicContact CE3-CD2 4.21Å; W164-L167 HydrophobicContact CZ3-CD2 3.99Å; W164-L167 PolarHBondContact O-N 3.01Å; L167-P170 WeakPolarHBondContact O-CD 3.49Å; L167-C171 WeakPolarHBondContact O-CB 3.42Å; L167-C171 PolarHBondContact O-N 3.23Å; L167-C171 VanDerWaalsContact O-N 3.11Å |
| 168 | F | 91.9 | Very high | 92.7 | Very high | 33 Ų | 33 | 48.1 Ų | 48.1 | 15% | 0.145 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -73 | -31.2 | -172.3 | -64.9 | -25.9 | 0 | 0 | 0 | 112.7 | L137 W164 S172 V205 | L137-F168 HydrophobicContact CD1-CB 3.99Å; W164-F168 HydrophobicContact CB-CD2 3.83Å; W164-F168 HydrophobicContact CB-CE2 3.97Å; W164-F168 HydrophobicContact CD2-CD2 4.4Å; W164-F168 AromaticContact CD2-CE2 3.7Å; W164-F168 HydrophobicContact CD2-CE2 3.7Å; W164-F168 AromaticContact CD2-CZ 3.91Å; W164-F168 HydrophobicContact CD2-CZ 3.91Å; W164-F168 HydrophobicContact CE3-CD1 4.46Å; W164-F168 HydrophobicContact CE3-CD2 4.23Å; W164-F168 AromaticContact CE3-CE1 3.82Å; W164-F168 HydrophobicContact CE3-CE1 3.82Å; W164-F168 AromaticContact CE3-CE2 3.56Å; W164-F168 HydrophobicContact CE3-CE2 3.56Å; W164-F168 AromaticContact CE3-CZ 3.32Å; W164-F168 HydrophobicContact CE3-CZ 3.32Å; W164-F168 HydrophobicContact CG-CD2 4.27Å; W164-F168 AromaticContact CG-CE2 3.88Å; W164-F168 HydrophobicContact CG-CE2 3.88Å; W164-F168 HydrophobicContact CH2-CZ 4.5Å; W164-F168 HydrophobicContact CZ3-CE1 4.08Å; W164-F168 HydrophobicContact CZ3-CE2 4.34Å; W164-F168 AromaticContact CZ3-CZ 3.68Å; W164-F168 HydrophobicContact CZ3-CZ 3.68Å; W164-F168 WeakPolarHBondContact O-CA 3.36Å; W164-F168 WeakPolarHBondContact O-CB 3.2Å; W164-F168 PolarHBondContact O-N 2.67Å; F168-S172 WeakPolarHBondContact O-CB 3.48Å; F168-S172 PolarHBondContact O-N 2.78Å; F168-S172 PolarHBondContact O-OG 2.99Å; F168-V205 HydrophobicContact CD2-CG1 4.42Å; F168-V205 HydrophobicContact CE2-CG1 4.08Å; F168-V205 HydrophobicContact CZ-CG1 4.47Å |
| 169 | T | 91.1 | Very high | 92.3 | Very high | 25 Ų | 25 | 46.9 Ų | 46.9 | 15% | 0.153 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.5 | -56.1 | 178.3 | -57.1 | 0 | 0 | 0 | 0 | 112.8 | W130 A134 F165 S172 F173 | W130-T169 HydrophobicContact CZ2-CG2 4.1Å; W130-T169 PolarHBondContact NE1-O 3.47Å; A134-T169 HydrophobicContact CB-CG2 3.87Å; F165-T169 WeakPolarHBondContact O-CB 3.42Å; F165-T169 PolarHBondContact O-N 2.93Å; F165-T169 PolarHBondContact O-OG1 2.97Å; T169-S172 PolarHBondContact O-OG 3.33Å; T169-F173 PolarHBondContact O-N 3.38Å |
| 170 | P | 90.2 | Very high | 92.1 | Very high | 72 Ų | 72 | 45 Ų | 45 | 47% | 0.468 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -71.8 | -37.5 | 177 | 28.1 | -34.6 | 0 | 0 | 0 | 112.7 | L166 L167 F173 V174 | L166-P170 WeakPolarHBondContact O-CD 3.17Å; L166-P170 WeakPolarHBondContact O-CG 3.48Å; L167-P170 WeakPolarHBondContact O-CD 3.49Å; P170-F173 PolarHBondContact O-N 3.05Å; P170-V174 WeakPolarHBondContact O-CG2 3.41Å; P170-V174 PolarHBondContact O-N 2.87Å |
| 171 | C | 89.9 | Confident | 91.7 | Very high | 56 Ų | 56 | 44.1 Ų | 44.1 | 38% | 0.378 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -61.6 | -48.5 | 178.8 | -179 | 0 | 0 | 0 | 0 | 111.1 | L167 F173 V174 C175 | L167-C171 WeakPolarHBondContact O-CB 3.42Å; L167-C171 PolarHBondContact O-N 3.23Å; L167-C171 VanDerWaalsContact O-N 3.11Å; C171-F173 VanDerWaalsContact C-N 3.3Å; C171-F173 PolarHBondContact O-N 3.38Å; C171-V174 PolarHBondContact O-N 2.89Å; C171-C175 WeakPolarHBondContact O-CB 3.3Å; C171-C175 PolarHBondContact O-N 3.38Å; C171-C175 PolarHBondContact O-SG 2.88Å |
| 172 | S | 90.8 | Very high | 91.1 | Very high | 2 Ų | 2 | 44.6 Ų | 44.6 | 1% | 0.014 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61 | -38.5 | 178.6 | 65.9 | 0 | 0 | 0 | 0 | 112.3 | W130 F168 T169 W176 Y177 | W130-S172 VanDerWaalsContact CD1-OG 3.26Å; W130-S172 PolarHBondContact NE1-OG 3.13Å; W130-S172 VanDerWaalsContact NE1-OG 3.12Å; F168-S172 WeakPolarHBondContact O-CB 3.48Å; F168-S172 PolarHBondContact O-N 2.78Å; F168-S172 PolarHBondContact O-OG 2.99Å; T169-S172 PolarHBondContact O-OG 3.33Å; S172-W176 VanDerWaalsContact CB-NE1 3.32Å; S172-W176 PolarHBondContact O-N 3.07Å; S172-W176 PolarHBondContact O-NE1 3.31Å; S172-Y177 PolarHBondContact O-N 3.24Å |
| 173 | F | 89.3 | Confident | 90.6 | Very high | 18 Ų | 18 | 41.8 Ų | 41.8 | 8% | 0.079 | 22% | 0.224 | C | C | . | . | I | π-helix | trans | -61.9 | -48 | 175.9 | -174.6 | -102.6 | 0 | 0 | 0 | 112 | W130 T169 P170 C171 Y177 R178 | W130-F173 AromaticContact CD2-CD2 3.99Å; W130-F173 HydrophobicContact CD2-CD2 3.99Å; W130-F173 AromaticContact CE2-CD2 3.7Å; W130-F173 HydrophobicContact CE3-CD2 4.23Å; W130-F173 AromaticContact CH2-CD2 3.97Å; W130-F173 HydrophobicContact CH2-CD2 3.97Å; W130-F173 HydrophobicContact CH2-CE2 4.48Å; W130-F173 HydrophobicContact CZ2-CB 3.85Å; W130-F173 AromaticContact CZ2-CD2 3.7Å; W130-F173 HydrophobicContact CZ2-CD2 3.7Å; W130-F173 HydrophobicContact CZ2-CG 4.06Å; W130-F173 HydrophobicContact CZ3-CD2 4.23Å; T169-F173 PolarHBondContact O-N 3.38Å; P170-F173 PolarHBondContact O-N 3.05Å; C171-F173 VanDerWaalsContact C-N 3.3Å; C171-F173 PolarHBondContact O-N 3.38Å; F173-Y177 AromaticContact CD2-CD1 3.56Å; F173-Y177 HydrophobicContact CD2-CD1 3.56Å; F173-Y177 HydrophobicContact CD2-CE1 4.25Å; F173-Y177 HydrophobicContact CD2-CG 4.29Å; F173-Y177 AromaticContact CE2-CD1 3.34Å; F173-Y177 HydrophobicContact CE2-CD1 3.34Å; F173-Y177 AromaticContact CE2-CE1 3.59Å; F173-Y177 HydrophobicContact CE2-CE1 3.59Å; F173-Y177 HydrophobicContact CE2-CG 4.42Å; F173-Y177 HydrophobicContact CG-CD1 4.46Å; F173-Y177 HydrophobicContact CZ-CD1 4.08Å; F173-Y177 HydrophobicContact CZ-CE1 4.22Å; F173-Y177 WeakPolarHBondContact O-CB 3.44Å; F173-Y177 PolarHBondContact O-N 3Å; F173-R178 HydrophobicContact CD1-CG 4.23Å; F173-R178 HydrophobicContact CE1-CG 4.04Å; F173-R178 WeakPolarHBondContact O-CB 3.27Å; F173-R178 WeakPolarHBondContact O-CG 3.43Å; F173-R178 PolarHBondContact O-N 3.42Å |
| 174 | V | 88.3 | Confident | 90.1 | Very high | 92 Ų | 92 | 37.8 Ų | 37.8 | 56% | 0.558 | 20% | 0.203 | S | C | * | . | I | π-helix | trans | -76.4 | -40 | -176.4 | 175.7 | 0 | 0 | 0 | 0 | 111.9 | P170 C171 R178 P179 | P170-V174 WeakPolarHBondContact O-CG2 3.41Å; P170-V174 PolarHBondContact O-N 2.87Å; C171-V174 PolarHBondContact O-N 2.89Å; V174-R178 WeakPolarHBondContact O-CB 3.3Å; V174-P179 WeakPolarHBondContact O-CD 3.23Å |
| 175 | C | 87.1 | Confident | 89.6 | Confident | 50 Ų | 50 | 40.9 Ų | 40.9 | 34% | 0.338 | 22% | 0.215 | S | C | . | . | I | π-helix | trans | -87.2 | -25.9 | -167.4 | -63.1 | 0 | 0 | 0 | 0 | 113.1 | C171 P179 V198 | C171-C175 WeakPolarHBondContact O-CB 3.3Å; C171-C175 PolarHBondContact O-N 3.38Å; C171-C175 PolarHBondContact O-SG 2.88Å; C175-P179 WeakPolarHBondContact O-CG 3.49Å; C175-V198 HydrophobicContact CB-CG1 3.85Å; C175-V198 WeakPolarHBondContact O-CG1 3.46Å |
| 176 | W | 91.1 | Very high | 88.7 | Confident | 2 Ų | 2 | 41.5 Ų | 41.5 | 1% | 0.008 | 23% | 0.225 | C | C | . | . | I | π-helix | trans | -128.7 | -41.7 | 176.8 | 74.5 | -103.6 | 0 | 0 | 0 | 114.2 | M126 W130 S172 L180 F195 V198 Y199 | M126-W176 HydrophobicContact CB-CZ3 4.36Å; M126-W176 HydrophobicContact CE-CE3 4.32Å; M126-W176 HydrophobicContact CE-CZ3 3.83Å; M126-W176 WeakPolarHBondContact O-CH2 3.36Å; M126-W176 HydrophobicContact SD-CZ3 4.42Å; W130-W176 HydrophobicContact CB-CH2 3.79Å; W130-W176 HydrophobicContact CB-CZ2 3.71Å; W130-W176 HydrophobicContact CG-CZ2 4.33Å; S172-W176 VanDerWaalsContact CB-NE1 3.32Å; S172-W176 PolarHBondContact O-N 3.07Å; S172-W176 PolarHBondContact O-NE1 3.31Å; W176-L180 HydrophobicContact CZ3-CD2 4.39Å; W176-L180 VanDerWaalsContact O-CB 3.3Å; W176-L180 WeakPolarHBondContact O-CB 3.4Å; W176-L180 PolarHBondContact O-N 2.82Å; W176-F195 HydrophobicContact CB-CD2 4.36Å; W176-F195 AromaticContact CE3-CE2 3.96Å; W176-F195 HydrophobicContact CE3-CE2 3.96Å; W176-F195 WeakPolarHBondContact O-CD2 3.33Å; W176-V198 HydrophobicContact CB-CG1 4.1Å; W176-Y199 HydrophobicContact CB-CD2 4.08Å; W176-Y199 AromaticContact CD2-CD2 3.65Å; W176-Y199 HydrophobicContact CD2-CD2 3.65Å; W176-Y199 AromaticContact CD2-CE2 3.7Å; W176-Y199 HydrophobicContact CD2-CE2 3.7Å; W176-Y199 AromaticContact CE3-CD2 3.62Å; W176-Y199 HydrophobicContact CE3-CD2 3.62Å; W176-Y199 AromaticContact CE3-CE2 3.5Å; W176-Y199 HydrophobicContact CE3-CE2 3.5Å; W176-Y199 VanDerWaalsContact CE3-CE2 3.5Å; W176-Y199 AromaticContact CG-CD2 3.87Å; W176-Y199 HydrophobicContact CG-CD2 3.87Å; W176-Y199 HydrophobicContact CG-CE2 4.37Å; W176-Y199 HydrophobicContact CH2-CE2 4.02Å; W176-Y199 HydrophobicContact CZ2-CE2 4.19Å; W176-Y199 HydrophobicContact CZ3-CD2 4.27Å; W176-Y199 AromaticContact CZ3-CE2 3.68Å; W176-Y199 HydrophobicContact CZ3-CE2 3.68Å |
| 177 | Y | 90.6 | Very high | 87.8 | Confident | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 21% | 0.211 | C | C | . | . | I | π-helix | trans | -68.6 | -41.9 | -177 | 175.4 | -100.7 | 0 | 0 | 0 | 111.8 | Q109 F111 Y127 S172 F173 L180 Y181 | Q109-Y177 PolarHBondContact NE2-OH 3.18Å; F111-Y177 VanDerWaalsContact CE1-OH 3.29Å; F111-Y177 WeakPolarHBondContact CE1-OH 3.31Å; F111-Y177 WeakPolarHBondContact CZ-OH 3.33Å; Y127-Y177 WeakPolarHBondContact CB-OH 3.48Å; Y127-Y177 AromaticContact CD2-CE1 3.96Å; Y127-Y177 HydrophobicContact CD2-CE1 3.96Å; Y127-Y177 AromaticContact CD2-CE2 3.91Å; Y127-Y177 HydrophobicContact CD2-CE2 3.91Å; Y127-Y177 AromaticContact CD2-CZ 3.49Å; Y127-Y177 VanDerWaalsContact CD2-CZ 3.49Å; Y127-Y177 WeakPolarHBondContact CD2-OH 3.4Å; Y127-Y177 HydrophobicContact CG-CE2 4.22Å; S172-Y177 PolarHBondContact O-N 3.24Å; F173-Y177 AromaticContact CD2-CD1 3.56Å; F173-Y177 HydrophobicContact CD2-CD1 3.56Å; F173-Y177 HydrophobicContact CD2-CE1 4.25Å; F173-Y177 HydrophobicContact CD2-CG 4.29Å; F173-Y177 AromaticContact CE2-CD1 3.34Å; F173-Y177 HydrophobicContact CE2-CD1 3.34Å; F173-Y177 AromaticContact CE2-CE1 3.59Å; F173-Y177 HydrophobicContact CE2-CE1 3.59Å; F173-Y177 HydrophobicContact CE2-CG 4.42Å; F173-Y177 HydrophobicContact CG-CD1 4.46Å; F173-Y177 HydrophobicContact CZ-CD1 4.08Å; F173-Y177 HydrophobicContact CZ-CE1 4.22Å; F173-Y177 WeakPolarHBondContact O-CB 3.44Å; F173-Y177 PolarHBondContact O-N 3Å; Y177-L180 WeakPolarHBondContact O-CB 3.09Å; Y177-L180 PolarHBondContact O-N 3.44Å; Y177-Y181 WeakPolarHBondContact O-CB 3.22Å; Y177-Y181 PolarHBondContact O-N 3.1Å |
| 178 | R | 88.1 | Confident | 87.2 | Confident | 99 Ų | 99 | 35.3 Ų | 35.3 | 37% | 0.374 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -62.4 | -51 | 176.2 | -85.7 | -73.2 | -168.5 | 125.7 | 9.2 | 113.1 | F173 V174 L180 Y181 G182 | F173-R178 HydrophobicContact CD1-CG 4.23Å; F173-R178 HydrophobicContact CE1-CG 4.04Å; F173-R178 WeakPolarHBondContact O-CB 3.27Å; F173-R178 WeakPolarHBondContact O-CG 3.43Å; F173-R178 PolarHBondContact O-N 3.42Å; V174-R178 WeakPolarHBondContact O-CB 3.3Å; R178-L180 VanDerWaalsContact C-N 3.28Å; R178-L180 PolarHBondContact O-N 3.25Å; R178-Y181 PolarHBondContact O-N 2.82Å; R178-G182 PolarHBondContact O-N 3.4Å |
| 179 | P | 89.6 | Confident | 86.7 | Confident | 24 Ų | 24 | 33.7 Ų | 33.7 | 16% | 0.156 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -54.4 | -43.2 | 172.1 | -32.4 | 37.8 | 0 | 0 | 0 | 112.9 | V174 C175 G182 A183 V194 F195 | V174-P179 WeakPolarHBondContact O-CD 3.23Å; C175-P179 WeakPolarHBondContact O-CG 3.49Å; P179-G182 PolarHBondContact O-N 3.4Å; P179-A183 VanDerWaalsContact O-CB 3.26Å; P179-A183 WeakPolarHBondContact O-CB 3.42Å; P179-A183 PolarHBondContact O-N 3.41Å; P179-V194 HydrophobicContact CB-CG1 4.35Å; P179-V194 HydrophobicContact CG-CG1 4.26Å; P179-F195 HydrophobicContact CB-CB 4.18Å |
| 180 | L | 90.6 | Very high | 86.2 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.3 | -51.5 | 176.2 | -179.2 | 81.4 | 0 | 0 | 0 | 112.5 | M126 W176 Y177 R178 G182 A183 F184 F195 V259 | M126-L180 HydrophobicContact CB-CD2 3.35Å; M126-L180 HydrophobicContact CE-CD1 4.2Å; M126-L180 HydrophobicContact CE-CD2 3.7Å; M126-L180 HydrophobicContact CG-CD2 3.48Å; M126-L180 VanDerWaalsContact CG-CD2 3.48Å; M126-L180 HydrophobicContact SD-CD2 4.4Å; W176-L180 HydrophobicContact CZ3-CD2 4.39Å; W176-L180 VanDerWaalsContact O-CB 3.3Å; W176-L180 WeakPolarHBondContact O-CB 3.4Å; W176-L180 PolarHBondContact O-N 2.82Å; Y177-L180 WeakPolarHBondContact O-CB 3.09Å; Y177-L180 PolarHBondContact O-N 3.44Å; R178-L180 VanDerWaalsContact C-N 3.28Å; R178-L180 PolarHBondContact O-N 3.25Å; L180-G182 VanDerWaalsContact C-N 3.28Å; L180-G182 PolarHBondContact O-N 3.36Å; L180-A183 WeakPolarHBondContact O-CB 3.48Å; L180-A183 PolarHBondContact O-N 3.09Å; L180-A183 VanDerWaalsContact O-N 3.14Å; L180-F184 HydrophobicContact CD1-CD2 3.95Å; L180-F184 HydrophobicContact CD1-CE2 3.57Å; L180-F184 HydrophobicContact CG-CD2 4.1Å; L180-F184 HydrophobicContact CG-CE2 4.17Å; L180-F184 WeakPolarHBondContact O-CD2 3.36Å; L180-F184 PolarHBondContact O-N 3.13Å; L180-F184 VanDerWaalsContact O-N 3.09Å; L180-F195 HydrophobicContact CB-CD2 3.67Å; L180-F195 HydrophobicContact CB-CE2 4.03Å; L180-F195 HydrophobicContact CB-CG 4.19Å; L180-F195 HydrophobicContact CD1-CD1 3.95Å; L180-F195 HydrophobicContact CD1-CD2 3.85Å; L180-F195 HydrophobicContact CD1-CE1 3.82Å; L180-F195 HydrophobicContact CD1-CE2 3.7Å; L180-F195 HydrophobicContact CD1-CG 3.97Å; L180-F195 HydrophobicContact CD1-CZ 3.7Å; L180-F195 HydrophobicContact CD2-CE2 4.47Å; L180-F195 HydrophobicContact CG-CD2 4.32Å; L180-F195 HydrophobicContact CG-CE2 4.28Å; L180-V259 HydrophobicContact CD1-CG1 3.88Å; L180-V259 HydrophobicContact CD1-CG2 4.25Å |
| 181 | Y | 88.3 | Confident | 86 | Confident | 20 Ų | 20 | 38.1 Ų | 38.1 | 8% | 0.078 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -59.3 | -44.4 | 178.8 | -175.3 | -93.3 | 0 | 0 | 0 | 110.8 | Q109 D110 F111 D114 I115 V123 Y177 R178 A183 R185 | Q109-Y181 HydrophobicContact CG-CE2 4.15Å; D110-Y181 PolarHBondContact N-OH 3.2Å; D110-Y181 PolarHBondContact O-OH 2.86Å; F111-Y181 HydrophobicContact CD1-CE2 4.02Å; F111-Y181 HydrophobicContact CE1-CD2 4.25Å; F111-Y181 HydrophobicContact CE1-CE2 4.04Å; D114-Y181 HydrophobicContact CB-CE1 4.46Å; D114-Y181 VanDerWaalsContact CB-OH 3.27Å; D114-Y181 WeakPolarHBondContact CB-OH 3.44Å; D114-Y181 PolarHBondContact OD2-OH 3.48Å; I115-Y181 HydrophobicContact CD1-CD2 4.23Å; I115-Y181 HydrophobicContact CD1-CE2 4.1Å; I115-Y181 HydrophobicContact CG1-CE2 4.05Å; V123-Y181 HydrophobicContact CG1-CD2 3.81Å; V123-Y181 HydrophobicContact CG1-CE2 4.48Å; Y177-Y181 WeakPolarHBondContact O-CB 3.22Å; Y177-Y181 PolarHBondContact O-N 3.1Å; R178-Y181 PolarHBondContact O-N 2.82Å; Y181-A183 VanDerWaalsContact C-N 3.32Å; Y181-A183 PolarHBondContact O-N 3.02Å; Y181-R185 VanDerWaalsContact O-CB 3.28Å; Y181-R185 WeakPolarHBondContact O-CB 3.48Å; Y181-R185 PolarHBondContact O-N 2.94Å |
| 182 | G | 84.9 | Confident | 85.9 | Confident | 9 Ų | 9 | 35.5 Ų | 35.5 | 9% | 0.093 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.3 | -34.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | R178 P179 L180 S186 R191 | R178-G182 PolarHBondContact O-N 3.4Å; P179-G182 PolarHBondContact O-N 3.4Å; L180-G182 VanDerWaalsContact C-N 3.28Å; L180-G182 PolarHBondContact O-N 3.36Å; G182-S186 PolarHBondContact O-N 2.79Å; G182-S186 PolarHBondContact O-OG 3.4Å; G182-R191 VanDerWaalsContact C-CD 3.45Å; G182-R191 WeakPolarHBondContact O-CD 3.45Å; G182-R191 PolarHBondContact O-NH1 3.18Å |
| 183 | A | 87.1 | Confident | 85.7 | Confident | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -66.9 | -47.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | P179 L180 Y181 D187 S188 R191 F192 | P179-A183 VanDerWaalsContact O-CB 3.26Å; P179-A183 WeakPolarHBondContact O-CB 3.42Å; P179-A183 PolarHBondContact O-N 3.41Å; L180-A183 WeakPolarHBondContact O-CB 3.48Å; L180-A183 PolarHBondContact O-N 3.09Å; L180-A183 VanDerWaalsContact O-N 3.14Å; Y181-A183 VanDerWaalsContact C-N 3.32Å; Y181-A183 PolarHBondContact O-N 3.02Å; A183-D187 WeakPolarHBondContact O-CA 3.48Å; A183-D187 PolarHBondContact O-N 3Å; A183-S188 PolarHBondContact O-N 3.37Å; A183-R191 HydrophobicContact CB-CB 3.7Å; A183-F192 HydrophobicContact CB-CB 4.48Å; A183-F192 HydrophobicContact CB-CD1 3.86Å; A183-F192 HydrophobicContact CB-CD2 3.75Å; A183-F192 HydrophobicContact CB-CE1 3.94Å; A183-F192 HydrophobicContact CB-CE2 3.82Å; A183-F192 HydrophobicContact CB-CG 3.75Å; A183-F192 HydrophobicContact CB-CZ 3.91Å |
| 184 | F | 85.4 | Confident | 85.7 | Confident | 4 Ų | 4 | 42 Ų | 42 | 2% | 0.018 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -74.1 | -26.3 | 178.3 | -78.5 | -72 | 0 | 0 | 0 | 114 | I115 F119 V123 L180 F192 V259 L262 | I115-F184 HydrophobicContact CD1-CB 4.01Å; I115-F184 HydrophobicContact CG2-CB 4.41Å; F119-F184 HydrophobicContact CB-CD1 3.62Å; F119-F184 HydrophobicContact CB-CE1 4.03Å; F119-F184 HydrophobicContact CB-CG 4.35Å; F119-F184 HydrophobicContact CD1-CD1 4.2Å; F119-F184 AromaticContact CD1-CE1 3.98Å; F119-F184 HydrophobicContact CD1-CE1 3.98Å; F119-F184 AromaticContact CD2-CD1 3.78Å; F119-F184 HydrophobicContact CD2-CD1 3.78Å; F119-F184 HydrophobicContact CD2-CE1 4.33Å; F119-F184 AromaticContact CG-CD1 3.59Å; F119-F184 HydrophobicContact CG-CD1 3.59Å; F119-F184 AromaticContact CG-CE1 3.84Å; F119-F184 HydrophobicContact CG-CE1 3.84Å; V123-F184 HydrophobicContact CG2-CB 3.74Å; V123-F184 HydrophobicContact CG2-CD1 4.41Å; V123-F184 HydrophobicContact CG2-CD2 3.51Å; V123-F184 HydrophobicContact CG2-CE2 4.18Å; V123-F184 HydrophobicContact CG2-CG 3.64Å; L180-F184 HydrophobicContact CD1-CD2 3.95Å; L180-F184 HydrophobicContact CD1-CE2 3.57Å; L180-F184 HydrophobicContact CG-CD2 4.1Å; L180-F184 HydrophobicContact CG-CE2 4.17Å; L180-F184 WeakPolarHBondContact O-CD2 3.36Å; L180-F184 PolarHBondContact O-N 3.13Å; L180-F184 VanDerWaalsContact O-N 3.09Å; F184-F192 HydrophobicContact CD1-CE1 4.45Å; F184-F192 AromaticContact CD1-CZ 3.84Å; F184-F192 HydrophobicContact CD1-CZ 3.84Å; F184-F192 HydrophobicContact CD2-CE1 4.13Å; F184-F192 HydrophobicContact CD2-CZ 4.17Å; F184-F192 HydrophobicContact CE1-CE1 4.07Å; F184-F192 AromaticContact CE1-CZ 3.74Å; F184-F192 HydrophobicContact CE1-CZ 3.74Å; F184-F192 AromaticContact CE2-CE1 3.72Å; F184-F192 HydrophobicContact CE2-CE1 3.72Å; F184-F192 HydrophobicContact CE2-CZ 4.08Å; F184-F192 HydrophobicContact CG-CE1 4.48Å; F184-F192 HydrophobicContact CG-CZ 4.07Å; F184-F192 AromaticContact CZ-CE1 3.69Å; F184-F192 HydrophobicContact CZ-CE1 3.69Å; F184-F192 AromaticContact CZ-CZ 3.87Å; F184-F192 HydrophobicContact CZ-CZ 3.87Å; F184-V259 HydrophobicContact CE2-CG1 4.06Å; F184-V259 HydrophobicContact CE2-CG2 4.42Å; F184-V259 HydrophobicContact CZ-CG1 4.1Å; F184-L262 HydrophobicContact CE1-CB 4.35Å; F184-L262 HydrophobicContact CZ-CB 4.32Å; F184-L262 HydrophobicContact CZ-CD1 4.43Å |
| 185 | R | 84.1 | Confident | 85.9 | Confident | 102 Ų | 102 | 37.6 Ų | 37.6 | 39% | 0.385 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -70.6 | -42.9 | 175.7 | 175.1 | 176.1 | -178.8 | 137.3 | 12.6 | 112.7 | D114 I115 Y181 | D114-R185 HydrophobicContact CB-CG 4.42Å; D114-R185 VanDerWaalsContact CG-CZ 3.49Å; D114-R185 WeakPolarHBondContact O-CG 3.34Å; D114-R185 IonicContact OD1-CZ 3.72Å; D114-R185 IonicContact OD1-NH1 3.83Å; D114-R185 PolarHBondContact OD1-NH1 2.83Å; D114-R185 IonicContact OD1-NH2 3.52Å; D114-R185 PolarHBondContact OD1-NH2 3.26Å; D114-R185 IonicContact OD2-CZ 3.56Å; D114-R185 IonicContact OD2-NH1 3.26Å; D114-R185 PolarHBondContact OD2-NH1 3.42Å; I115-R185 HydrophobicContact CD1-CB 3.87Å; Y181-R185 VanDerWaalsContact O-CB 3.28Å; Y181-R185 WeakPolarHBondContact O-CB 3.48Å; Y181-R185 PolarHBondContact O-N 2.94Å |
| 186 | S | 77.3 | Confident | 86.2 | Confident | 63 Ų | 63 | 36.3 Ų | 36.3 | 44% | 0.441 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -113.1 | 12 | -172.8 | 68.9 | 0 | 0 | 0 | 0 | 113.6 | G182 S188 R191 | G182-S186 PolarHBondContact O-N 2.79Å; G182-S186 PolarHBondContact O-OG 3.4Å; S186-S188 PolarHBondContact O-N 2.82Å; S186-S188 WeakPolarHBondContact OG-CB 3.11Å; S186-R191 PolarHBondContact OG-NH1 2.8Å |
| 187 | D | 76.4 | Confident | 86.2 | Confident | 56 Ų | 56 | 42.8 Ų | 42.8 | 30% | 0.299 | 20% | 0.199 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 42.7 | 40.3 | -172.4 | -168.4 | 47.4 | 0 | 0 | 0 | 113.6 | A183 K272 | A183-D187 WeakPolarHBondContact O-CA 3.48Å; A183-D187 PolarHBondContact O-N 3Å; D187-K272 IonicContact OD2-NZ 3.02Å; D187-K272 PolarHBondContact OD2-NZ 3.36Å |
| 188 | S | 79.6 | Confident | 86.3 | Confident | 14 Ų | 14 | 44.5 Ų | 44.5 | 10% | 0.098 | 21% | 0.21 | C | C | . | . | trans | -87.8 | 116.1 | -172.9 | 172.4 | 0 | 0 | 0 | 0 | 111.3 | A183 S186 F190 R191 F192 E276 | A183-S188 PolarHBondContact O-N 3.37Å; S186-S188 PolarHBondContact O-N 2.82Å; S186-S188 WeakPolarHBondContact OG-CB 3.11Å; S188-F190 VanDerWaalsContact C-N 3.3Å; S188-F190 PolarHBondContact O-N 3.48Å; S188-R191 PolarHBondContact O-N 3.48Å; S188-R191 PolarHBondContact OG-N 3.35Å; S188-F192 VanDerWaalsContact O-CD2 3.25Å; S188-F192 WeakPolarHBondContact O-CD2 3.29Å; S188-F192 PolarHBondContact O-N 2.88Å; S188-F192 VanDerWaalsContact O-N 3.14Å; S188-E276 VanDerWaalsContact C-OE2 3.31Å; S188-E276 WeakPolarHBondContact CA-OE2 3.49Å; S188-E276 WeakPolarHBondContact CB-OE2 3.45Å; S188-E276 PolarHBondContact OG-OE2 2.87Å | ||
| 189 | S | 80.6 | Confident | 86.6 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -63.6 | -35.3 | 178.3 | -51.5 | 0 | 0 | 0 | 0 | 111.9 | F192 F193 K272 E276 | S189-F192 WeakPolarHBondContact O-CB 3.19Å; S189-F192 PolarHBondContact O-N 3.34Å; S189-F193 PolarHBondContact O-N 2.74Å; S189-F193 VanDerWaalsContact O-N 3.07Å; S189-K272 WeakPolarHBondContact OG-CD 3.28Å; S189-K272 WeakPolarHBondContact OG-CG 3.4Å; S189-E276 VanDerWaalsContact N-CD 3.35Å; S189-E276 PolarHBondContact N-OE1 3.22Å; S189-E276 PolarHBondContact N-OE2 2.93Å; S189-E276 PolarHBondContact OG-OE1 2.94Å |
| 190 | F | 80.6 | Confident | 86.8 | Confident | 82 Ų | 82 | 43.2 Ų | 43.2 | 36% | 0.36 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -64.5 | -43.4 | 176.3 | 177.7 | -100.8 | 0 | 0 | 0 | 112.1 | S188 F192 F193 V194 E276 F277 | S188-F190 VanDerWaalsContact C-N 3.3Å; S188-F190 PolarHBondContact O-N 3.48Å; F190-F192 VanDerWaalsContact C-N 3.32Å; F190-F192 PolarHBondContact O-N 2.87Å; F190-F193 WeakPolarHBondContact O-CB 3.4Å; F190-F193 PolarHBondContact O-N 2.96Å; F190-V194 HydrophobicContact CD1-CG2 4.45Å; F190-V194 HydrophobicContact CE1-CG2 3.97Å; F190-V194 HydrophobicContact CE2-CG2 4.42Å; F190-V194 HydrophobicContact CZ-CG2 3.96Å; F190-V194 PolarHBondContact O-N 3.02Å; F190-V194 VanDerWaalsContact O-N 3.09Å; F190-E276 PolarHBondContact N-OE2 3.37Å; F190-F277 HydrophobicContact CD2-CB 4.24Å; F190-F277 HydrophobicContact CD2-CD2 4.07Å; F190-F277 AromaticContact CE2-CD2 3.64Å; F190-F277 HydrophobicContact CE2-CD2 3.64Å; F190-F277 HydrophobicContact CE2-CE2 4.24Å; F190-F277 HydrophobicContact CE2-CG 4.43Å; F190-F277 AromaticContact CZ-CD2 3.98Å; F190-F277 HydrophobicContact CZ-CD2 3.98Å; F190-F277 HydrophobicContact CZ-CE2 4.32Å |
| 191 | R | 85.7 | Confident | 87 | Confident | 108 Ų | 108 | 46.7 Ų | 46.7 | 41% | 0.408 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -66.3 | -35.2 | 177.5 | -67.1 | -178.8 | -180 | 171.3 | -2.2 | 112.1 | G182 A183 S186 S188 F195 | G182-R191 VanDerWaalsContact C-CD 3.45Å; G182-R191 WeakPolarHBondContact O-CD 3.45Å; G182-R191 PolarHBondContact O-NH1 3.18Å; A183-R191 HydrophobicContact CB-CB 3.7Å; S186-R191 PolarHBondContact OG-NH1 2.8Å; S188-R191 PolarHBondContact O-N 3.48Å; S188-R191 PolarHBondContact OG-N 3.35Å; R191-F195 WeakPolarHBondContact O-CB 3.36Å; R191-F195 PolarHBondContact O-N 3.02Å |
| 192 | F | 88 | Confident | 87.3 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.5 | -44.2 | 170.7 | -84.9 | -66.1 | 0 | 0 | 0 | 112 | A183 F184 S188 S189 F190 F195 F196 V259 Y263 | A183-F192 HydrophobicContact CB-CB 4.48Å; A183-F192 HydrophobicContact CB-CD1 3.86Å; A183-F192 HydrophobicContact CB-CD2 3.75Å; A183-F192 HydrophobicContact CB-CE1 3.94Å; A183-F192 HydrophobicContact CB-CE2 3.82Å; A183-F192 HydrophobicContact CB-CG 3.75Å; A183-F192 HydrophobicContact CB-CZ 3.91Å; F184-F192 HydrophobicContact CD1-CE1 4.45Å; F184-F192 AromaticContact CD1-CZ 3.84Å; F184-F192 HydrophobicContact CD1-CZ 3.84Å; F184-F192 HydrophobicContact CD2-CE1 4.13Å; F184-F192 HydrophobicContact CD2-CZ 4.17Å; F184-F192 HydrophobicContact CE1-CE1 4.07Å; F184-F192 AromaticContact CE1-CZ 3.74Å; F184-F192 HydrophobicContact CE1-CZ 3.74Å; F184-F192 AromaticContact CE2-CE1 3.72Å; F184-F192 HydrophobicContact CE2-CE1 3.72Å; F184-F192 HydrophobicContact CE2-CZ 4.08Å; F184-F192 HydrophobicContact CG-CE1 4.48Å; F184-F192 HydrophobicContact CG-CZ 4.07Å; F184-F192 AromaticContact CZ-CE1 3.69Å; F184-F192 HydrophobicContact CZ-CE1 3.69Å; F184-F192 AromaticContact CZ-CZ 3.87Å; F184-F192 HydrophobicContact CZ-CZ 3.87Å; S188-F192 VanDerWaalsContact O-CD2 3.25Å; S188-F192 WeakPolarHBondContact O-CD2 3.29Å; S188-F192 PolarHBondContact O-N 2.88Å; S188-F192 VanDerWaalsContact O-N 3.14Å; S189-F192 WeakPolarHBondContact O-CB 3.19Å; S189-F192 PolarHBondContact O-N 3.34Å; F190-F192 VanDerWaalsContact C-N 3.32Å; F190-F192 PolarHBondContact O-N 2.87Å; F192-F195 WeakPolarHBondContact O-CB 3.14Å; F192-F195 PolarHBondContact O-N 3.38Å; F192-F196 HydrophobicContact CB-CD2 4.5Å; F192-F196 HydrophobicContact CB-CE2 4.17Å; F192-F196 HydrophobicContact CD1-CE2 4.21Å; F192-F196 WeakPolarHBondContact O-CD2 3.44Å; F192-F196 PolarHBondContact O-N 3.44Å; F192-V259 HydrophobicContact CE1-CG1 4.29Å; F192-Y263 HydrophobicContact CB-CD2 3.66Å; F192-Y263 HydrophobicContact CB-CE2 3.77Å; F192-Y263 HydrophobicContact CD1-CD2 4.1Å; F192-Y263 AromaticContact CD2-CD2 3.98Å; F192-Y263 HydrophobicContact CD2-CD2 3.98Å; F192-Y263 HydrophobicContact CD2-CE2 4.47Å; F192-Y263 AromaticContact CG-CD2 3.66Å; F192-Y263 HydrophobicContact CG-CD2 3.66Å; F192-Y263 HydrophobicContact CG-CE2 4.21Å |
| 193 | F | 87.6 | Confident | 87.7 | Confident | 109 Ų | 109 | 49.1 Ų | 49.1 | 48% | 0.478 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -61.6 | -48.4 | 178.5 | -177.5 | -97.7 | 0 | 0 | 0 | 112.4 | S189 F190 F195 F196 F197 | S189-F193 PolarHBondContact O-N 2.74Å; S189-F193 VanDerWaalsContact O-N 3.07Å; F190-F193 WeakPolarHBondContact O-CB 3.4Å; F190-F193 PolarHBondContact O-N 2.96Å; F193-F195 VanDerWaalsContact C-N 3.3Å; F193-F195 PolarHBondContact O-N 3.48Å; F193-F196 PolarHBondContact O-N 2.91Å; F193-F197 PolarHBondContact O-N 3.31Å |
| 194 | V | 89.2 | Confident | 88.1 | Confident | 48 Ų | 48 | 51.3 Ų | 51.3 | 29% | 0.291 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -58.7 | -44 | 175.6 | 174.4 | 0 | 0 | 0 | 0 | 110.8 | P179 F190 F197 V198 | P179-V194 HydrophobicContact CB-CG1 4.35Å; P179-V194 HydrophobicContact CG-CG1 4.26Å; F190-V194 HydrophobicContact CD1-CG2 4.45Å; F190-V194 HydrophobicContact CE1-CG2 3.97Å; F190-V194 HydrophobicContact CE2-CG2 4.42Å; F190-V194 HydrophobicContact CZ-CG2 3.96Å; F190-V194 PolarHBondContact O-N 3.02Å; F190-V194 VanDerWaalsContact O-N 3.09Å; V194-F197 PolarHBondContact O-N 3.01Å; V194-V198 HydrophobicContact CG1-CG2 4.41Å; V194-V198 WeakPolarHBondContact O-CG2 3.42Å; V194-V198 PolarHBondContact O-N 3.31Å; V194-V198 VanDerWaalsContact O-N 3.09Å |
| 195 | F | 92.6 | Very high | 88.5 | Confident | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -56.2 | -53.7 | 175 | 162.3 | -101.7 | 0 | 0 | 0 | 111.6 | M126 W176 P179 L180 R191 F192 F193 F197 V198 Y199 V259 | M126-F195 HydrophobicContact CE-CE2 3.62Å; M126-F195 HydrophobicContact CE-CZ 3.4Å; M126-F195 VanDerWaalsContact CE-CZ 3.4Å; W176-F195 HydrophobicContact CB-CD2 4.36Å; W176-F195 AromaticContact CE3-CE2 3.96Å; W176-F195 HydrophobicContact CE3-CE2 3.96Å; W176-F195 WeakPolarHBondContact O-CD2 3.33Å; P179-F195 HydrophobicContact CB-CB 4.18Å; L180-F195 HydrophobicContact CB-CD2 3.67Å; L180-F195 HydrophobicContact CB-CE2 4.03Å; L180-F195 HydrophobicContact CB-CG 4.19Å; L180-F195 HydrophobicContact CD1-CD1 3.95Å; L180-F195 HydrophobicContact CD1-CD2 3.85Å; L180-F195 HydrophobicContact CD1-CE1 3.82Å; L180-F195 HydrophobicContact CD1-CE2 3.7Å; L180-F195 HydrophobicContact CD1-CG 3.97Å; L180-F195 HydrophobicContact CD1-CZ 3.7Å; L180-F195 HydrophobicContact CD2-CE2 4.47Å; L180-F195 HydrophobicContact CG-CD2 4.32Å; L180-F195 HydrophobicContact CG-CE2 4.28Å; R191-F195 WeakPolarHBondContact O-CB 3.36Å; R191-F195 PolarHBondContact O-N 3.02Å; F192-F195 WeakPolarHBondContact O-CB 3.14Å; F192-F195 PolarHBondContact O-N 3.38Å; F193-F195 VanDerWaalsContact C-N 3.3Å; F193-F195 PolarHBondContact O-N 3.48Å; F195-F197 PolarHBondContact O-N 2.95Å; F195-V198 PolarHBondContact O-N 2.88Å; F195-Y199 HydrophobicContact CD2-CD2 4.32Å; F195-Y199 HydrophobicContact CE2-CD1 4.49Å; F195-Y199 AromaticContact CE2-CD2 3.39Å; F195-Y199 HydrophobicContact CE2-CD2 3.39Å; F195-Y199 HydrophobicContact CE2-CE2 4.04Å; F195-Y199 AromaticContact CE2-CG 3.63Å; F195-Y199 HydrophobicContact CE2-CG 3.63Å; F195-Y199 HydrophobicContact CZ-CD1 4.15Å; F195-Y199 AromaticContact CZ-CD2 3.84Å; F195-Y199 HydrophobicContact CZ-CD2 3.84Å; F195-Y199 HydrophobicContact CZ-CE2 4.35Å; F195-Y199 AromaticContact CZ-CG 3.7Å; F195-Y199 HydrophobicContact CZ-CG 3.7Å; F195-Y199 WeakPolarHBondContact O-CB 3.29Å; F195-Y199 PolarHBondContact O-N 2.92Å; F195-V259 HydrophobicContact CD1-CG1 4.18Å; F195-V259 HydrophobicContact CE1-CB 4.25Å; F195-V259 HydrophobicContact CE1-CG1 3.54Å; F195-V259 HydrophobicContact CZ-CG1 4.26Å |
| 196 | F | 92.4 | Very high | 89.1 | Confident | 22 Ų | 22 | 48 Ų | 48 | 10% | 0.096 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.8 | -42.9 | -176.6 | -72.2 | -60.1 | 0 | 0 | 0 | 112.4 | F192 F193 Y199 I200 F256 V259 H260 Y263 | F192-F196 HydrophobicContact CB-CD2 4.5Å; F192-F196 HydrophobicContact CB-CE2 4.17Å; F192-F196 HydrophobicContact CD1-CE2 4.21Å; F192-F196 WeakPolarHBondContact O-CD2 3.44Å; F192-F196 PolarHBondContact O-N 3.44Å; F193-F196 PolarHBondContact O-N 2.91Å; F196-Y199 PolarHBondContact O-N 3.45Å; F196-I200 VanDerWaalsContact O-CG1 3.31Å; F196-I200 WeakPolarHBondContact O-CG1 3.26Å; F196-I200 PolarHBondContact O-N 3.32Å; F196-I200 VanDerWaalsContact O-N 3.09Å; F196-F256 HydrophobicContact CD1-CD2 4.19Å; F196-F256 AromaticContact CD1-CE2 3.66Å; F196-F256 HydrophobicContact CD1-CE2 3.66Å; F196-F256 HydrophobicContact CD1-CZ 4.25Å; F196-F256 HydrophobicContact CE1-CE2 4.36Å; F196-V259 HydrophobicContact CE1-CG1 4.03Å; F196-V259 HydrophobicContact CZ-CG1 3.95Å; F196-H260 HydrophobicContact CE1-CB 3.91Å; F196-H260 HydrophobicContact CZ-CB 4.16Å; F196-Y263 HydrophobicContact CE2-CD1 4.07Å; F196-Y263 AromaticContact CE2-CD2 3.98Å; F196-Y263 HydrophobicContact CE2-CD2 3.98Å; F196-Y263 AromaticContact CE2-CG 3.73Å; F196-Y263 HydrophobicContact CE2-CG 3.73Å; F196-Y263 HydrophobicContact CZ-CG 4.13Å |
| 197 | F | 91.6 | Very high | 90 | Very high | 138 Ų | 138 | 48.3 Ų | 48.3 | 61% | 0.605 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -59.5 | -52.1 | 178.4 | 177.4 | -101.2 | 0 | 0 | 0 | 111.7 | F193 V194 F195 Y199 | F193-F197 PolarHBondContact O-N 3.31Å; V194-F197 PolarHBondContact O-N 3.01Å; F195-F197 PolarHBondContact O-N 2.95Å; F197-Y199 VanDerWaalsContact C-N 3.35Å; F197-Y199 PolarHBondContact O-N 3.18Å |
| 198 | V | 93.1 | Very high | 90.9 | Very high | 37 Ų | 37 | 48.8 Ų | 48.8 | 22% | 0.224 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -68 | -37.3 | -179.8 | 179.3 | 0 | 0 | 0 | 0 | 111.4 | C175 W176 V194 F195 I200 C201 Q202 | C175-V198 HydrophobicContact CB-CG1 3.85Å; C175-V198 WeakPolarHBondContact O-CG1 3.46Å; W176-V198 HydrophobicContact CB-CG1 4.1Å; V194-V198 HydrophobicContact CG1-CG2 4.41Å; V194-V198 WeakPolarHBondContact O-CG2 3.42Å; V194-V198 PolarHBondContact O-N 3.31Å; V194-V198 VanDerWaalsContact O-N 3.09Å; F195-V198 PolarHBondContact O-N 2.88Å; V198-I200 VanDerWaalsContact C-N 3.32Å; V198-I200 PolarHBondContact O-N 3.12Å; V198-C201 WeakPolarHBondContact O-CB 3.31Å; V198-C201 PolarHBondContact O-N 3.34Å; V198-Q202 PolarHBondContact O-N 3.19Å |
| 199 | Y | 94.5 | Very high | 91.6 | Very high | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -69.9 | -27.5 | -176.4 | -160 | -95.2 | 0 | 0 | 0 | 112.9 | M126 L129 W176 F195 F196 F197 Q202 F203 S252 F256 | M126-Y199 HydrophobicContact CE-CD2 4.37Å; M126-Y199 HydrophobicContact CE-CE1 4.5Å; M126-Y199 HydrophobicContact CE-CE2 3.74Å; L129-Y199 WeakPolarHBondContact CD2-OH 3.29Å; W176-Y199 HydrophobicContact CB-CD2 4.08Å; W176-Y199 AromaticContact CD2-CD2 3.65Å; W176-Y199 HydrophobicContact CD2-CD2 3.65Å; W176-Y199 AromaticContact CD2-CE2 3.7Å; W176-Y199 HydrophobicContact CD2-CE2 3.7Å; W176-Y199 AromaticContact CE3-CD2 3.62Å; W176-Y199 HydrophobicContact CE3-CD2 3.62Å; W176-Y199 AromaticContact CE3-CE2 3.5Å; W176-Y199 HydrophobicContact CE3-CE2 3.5Å; W176-Y199 VanDerWaalsContact CE3-CE2 3.5Å; W176-Y199 AromaticContact CG-CD2 3.87Å; W176-Y199 HydrophobicContact CG-CD2 3.87Å; W176-Y199 HydrophobicContact CG-CE2 4.37Å; W176-Y199 HydrophobicContact CH2-CE2 4.02Å; W176-Y199 HydrophobicContact CZ2-CE2 4.19Å; W176-Y199 HydrophobicContact CZ3-CD2 4.27Å; W176-Y199 AromaticContact CZ3-CE2 3.68Å; W176-Y199 HydrophobicContact CZ3-CE2 3.68Å; F195-Y199 HydrophobicContact CD2-CD2 4.32Å; F195-Y199 HydrophobicContact CE2-CD1 4.49Å; F195-Y199 AromaticContact CE2-CD2 3.39Å; F195-Y199 HydrophobicContact CE2-CD2 3.39Å; F195-Y199 HydrophobicContact CE2-CE2 4.04Å; F195-Y199 AromaticContact CE2-CG 3.63Å; F195-Y199 HydrophobicContact CE2-CG 3.63Å; F195-Y199 HydrophobicContact CZ-CD1 4.15Å; F195-Y199 AromaticContact CZ-CD2 3.84Å; F195-Y199 HydrophobicContact CZ-CD2 3.84Å; F195-Y199 HydrophobicContact CZ-CE2 4.35Å; F195-Y199 AromaticContact CZ-CG 3.7Å; F195-Y199 HydrophobicContact CZ-CG 3.7Å; F195-Y199 WeakPolarHBondContact O-CB 3.29Å; F195-Y199 PolarHBondContact O-N 2.92Å; F196-Y199 PolarHBondContact O-N 3.45Å; F197-Y199 VanDerWaalsContact C-N 3.35Å; F197-Y199 PolarHBondContact O-N 3.18Å; Y199-Q202 PolarHBondContact O-N 2.92Å; Y199-F203 WeakPolarHBondContact O-CB 3.39Å; Y199-F203 PolarHBondContact O-N 3.1Å; Y199-S252 WeakPolarHBondContact OH-CA 3.36Å; Y199-S252 PolarHBondContact OH-OG 3.33Å; Y199-S252 VanDerWaalsContact OH-OG 3.07Å; Y199-F256 HydrophobicContact CD1-CB 4.28Å; Y199-F256 AromaticContact CD1-CD2 3.68Å; Y199-F256 HydrophobicContact CD1-CD2 3.68Å; Y199-F256 HydrophobicContact CD1-CG 4.43Å; Y199-F256 HydrophobicContact CE1-CB 4.02Å; Y199-F256 HydrophobicContact CE1-CD2 4.29Å |
| 200 | I | 94.3 | Very high | 92.4 | Very high | 96 Ų | 96 | 48.7 Ų | 48.7 | 49% | 0.492 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -63.2 | -44.9 | 170.8 | -71.1 | 164.2 | 0 | 0 | 0 | 110.4 | F196 V198 Q202 F203 A204 F256 | F196-I200 VanDerWaalsContact O-CG1 3.31Å; F196-I200 WeakPolarHBondContact O-CG1 3.26Å; F196-I200 PolarHBondContact O-N 3.32Å; F196-I200 VanDerWaalsContact O-N 3.09Å; V198-I200 VanDerWaalsContact C-N 3.32Å; V198-I200 PolarHBondContact O-N 3.12Å; I200-Q202 VanDerWaalsContact C-N 3.35Å; I200-F203 PolarHBondContact O-N 3.35Å; I200-A204 PolarHBondContact O-N 2.87Å; I200-F256 HydrophobicContact CD1-CZ 4.35Å; I200-F256 HydrophobicContact CG1-CE2 3.95Å; I200-F256 HydrophobicContact CG1-CZ 4.07Å |
| 201 | C | 93.8 | Very high | 93.2 | Very high | 72 Ų | 72 | 46.1 Ų | 46.1 | 49% | 0.486 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62.1 | -43.1 | 174.5 | -62.3 | 0 | 0 | 0 | 0 | 111.3 | V198 F203 A204 V205 | V198-C201 WeakPolarHBondContact O-CB 3.31Å; V198-C201 PolarHBondContact O-N 3.34Å; C201-F203 VanDerWaalsContact C-N 3.33Å; C201-F203 PolarHBondContact O-N 2.81Å; C201-A204 WeakPolarHBondContact O-CB 3.3Å; C201-A204 PolarHBondContact O-N 3.29Å; C201-V205 WeakPolarHBondContact O-CG2 3.46Å; C201-V205 PolarHBondContact O-N 2.91Å |
| 202 | Q | 93.8 | Very high | 93.5 | Very high | 19 Ų | 19 | 41 Ų | 41 | 9% | 0.089 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -60 | -41.9 | 174.6 | -178.6 | 67.5 | 39.9 | 0 | 0 | 111.9 | V198 Y199 I200 A204 V205 H206 | V198-Q202 PolarHBondContact O-N 3.19Å; Y199-Q202 PolarHBondContact O-N 2.92Å; I200-Q202 VanDerWaalsContact C-N 3.35Å; Q202-A204 VanDerWaalsContact C-N 3.34Å; Q202-V205 WeakPolarHBondContact O-CB 3.23Å; Q202-V205 PolarHBondContact O-N 3.42Å; Q202-H206 PolarHBondContact NE2-NE2 2.89Å; Q202-H206 VanDerWaalsContact NE2-NE2 3.15Å; Q202-H206 PolarHBondContact O-N 3.12Å |
| 203 | F | 95.1 | Very high | 93.7 | Very high | 61 Ų | 61 | 46 Ų | 46 | 27% | 0.268 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -62.6 | -42.3 | 176.8 | 175.4 | -106.7 | 0 | 0 | 0 | 111.4 | Y199 I200 C201 V205 H206 V207 A249 L253 | Y199-F203 WeakPolarHBondContact O-CB 3.39Å; Y199-F203 PolarHBondContact O-N 3.1Å; I200-F203 PolarHBondContact O-N 3.35Å; C201-F203 VanDerWaalsContact C-N 3.33Å; C201-F203 PolarHBondContact O-N 2.81Å; F203-V205 VanDerWaalsContact C-N 3.3Å; F203-V205 PolarHBondContact O-N 3.33Å; F203-H206 PolarHBondContact O-N 3.5Å; F203-V207 HydrophobicContact CE1-CG2 4.12Å; F203-V207 HydrophobicContact CE2-CG2 4.27Å; F203-V207 HydrophobicContact CZ-CG2 3.93Å; F203-V207 PolarHBondContact O-N 2.76Å; F203-V207 VanDerWaalsContact O-N 3.1Å; F203-A249 WeakPolarHBondContact CE2-O 3.37Å; F203-L253 HydrophobicContact CE2-CB 3.84Å; F203-L253 HydrophobicContact CE2-CD1 4.38Å; F203-L253 HydrophobicContact CZ-CB 4.31Å; F203-L253 HydrophobicContact CZ-CD1 4.16Å |
| 204 | A | 95.1 | Very high | 93.6 | Very high | 47 Ų | 47 | 45.1 Ų | 45.1 | 39% | 0.388 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -58.8 | -42.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | I200 C201 Q202 H206 V207 L208 | I200-A204 PolarHBondContact O-N 2.87Å; C201-A204 WeakPolarHBondContact O-CB 3.3Å; C201-A204 PolarHBondContact O-N 3.29Å; Q202-A204 VanDerWaalsContact C-N 3.34Å; A204-H206 PolarHBondContact O-N 3.38Å; A204-V207 PolarHBondContact O-N 3.25Å; A204-L208 WeakPolarHBondContact O-CG 3.47Å; A204-L208 PolarHBondContact O-N 3.3Å |
| 205 | V | 93.9 | Very high | 93.6 | Very high | 34 Ų | 34 | 47 Ų | 47 | 21% | 0.206 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -58.1 | -44.7 | 174.3 | 171.2 | 0 | 0 | 0 | 0 | 111.6 | F168 C201 Q202 F203 V207 L208 Q209 | F168-V205 HydrophobicContact CD2-CG1 4.42Å; F168-V205 HydrophobicContact CE2-CG1 4.08Å; F168-V205 HydrophobicContact CZ-CG1 4.47Å; C201-V205 WeakPolarHBondContact O-CG2 3.46Å; C201-V205 PolarHBondContact O-N 2.91Å; Q202-V205 WeakPolarHBondContact O-CB 3.23Å; Q202-V205 PolarHBondContact O-N 3.42Å; F203-V205 VanDerWaalsContact C-N 3.3Å; F203-V205 PolarHBondContact O-N 3.33Å; V205-V207 VanDerWaalsContact C-N 3.31Å; V205-V207 PolarHBondContact O-N 2.94Å; V205-L208 PolarHBondContact O-N 3.37Å; V205-Q209 HydrophobicContact CG1-CG 4.22Å; V205-Q209 WeakPolarHBondContact O-CB 3.24Å; V205-Q209 VanDerWaalsContact O-CG 3.25Å; V205-Q209 WeakPolarHBondContact O-CG 3.49Å; V205-Q209 PolarHBondContact O-N 2.94Å |
| 206 | H | 95.4 | Very high | 93.5 | Very high | 1 Ų | 1 | 51.8 Ų | 51.8 | 1% | 0.005 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60 | -40.1 | 176.2 | -68.6 | 151 | 0 | 0 | 0 | 112.7 | H133 Q202 F203 A204 Q209 A210 A249 S252 | H133-H206 AromaticContact CD2-NE2 3.76Å; H133-H206 AromaticContact CE1-CD2 3.58Å; H133-H206 AromaticContact CE1-NE2 3.57Å; H133-H206 AromaticContact CG-NE2 3.46Å; H133-H206 AromaticContact ND1-CD2 3.57Å; H133-H206 AromaticContact ND1-NE2 3.33Å; H133-H206 PolarHBondContact ND1-NE2 2.93Å; H133-H206 AromaticContact NE2-NE2 3.82Å; Q202-H206 PolarHBondContact NE2-NE2 2.89Å; Q202-H206 VanDerWaalsContact NE2-NE2 3.15Å; Q202-H206 PolarHBondContact O-N 3.12Å; F203-H206 PolarHBondContact O-N 3.5Å; A204-H206 PolarHBondContact O-N 3.38Å; H206-Q209 PolarHBondContact O-N 2.9Å; H206-A210 WeakPolarHBondContact O-CB 3.24Å; H206-A210 PolarHBondContact O-N 3.17Å; H206-A249 HydrophobicContact CB-CB 3.95Å; H206-S252 PolarHBondContact CE1-OG 2.98Å; H206-S252 PolarHBondContact ND1-OG 2.94Å |
| 207 | V | 96.3 | Very high | 93.5 | Very high | 70 Ų | 70 | 50.8 Ų | 50.8 | 42% | 0.424 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -65.7 | -43.8 | 176.6 | 175.2 | 0 | 0 | 0 | 0 | 111 | F203 A204 V205 Q209 A210 A211 | F203-V207 HydrophobicContact CE1-CG2 4.12Å; F203-V207 HydrophobicContact CE2-CG2 4.27Å; F203-V207 HydrophobicContact CZ-CG2 3.93Å; F203-V207 PolarHBondContact O-N 2.76Å; F203-V207 VanDerWaalsContact O-N 3.1Å; A204-V207 PolarHBondContact O-N 3.25Å; V205-V207 VanDerWaalsContact C-N 3.31Å; V205-V207 PolarHBondContact O-N 2.94Å; V207-Q209 VanDerWaalsContact C-N 3.34Å; V207-Q209 PolarHBondContact O-N 3.41Å; V207-A210 PolarHBondContact O-N 3.4Å; V207-A211 PolarHBondContact O-N 2.78Å |
| 208 | L | 95.3 | Very high | 93.7 | Very high | 67 Ų | 67 | 44.2 Ų | 44.2 | 35% | 0.351 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -63.2 | -39.3 | 177.2 | -66.1 | 174.7 | 0 | 0 | 0 | 112 | A204 V205 A211 G212 F213 | A204-L208 WeakPolarHBondContact O-CG 3.47Å; A204-L208 PolarHBondContact O-N 3.3Å; V205-L208 PolarHBondContact O-N 3.37Å; L208-A211 PolarHBondContact O-N 3.33Å; L208-G212 PolarHBondContact O-N 3.44Å; L208-F213 HydrophobicContact CD2-CD2 4.28Å; L208-F213 HydrophobicContact CD2-CE2 3.62Å |
| 209 | Q | 95.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -67.1 | -41.2 | 175.9 | -70.9 | 170.3 | -26.7 | 0 | 0 | 112 | H133 V205 H206 V207 A211 G212 G220 F245 | H133-Q209 PolarHBondContact CE1-OE1 3.01Å; V205-Q209 HydrophobicContact CG1-CG 4.22Å; V205-Q209 WeakPolarHBondContact O-CB 3.24Å; V205-Q209 VanDerWaalsContact O-CG 3.25Å; V205-Q209 WeakPolarHBondContact O-CG 3.49Å; V205-Q209 PolarHBondContact O-N 2.94Å; H206-Q209 PolarHBondContact O-N 2.9Å; V207-Q209 VanDerWaalsContact C-N 3.34Å; V207-Q209 PolarHBondContact O-N 3.41Å; Q209-A211 VanDerWaalsContact C-N 3.35Å; Q209-G212 PolarHBondContact O-N 3.48Å; Q209-G220 WeakPolarHBondContact O-CA 3.45Å; Q209-F245 HydrophobicContact CB-CD1 3.7Å; Q209-F245 HydrophobicContact CB-CD2 4.4Å; Q209-F245 HydrophobicContact CB-CE1 3.89Å; Q209-F245 HydrophobicContact CB-CG 3.99Å; Q209-F245 HydrophobicContact CB-CZ 4.31Å; Q209-F245 HydrophobicContact CG-CD1 4.49Å; Q209-F245 HydrophobicContact CG-CE1 4.24Å |
| 210 | A | 97.1 | Very high | 93.8 | Very high | 11 Ų | 11 | 42.5 Ų | 42.5 | 9% | 0.091 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -64.9 | -38.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | H206 V207 G220 W221 F245 | H206-A210 WeakPolarHBondContact O-CB 3.24Å; H206-A210 PolarHBondContact O-N 3.17Å; V207-A210 PolarHBondContact O-N 3.4Å; A210-G220 CarbonylContact O-C 3.58Å; A210-G220 VanDerWaalsContact O-CA 3.24Å; A210-G220 WeakPolarHBondContact O-CA 3.33Å; A210-W221 PolarHBondContact O-N 2.83Å; A210-F245 HydrophobicContact CB-CB 4.09Å |
| 211 | A | 96.5 | Very high | 94 | Very high | 28 Ų | 28 | 43 Ų | 43 | 23% | 0.231 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.2 | -45.1 | 174 | 0 | 0 | 0 | 0 | 0 | 111.5 | V207 L208 Q209 F213 W221 I222 | V207-A211 PolarHBondContact O-N 2.78Å; L208-A211 PolarHBondContact O-N 3.33Å; Q209-A211 VanDerWaalsContact C-N 3.35Å; A211-F213 HydrophobicContact CB-CD2 4.41Å; A211-F213 HydrophobicContact CB-CE2 3.96Å; A211-F213 HydrophobicContact CB-CZ 4.25Å; A211-W221 PolarHBondContact O-N 3.2Å; A211-I222 WeakPolarHBondContact O-CB 3.45Å; A211-I222 WeakPolarHBondContact O-CG1 3.48Å; A211-I222 PolarHBondContact O-N 3.43Å |
| 212 | G | 92.5 | Very high | 94 | Very high | 0 Ų | 0 | 42.7 Ų | 42.7 | 0% | 0 | 22% | 0.216 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 68.2 | 59.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | L208 Q209 I222 S223 | L208-G212 PolarHBondContact O-N 3.44Å; Q209-G212 PolarHBondContact O-N 3.48Å; G212-I222 WeakPolarHBondContact O-CB 3.38Å; G212-S223 PolarHBondContact O-N 3.17Å; G212-S223 PolarHBondContact O-OG 3.17Å |
| 213 | F | 91.1 | Very high | 93.9 | Very high | 105 Ų | 105 | 42 Ų | 42 | 46% | 0.461 | 21% | 0.213 | S | C | . | . | trans | -58.3 | 147.6 | 174.7 | -65.2 | -74.7 | 0 | 0 | 0 | 111.6 | L208 A211 W216 I222 | L208-F213 HydrophobicContact CD2-CD2 4.28Å; L208-F213 HydrophobicContact CD2-CE2 3.62Å; A211-F213 HydrophobicContact CB-CD2 4.41Å; A211-F213 HydrophobicContact CB-CE2 3.96Å; A211-F213 HydrophobicContact CB-CZ 4.25Å; F213-W216 HydrophobicContact CB-CB 4.24Å; F213-W216 WeakPolarHBondContact O-CB 3.5Å; F213-W216 PolarHBondContact O-N 2.87Å; F213-I222 HydrophobicContact CD1-CD1 4.18Å; F213-I222 HydrophobicContact CE1-CD1 4.23Å | ||
| 214 | H | 86.1 | Confident | 93.9 | Very high | 91 Ų | 91 | 39.1 Ų | 39.1 | 42% | 0.421 | 20% | 0.201 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -58.9 | 140.3 | 177.3 | -63.9 | 105.1 | 0 | 0 | 0 | 111.3 | W216 I222 | H214-W216 PolarHBondContact O-N 2.86Å; H214-I222 VanDerWaalsContact CE1-CG2 3.46Å; H214-I222 WeakPolarHBondContact CE1-CG2 3.33Å |
| 215 | N | 88.5 | Confident | 93.8 | Very high | 89 Ų | 89 | 41.2 Ų | 41.2 | 48% | 0.476 | 21% | 0.205 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 60.7 | 23 | -179.2 | -52.5 | -33.5 | 0 | 0 | 0 | 113.8 | D157 L160 | D157-N215 WeakPolarHBondContact OD1-CA 3.32Å; D157-N215 PolarHBondContact OD1-N 2.82Å; D157-N215 VanDerWaalsContact OD1-N 3.15Å; L160-N215 WeakPolarHBondContact CD1-O 3.43Å |
| 216 | W | 91.9 | Very high | 93.6 | Very high | 100 Ų | 100 | 41.5 Ų | 41.5 | 38% | 0.379 | 21% | 0.207 | S | C | . | . | S | Bend | trans | -100.1 | -6.3 | 174.3 | -165 | -114.3 | 0 | 0 | 0 | 112.2 | D157 W164 F213 H214 N218 | D157-W216 PolarHBondContact OD1-N 3.38Å; W164-W216 PolarHBondContact NE1-O 3.32Å; F213-W216 HydrophobicContact CB-CB 4.24Å; F213-W216 WeakPolarHBondContact O-CB 3.5Å; F213-W216 PolarHBondContact O-N 2.87Å; H214-W216 PolarHBondContact O-N 2.86Å; W216-N218 PolarHBondContact O-ND2 2.95Å |
| 217 | G | 92.8 | Very high | 93.3 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 21% | 0.206 | C | C | . | . | S | Bend | trans | 71.4 | 28.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | N140 D157 S161 | N140-G217 PolarHBondContact ND2-O 3.33Å; D157-G217 WeakPolarHBondContact O-CA 3.15Å; D157-G217 PolarHBondContact OD1-N 3.46Å; S161-G217 WeakPolarHBondContact CB-O 3.31Å |
| 218 | N | 94.8 | Very high | 93.1 | Very high | 1 Ų | 1 | 40.9 Ų | 40.9 | 1% | 0.005 | 20% | 0.201 | C | C | . | . | trans | -131.2 | 131 | 177.6 | -66.7 | -80.2 | 0 | 0 | 0 | 111.2 | N140 W216 G220 S223 F245 | N140-N218 WeakPolarHBondContact OD1-CA 3.34Å; W216-N218 PolarHBondContact O-ND2 2.95Å; N218-G220 PolarHBondContact O-N 3.47Å; N218-S223 PolarHBondContact O-OG 3.15Å; N218-F245 HydrophobicContact CB-CE2 4.48Å | ||
| 219 | C | 95.4 | Very high | 92.9 | Very high | 1 Ų | 1 | 44.6 Ų | 44.6 | 1% | 0.007 | 22% | 0.221 | C | C | . | . | trans | -80.3 | 59.8 | 173.8 | -66.6 | 0 | 0 | 0 | 0 | 110.8 | N140 C144 M238 I241 A242 | N140-C219 WeakPolarHBondContact OD1-CB 3.44Å; N140-C219 PolarHBondContact OD1-N 3.24Å; C144-C219 PolarHBondContact N-SG 3.09Å; C144-C219 PolarHBondContact SG-SG 2.9Å; C219-M238 HydrophobicContact CB-CB 4.1Å; C219-M238 HydrophobicContact CB-CE 4.28Å; C219-M238 HydrophobicContact CB-CG 4.16Å; C219-I241 HydrophobicContact CB-CB 4.07Å; C219-I241 HydrophobicContact CB-CD1 4.32Å; C219-I241 HydrophobicContact CB-CG2 3.81Å; C219-A242 WeakPolarHBondContact O-CA 3.41Å; C219-A242 WeakPolarHBondContact O-CB 3.44Å; C219-A242 PolarHBondContact O-N 2.89Å | ||
| 220 | G | 94.9 | Very high | 92.6 | Very high | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 24% | 0.243 | C | C | . | . | trans | -83.1 | -172.2 | 173 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q209 A210 N218 I222 S223 S224 | Q209-G220 WeakPolarHBondContact O-CA 3.45Å; A210-G220 CarbonylContact O-C 3.58Å; A210-G220 VanDerWaalsContact O-CA 3.24Å; A210-G220 WeakPolarHBondContact O-CA 3.33Å; N218-G220 PolarHBondContact O-N 3.47Å; G220-I222 PolarHBondContact O-N 3.23Å; G220-S223 PolarHBondContact O-N 3.43Å; G220-S224 VanDerWaalsContact O-CB 3.27Å; G220-S224 WeakPolarHBondContact O-CB 3.39Å; G220-S224 PolarHBondContact O-N 3.27Å; G220-S224 PolarHBondContact O-OG 2.89Å | ||
| 221 | W | 97.1 | Very high | 92.5 | Very high | 105 Ų | 105 | 51.5 Ų | 51.5 | 40% | 0.398 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -58.4 | -42.7 | -174.9 | -73 | 107.3 | 0 | 0 | 0 | 113.5 | A210 A211 S224 L225 I239 A242 T246 | A210-W221 PolarHBondContact O-N 2.83Å; A211-W221 PolarHBondContact O-N 3.2Å; W221-S224 WeakPolarHBondContact CA-OG 3.37Å; W221-S224 PolarHBondContact O-OG 2.91Å; W221-L225 WeakPolarHBondContact O-CB 3.45Å; W221-L225 WeakPolarHBondContact O-CD1 3.25Å; W221-L225 WeakPolarHBondContact O-CG 3.47Å; W221-L225 PolarHBondContact O-N 2.99Å; W221-I239 HydrophobicContact CE3-CD1 3.86Å; W221-I239 HydrophobicContact CZ3-CD1 3.67Å; W221-I239 HydrophobicContact CZ3-CG2 4.32Å; W221-A242 HydrophobicContact CD2-CB 4.11Å; W221-A242 HydrophobicContact CE3-CB 4.49Å; W221-A242 HydrophobicContact CG-CB 4.29Å; W221-T246 PolarHBondContact NE1-OG1 3.38Å |
| 222 | I | 94.4 | Very high | 92.4 | Very high | 67 Ų | 67 | 55.4 Ų | 55.4 | 34% | 0.344 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -65.5 | -53.4 | -179.4 | -62.1 | 166.9 | 0 | 0 | 0 | 110.2 | A211 G212 F213 H214 G220 S224 L225 T226 | A211-I222 WeakPolarHBondContact O-CB 3.45Å; A211-I222 WeakPolarHBondContact O-CG1 3.48Å; A211-I222 PolarHBondContact O-N 3.43Å; G212-I222 WeakPolarHBondContact O-CB 3.38Å; F213-I222 HydrophobicContact CD1-CD1 4.18Å; F213-I222 HydrophobicContact CE1-CD1 4.23Å; H214-I222 VanDerWaalsContact CE1-CG2 3.46Å; H214-I222 WeakPolarHBondContact CE1-CG2 3.33Å; G220-I222 PolarHBondContact O-N 3.23Å; I222-S224 VanDerWaalsContact C-N 3.34Å; I222-S224 PolarHBondContact O-N 2.94Å; I222-L225 PolarHBondContact O-N 3.18Å; I222-T226 PolarHBondContact O-N 3.47Å; I222-T226 VanDerWaalsContact O-N 3.13Å; I222-T226 PolarHBondContact O-OG1 3.37Å |
| 223 | S | 92.3 | Very high | 92.6 | Very high | 4 Ų | 4 | 59.8 Ų | 59.8 | 3% | 0.028 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -59 | -40.8 | 177.9 | -66.2 | 0 | 0 | 0 | 0 | 113.2 | G212 N218 G220 T226 G227 M238 | G212-S223 PolarHBondContact O-N 3.17Å; G212-S223 PolarHBondContact O-OG 3.17Å; N218-S223 PolarHBondContact O-OG 3.15Å; G220-S223 PolarHBondContact O-N 3.43Å; S223-T226 PolarHBondContact O-N 2.77Å; S223-G227 PolarHBondContact O-N 2.98Å; S223-M238 WeakPolarHBondContact O-CE 3.24Å |
| 224 | S | 94.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -71.7 | -35.4 | -177.9 | 57.1 | 0 | 0 | 0 | 0 | 113.5 | G220 W221 I222 G227 L228 M238 I239 | G220-S224 VanDerWaalsContact O-CB 3.27Å; G220-S224 WeakPolarHBondContact O-CB 3.39Å; G220-S224 PolarHBondContact O-N 3.27Å; G220-S224 PolarHBondContact O-OG 2.89Å; W221-S224 WeakPolarHBondContact CA-OG 3.37Å; W221-S224 PolarHBondContact O-OG 2.91Å; I222-S224 VanDerWaalsContact C-N 3.34Å; I222-S224 PolarHBondContact O-N 2.94Å; S224-G227 CarbonylContact O-C 3.6Å; S224-G227 WeakPolarHBondContact O-CA 3.47Å; S224-G227 PolarHBondContact O-N 3Å; S224-G227 VanDerWaalsContact O-N 3.14Å; S224-L228 PolarHBondContact O-N 3.42Å; S224-M238 VanDerWaalsContact CB-CB 3.47Å; S224-I239 VanDerWaalsContact OG-CD1 3.31Å; S224-I239 WeakPolarHBondContact OG-CD1 3.33Å |
| 225 | L | 93.7 | Very high | 93.3 | Very high | 92 Ų | 92 | 51.1 Ų | 51.1 | 48% | 0.482 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -68.7 | -38.4 | 173.1 | -68.9 | 172.4 | 0 | 0 | 0 | 111.7 | W221 I222 G227 L228 N229 I239 | W221-L225 WeakPolarHBondContact O-CB 3.45Å; W221-L225 WeakPolarHBondContact O-CD1 3.25Å; W221-L225 WeakPolarHBondContact O-CG 3.47Å; W221-L225 PolarHBondContact O-N 2.99Å; I222-L225 PolarHBondContact O-N 3.18Å; L225-G227 PolarHBondContact O-N 2.97Å; L225-L228 HydrophobicContact CD2-CD1 4.29Å; L225-L228 PolarHBondContact O-N 2.89Å; L225-N229 PolarHBondContact O-ND2 3.22Å; L225-I239 HydrophobicContact CD2-CD1 4.33Å |
| 226 | T | 90 | Very high | 93.6 | Very high | 39 Ų | 39 | 51.2 Ų | 51.2 | 24% | 0.239 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.8 | -39.9 | 167.6 | -55.9 | 0 | 0 | 0 | 0 | 110.5 | W147 I222 S223 L228 N229 | W147-T226 HydrophobicContact CZ2-CG2 4.09Å; I222-T226 PolarHBondContact O-N 3.47Å; I222-T226 VanDerWaalsContact O-N 3.13Å; I222-T226 PolarHBondContact O-OG1 3.37Å; S223-T226 PolarHBondContact O-N 2.77Å; T226-L228 PolarHBondContact O-N 2.94Å; T226-N229 PolarHBondContact O-N 3.42Å |
| 227 | G | 88.1 | Confident | 93.9 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -39.8 | -62.8 | 168.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | S223 S224 L225 N229 Q230 N231 | S223-G227 PolarHBondContact O-N 2.98Å; S224-G227 CarbonylContact O-C 3.6Å; S224-G227 WeakPolarHBondContact O-CA 3.47Å; S224-G227 PolarHBondContact O-N 3Å; S224-G227 VanDerWaalsContact O-N 3.14Å; L225-G227 PolarHBondContact O-N 2.97Å; G227-N229 PolarHBondContact O-N 2.92Å; G227-Q230 PolarHBondContact O-N 2.86Å; G227-Q230 VanDerWaalsContact O-N 3.1Å; G227-N231 PolarHBondContact O-N 2.82Å |
| 228 | L | 92.1 | Very high | 94 | Very high | 58 Ų | 58 | 50.2 Ų | 50.2 | 30% | 0.304 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -60.8 | -30.5 | -174.9 | -72.3 | 170.3 | 0 | 0 | 0 | 113.6 | S224 L225 T226 Q230 I236 I239 | S224-L228 PolarHBondContact O-N 3.42Å; L225-L228 HydrophobicContact CD2-CD1 4.29Å; L225-L228 PolarHBondContact O-N 2.89Å; T226-L228 PolarHBondContact O-N 2.94Å; L228-Q230 VanDerWaalsContact C-N 3.32Å; L228-I236 HydrophobicContact CD2-CG1 4.02Å; L228-I239 HydrophobicContact CD1-CD1 4.26Å; L228-I239 HydrophobicContact CD1-CG1 4.03Å |
| 229 | N | 91.4 | Very high | 94.2 | Very high | 145 Ų | 145 | 52.2 Ų | 52.2 | 78% | 0.775 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -75.6 | -19.9 | 179.5 | -72.5 | -57.3 | 0 | 0 | 0 | 113.4 | L225 T226 G227 | L225-N229 PolarHBondContact O-ND2 3.22Å; T226-N229 PolarHBondContact O-N 3.42Å; G227-N229 PolarHBondContact O-N 2.92Å |
| 230 | Q | 90.6 | Very high | 94.3 | Very high | 99 Ų | 99 | 57 Ų | 57 | 46% | 0.463 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -104.1 | -44.9 | 178.7 | -61.7 | -171.7 | -2.6 | 0 | 0 | 112.4 | W147 V150 G227 L228 | W147-Q230 HydrophobicContact CH2-CB 3.78Å; W147-Q230 HydrophobicContact CH2-CG 3.89Å; W147-Q230 HydrophobicContact CZ3-CB 4.1Å; V150-Q230 HydrophobicContact CG1-CB 4.46Å; G227-Q230 PolarHBondContact O-N 2.86Å; G227-Q230 VanDerWaalsContact O-N 3.1Å; L228-Q230 VanDerWaalsContact C-N 3.32Å |
| 231 | N | 94.6 | Very high | 94.4 | Very high | 57 Ų | 57 | 57.3 Ų | 57.3 | 31% | 0.305 | 30% | 0.296 | S | S | . | . | trans | -147.4 | 110.4 | -179.6 | -172.3 | -70.4 | 0 | 0 | 0 | 110.3 | V150 G227 P233 V234 G235 | V150-N231 HydrophobicContact CG1-CB 3.91Å; V150-N231 HydrophobicContact CG2-CB 3.89Å; G227-N231 PolarHBondContact O-N 2.82Å; N231-P233 WeakPolarHBondContact OD1-CD 3.4Å; N231-V234 HydrophobicContact CB-CB 4.28Å; N231-V234 HydrophobicContact CB-CG2 4.43Å; N231-V234 PolarHBondContact O-N 3.31Å; N231-V234 WeakPolarHBondContact OD1-CG2 3.32Å; N231-V234 PolarHBondContact OD1-N 3.11Å; N231-V234 VanDerWaalsContact OD1-N 3.14Å; N231-G235 PolarHBondContact O-N 3.49Å | ||
| 232 | I | 94.9 | Very high | 94.5 | Very high | 111 Ų | 111 | 52.3 Ų | 52.3 | 57% | 0.569 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -58.9 | -50.8 | -174.5 | -62 | 170.7 | 0 | 0 | 0 | 112 | V234 G235 I236 | I232-V234 PolarHBondContact O-N 2.74Å; I232-G235 PolarHBondContact O-N 3.13Å; I232-I236 HydrophobicContact CG2-CD1 3.76Å; I232-I236 HydrophobicContact CG2-CG1 4.3Å; I232-I236 WeakPolarHBondContact O-CG1 3.38Å; I232-I236 PolarHBondContact O-N 3.3Å |
| 233 | P | 95.7 | Very high | 94.6 | Very high | 92 Ų | 92 | 51.3 Ų | 51.3 | 60% | 0.597 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -53.6 | -46.4 | 176.7 | -28 | 31.8 | 0 | 0 | 0 | 114.4 | N231 I236 M237 | N231-P233 WeakPolarHBondContact OD1-CD 3.4Å; P233-I236 PolarHBondContact O-N 2.82Å; P233-M237 PolarHBondContact O-N 2.94Å |
| 234 | V | 95.6 | Very high | 94.9 | Very high | 14 Ų | 14 | 53 Ų | 53 | 9% | 0.085 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -69.4 | -42.1 | 179.6 | 179.3 | 0 | 0 | 0 | 0 | 110.9 | A146 W147 V150 N231 I232 I236 M237 M238 | A146-V234 HydrophobicContact CB-CG1 3.94Å; A146-V234 HydrophobicContact CB-CG2 4.14Å; W147-V234 HydrophobicContact CB-CG1 4.29Å; W147-V234 HydrophobicContact CE3-CB 4.46Å; W147-V234 HydrophobicContact CE3-CG1 3.7Å; V150-V234 HydrophobicContact CG2-CB 4.37Å; V150-V234 HydrophobicContact CG2-CG2 3.73Å; N231-V234 HydrophobicContact CB-CB 4.28Å; N231-V234 HydrophobicContact CB-CG2 4.43Å; N231-V234 PolarHBondContact O-N 3.31Å; N231-V234 WeakPolarHBondContact OD1-CG2 3.32Å; N231-V234 PolarHBondContact OD1-N 3.11Å; N231-V234 VanDerWaalsContact OD1-N 3.14Å; I232-V234 PolarHBondContact O-N 2.74Å; V234-I236 VanDerWaalsContact C-N 3.33Å; V234-I236 PolarHBondContact O-N 2.85Å; V234-M237 WeakPolarHBondContact O-CB 3.11Å; V234-M237 PolarHBondContact O-N 3.2Å; V234-M237 VanDerWaalsContact O-N 3.17Å; V234-M238 HydrophobicContact CG1-CG 4.28Å; V234-M238 HydrophobicContact CG1-SD 3.95Å; V234-M238 VanDerWaalsContact O-CG 3.28Å; V234-M238 WeakPolarHBondContact O-CG 3.47Å; V234-M238 PolarHBondContact O-N 2.89Å |
| 235 | G | 95.8 | Very high | 95.1 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -56.5 | -43.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | N231 I232 M237 M238 I239 | N231-G235 PolarHBondContact O-N 3.49Å; I232-G235 PolarHBondContact O-N 3.13Å; G235-M237 PolarHBondContact O-N 3.28Å; G235-M238 PolarHBondContact O-N 3.02Å; G235-I239 VanDerWaalsContact O-CG1 3.3Å; G235-I239 WeakPolarHBondContact O-CG1 3.4Å; G235-I239 PolarHBondContact O-N 3.18Å |
| 236 | I | 96.6 | Very high | 95.3 | Very high | 90 Ų | 90 | 50.8 Ų | 50.8 | 46% | 0.462 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -61.7 | -45 | 176.2 | -68.2 | 167.9 | 0 | 0 | 0 | 111.1 | L228 I232 P233 V234 M238 I239 I240 | L228-I236 HydrophobicContact CD2-CG1 4.02Å; I232-I236 HydrophobicContact CG2-CD1 3.76Å; I232-I236 HydrophobicContact CG2-CG1 4.3Å; I232-I236 WeakPolarHBondContact O-CG1 3.38Å; I232-I236 PolarHBondContact O-N 3.3Å; P233-I236 PolarHBondContact O-N 2.82Å; V234-I236 VanDerWaalsContact C-N 3.33Å; V234-I236 PolarHBondContact O-N 2.85Å; I236-M238 VanDerWaalsContact C-N 3.31Å; I236-M238 PolarHBondContact O-N 3.3Å; I236-I239 PolarHBondContact O-N 3.36Å; I236-I240 HydrophobicContact CG2-CD1 4.4Å; I236-I240 WeakPolarHBondContact O-CG1 3.26Å; I236-I240 PolarHBondContact O-N 2.76Å; I236-I240 VanDerWaalsContact O-N 3.11Å |
| 237 | M | 96.4 | Very high | 95.6 | Very high | 79 Ų | 79 | 50.6 Ų | 50.6 | 39% | 0.389 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -58.7 | -44.1 | 176.1 | -173.1 | -168.2 | -56.2 | 0 | 0 | 111.4 | A146 P233 V234 G235 I240 I241 | A146-M237 HydrophobicContact CB-CE 4.13Å; A146-M237 HydrophobicContact CB-SD 3.96Å; P233-M237 PolarHBondContact O-N 2.94Å; V234-M237 WeakPolarHBondContact O-CB 3.11Å; V234-M237 PolarHBondContact O-N 3.2Å; V234-M237 VanDerWaalsContact O-N 3.17Å; G235-M237 PolarHBondContact O-N 3.28Å; M237-I240 PolarHBondContact O-N 3.18Å; M237-I241 HydrophobicContact CG-CD1 4.43Å; M237-I241 WeakPolarHBondContact O-CG1 3.18Å; M237-I241 PolarHBondContact O-N 3.44Å |
| 238 | M | 96.4 | Very high | 96 | Very high | 1 Ų | 1 | 50.6 Ų | 50.6 | 1% | 0.005 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -66.2 | -35.9 | 177.7 | -63.5 | 171.7 | 76.9 | 0 | 0 | 112.2 | W147 C219 S223 S224 V234 G235 I236 I240 I241 A242 | W147-M238 HydrophobicContact CB-CE 4.35Å; W147-M238 HydrophobicContact CB-SD 4.12Å; W147-M238 HydrophobicContact CD2-CE 4.07Å; W147-M238 HydrophobicContact CD2-SD 3.78Å; W147-M238 HydrophobicContact CE3-SD 3.77Å; W147-M238 HydrophobicContact CG-CE 3.93Å; W147-M238 HydrophobicContact CG-SD 3.95Å; C219-M238 HydrophobicContact CB-CB 4.1Å; C219-M238 HydrophobicContact CB-CE 4.28Å; C219-M238 HydrophobicContact CB-CG 4.16Å; S223-M238 WeakPolarHBondContact O-CE 3.24Å; S224-M238 VanDerWaalsContact CB-CB 3.47Å; V234-M238 HydrophobicContact CG1-CG 4.28Å; V234-M238 HydrophobicContact CG1-SD 3.95Å; V234-M238 VanDerWaalsContact O-CG 3.28Å; V234-M238 WeakPolarHBondContact O-CG 3.47Å; V234-M238 PolarHBondContact O-N 2.89Å; G235-M238 PolarHBondContact O-N 3.02Å; I236-M238 VanDerWaalsContact C-N 3.31Å; I236-M238 PolarHBondContact O-N 3.3Å; M238-I240 VanDerWaalsContact C-N 3.34Å; M238-I240 PolarHBondContact O-N 2.9Å; M238-I241 PolarHBondContact O-N 2.85Å; M238-A242 WeakPolarHBondContact O-CB 3.46Å; M238-A242 PolarHBondContact O-N 3.23Å |
| 239 | I | 97.7 | Very high | 96.2 | Very high | 42 Ų | 42 | 48.4 Ų | 48.4 | 22% | 0.215 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.8 | -40.7 | 174.8 | -71.7 | -73 | 0 | 0 | 0 | 111.2 | W221 S224 L225 L228 G235 I236 I241 A242 A243 | W221-I239 HydrophobicContact CE3-CD1 3.86Å; W221-I239 HydrophobicContact CZ3-CD1 3.67Å; W221-I239 HydrophobicContact CZ3-CG2 4.32Å; S224-I239 VanDerWaalsContact OG-CD1 3.31Å; S224-I239 WeakPolarHBondContact OG-CD1 3.33Å; L225-I239 HydrophobicContact CD2-CD1 4.33Å; L228-I239 HydrophobicContact CD1-CD1 4.26Å; L228-I239 HydrophobicContact CD1-CG1 4.03Å; G235-I239 VanDerWaalsContact O-CG1 3.3Å; G235-I239 WeakPolarHBondContact O-CG1 3.4Å; G235-I239 PolarHBondContact O-N 3.18Å; I236-I239 PolarHBondContact O-N 3.36Å; I239-I241 VanDerWaalsContact C-N 3.29Å; I239-I241 PolarHBondContact O-N 3.38Å; I239-A242 PolarHBondContact O-N 2.9Å; I239-A243 WeakPolarHBondContact O-CB 3.36Å; I239-A243 PolarHBondContact O-N 3.18Å |
| 240 | I | 97.8 | Very high | 96.5 | Very high | 101 Ų | 101 | 45.5 Ų | 45.5 | 52% | 0.518 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60 | -44.6 | 175.4 | -65.3 | 166.5 | 0 | 0 | 0 | 109.8 | I236 M237 M238 A243 L244 | I236-I240 HydrophobicContact CG2-CD1 4.4Å; I236-I240 WeakPolarHBondContact O-CG1 3.26Å; I236-I240 PolarHBondContact O-N 2.76Å; I236-I240 VanDerWaalsContact O-N 3.11Å; M237-I240 PolarHBondContact O-N 3.18Å; M238-I240 VanDerWaalsContact C-N 3.34Å; M238-I240 PolarHBondContact O-N 2.9Å; I240-A243 WeakPolarHBondContact O-CB 3.38Å; I240-A243 PolarHBondContact O-N 3.47Å; I240-L244 WeakPolarHBondContact O-CG 2.65Å; I240-L244 PolarHBondContact O-N 3.47Å |
| 241 | I | 97.8 | Very high | 96.7 | Very high | 7 Ų | 7 | 43.9 Ų | 43.9 | 4% | 0.036 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -65.1 | -42.2 | 177.7 | -64 | 160.5 | 0 | 0 | 0 | 111.2 | L139 N140 C219 M237 M238 I239 A243 L244 F245 | L139-I241 HydrophobicContact CB-CG1 4.46Å; L139-I241 WeakPolarHBondContact O-CD1 3.4Å; N140-I241 HydrophobicContact CB-CG2 4.02Å; C219-I241 HydrophobicContact CB-CB 4.07Å; C219-I241 HydrophobicContact CB-CD1 4.32Å; C219-I241 HydrophobicContact CB-CG2 3.81Å; M237-I241 HydrophobicContact CG-CD1 4.43Å; M237-I241 WeakPolarHBondContact O-CG1 3.18Å; M237-I241 PolarHBondContact O-N 3.44Å; M238-I241 PolarHBondContact O-N 2.85Å; I239-I241 VanDerWaalsContact C-N 3.29Å; I239-I241 PolarHBondContact O-N 3.38Å; I241-A243 VanDerWaalsContact C-N 3.29Å; I241-A243 PolarHBondContact O-N 2.98Å; I241-L244 WeakPolarHBondContact O-CB 3.29Å; I241-L244 PolarHBondContact O-N 2.86Å; I241-L244 VanDerWaalsContact O-N 3.12Å; I241-F245 HydrophobicContact CG2-CD2 3.82Å; I241-F245 HydrophobicContact CG2-CE2 3.56Å; I241-F245 WeakPolarHBondContact O-CD2 3.48Å; I241-F245 PolarHBondContact O-N 2.97Å |
| 242 | A | 97.8 | Very high | 96.7 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -59.9 | -39.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | C219 W221 M238 I239 F245 T246 | C219-A242 WeakPolarHBondContact O-CA 3.41Å; C219-A242 WeakPolarHBondContact O-CB 3.44Å; C219-A242 PolarHBondContact O-N 2.89Å; W221-A242 HydrophobicContact CD2-CB 4.11Å; W221-A242 HydrophobicContact CE3-CB 4.49Å; W221-A242 HydrophobicContact CG-CB 4.29Å; M238-A242 WeakPolarHBondContact O-CB 3.46Å; M238-A242 PolarHBondContact O-N 3.23Å; I239-A242 PolarHBondContact O-N 2.9Å; A242-F245 PolarHBondContact O-N 3.2Å; A242-T246 WeakPolarHBondContact O-CB 3.13Å; A242-T246 PolarHBondContact O-N 3.44Å; A242-T246 PolarHBondContact O-OG1 3.02Å |
| 243 | A | 98.1 | Very high | 96.8 | Very high | 46 Ų | 46 | 39.8 Ų | 39.8 | 38% | 0.38 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -64.9 | -39.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | I239 I240 I241 T246 A247 | I239-A243 WeakPolarHBondContact O-CB 3.36Å; I239-A243 PolarHBondContact O-N 3.18Å; I240-A243 WeakPolarHBondContact O-CB 3.38Å; I240-A243 PolarHBondContact O-N 3.47Å; I241-A243 VanDerWaalsContact C-N 3.29Å; I241-A243 PolarHBondContact O-N 2.98Å; A243-T246 WeakPolarHBondContact O-CB 3.39Å; A243-T246 PolarHBondContact O-N 3.42Å; A243-A247 WeakPolarHBondContact O-CB 3.49Å; A243-A247 PolarHBondContact O-N 2.77Å |
| 244 | L | 98 | Very high | 96.8 | Very high | 41 Ų | 41 | 39.7 Ų | 39.7 | 22% | 0.215 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -65.1 | -41.2 | 174.8 | -66.6 | 173.2 | 0 | 0 | 0 | 112.4 | F132 T136 L139 I240 I241 T246 A247 S248 | F132-L244 WeakPolarHBondContact CE1-O 3.36Å; F132-L244 HydrophobicContact CE2-CD2 3.82Å; F132-L244 HydrophobicContact CZ-CB 4.27Å; F132-L244 HydrophobicContact CZ-CD2 3.65Å; T136-L244 HydrophobicContact CG2-CB 3.64Å; L139-L244 HydrophobicContact CD1-CD1 3.7Å; I240-L244 WeakPolarHBondContact O-CG 2.65Å; I240-L244 PolarHBondContact O-N 3.47Å; I241-L244 WeakPolarHBondContact O-CB 3.29Å; I241-L244 PolarHBondContact O-N 2.86Å; I241-L244 VanDerWaalsContact O-N 3.12Å; L244-T246 VanDerWaalsContact C-N 3.33Å; L244-A247 PolarHBondContact O-N 3.43Å; L244-S248 PolarHBondContact O-N 2.93Å; L244-S248 PolarHBondContact O-OG 3.34Å |
| 245 | F | 97.7 | Very high | 96.7 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64 | -39.6 | 172.6 | -78.4 | -54.7 | 0 | 0 | 0 | 111.9 | T136 L137 N140 Q209 A210 N218 I241 A242 S248 A249 | T136-F245 HydrophobicContact CG2-CD1 3.57Å; T136-F245 HydrophobicContact CG2-CD2 4.2Å; T136-F245 HydrophobicContact CG2-CE1 3.6Å; T136-F245 HydrophobicContact CG2-CE2 4.23Å; T136-F245 HydrophobicContact CG2-CG 3.88Å; T136-F245 HydrophobicContact CG2-CZ 3.94Å; L137-F245 HydrophobicContact CD2-CE1 4.14Å; L137-F245 HydrophobicContact CD2-CZ 4.2Å; N140-F245 HydrophobicContact CB-CE2 4.01Å; N140-F245 HydrophobicContact CB-CZ 3.86Å; Q209-F245 HydrophobicContact CB-CD1 3.7Å; Q209-F245 HydrophobicContact CB-CD2 4.4Å; Q209-F245 HydrophobicContact CB-CE1 3.89Å; Q209-F245 HydrophobicContact CB-CG 3.99Å; Q209-F245 HydrophobicContact CB-CZ 4.31Å; Q209-F245 HydrophobicContact CG-CD1 4.49Å; Q209-F245 HydrophobicContact CG-CE1 4.24Å; A210-F245 HydrophobicContact CB-CB 4.09Å; N218-F245 HydrophobicContact CB-CE2 4.48Å; I241-F245 HydrophobicContact CG2-CD2 3.82Å; I241-F245 HydrophobicContact CG2-CE2 3.56Å; I241-F245 WeakPolarHBondContact O-CD2 3.48Å; I241-F245 PolarHBondContact O-N 2.97Å; A242-F245 PolarHBondContact O-N 3.2Å; F245-S248 WeakPolarHBondContact O-CB 3.3Å; F245-S248 PolarHBondContact O-N 3.28Å; F245-A249 PolarHBondContact O-N 3.13Å |
| 246 | T | 97.9 | Very high | 96.6 | Very high | 45 Ų | 45 | 41.4 Ų | 41.4 | 28% | 0.276 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -63.7 | -45.4 | 175.4 | -55.6 | 0 | 0 | 0 | 0 | 111 | W221 A242 A243 L244 S248 A249 V250 | W221-T246 PolarHBondContact NE1-OG1 3.38Å; A242-T246 WeakPolarHBondContact O-CB 3.13Å; A242-T246 PolarHBondContact O-N 3.44Å; A242-T246 PolarHBondContact O-OG1 3.02Å; A243-T246 WeakPolarHBondContact O-CB 3.39Å; A243-T246 PolarHBondContact O-N 3.42Å; L244-T246 VanDerWaalsContact C-N 3.33Å; T246-S248 VanDerWaalsContact C-N 3.29Å; T246-S248 PolarHBondContact O-N 3.05Å; T246-A249 PolarHBondContact O-N 3.13Å; T246-V250 WeakPolarHBondContact O-CG2 3.47Å; T246-V250 PolarHBondContact O-N 3.15Å |
| 247 | A | 97.5 | Very high | 96.4 | Very high | 35 Ų | 35 | 44.1 Ų | 44.1 | 29% | 0.289 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -59.1 | -41.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | F132 A243 L244 A249 V250 I251 | F132-A247 HydrophobicContact CE1-CB 4.14Å; F132-A247 HydrophobicContact CZ-CB 4.16Å; A243-A247 WeakPolarHBondContact O-CB 3.49Å; A243-A247 PolarHBondContact O-N 2.77Å; L244-A247 PolarHBondContact O-N 3.43Å; A247-A249 PolarHBondContact O-N 3.37Å; A247-V250 PolarHBondContact O-N 3.36Å; A247-I251 WeakPolarHBondContact O-CB 3.31Å; A247-I251 WeakPolarHBondContact O-CD1 3.41Å; A247-I251 WeakPolarHBondContact O-CG1 3.5Å; A247-I251 PolarHBondContact O-N 3.33Å |
| 248 | S | 95.6 | Very high | 96.1 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58.3 | -47.4 | 174.4 | -59.9 | 0 | 0 | 0 | 0 | 111.3 | F132 L244 F245 T246 S252 | F132-S248 VanDerWaalsContact CD1-OG 3.31Å; F132-S248 WeakPolarHBondContact CD1-OG 3.42Å; F132-S248 WeakPolarHBondContact CE1-OG 3.27Å; L244-S248 PolarHBondContact O-N 2.93Å; L244-S248 PolarHBondContact O-OG 3.34Å; F245-S248 WeakPolarHBondContact O-CB 3.3Å; F245-S248 PolarHBondContact O-N 3.28Å; T246-S248 VanDerWaalsContact C-N 3.29Å; T246-S248 PolarHBondContact O-N 3.05Å; S248-S252 VanDerWaalsContact O-CB 3.22Å; S248-S252 WeakPolarHBondContact O-CB 3.48Å; S248-S252 PolarHBondContact O-N 2.89Å; S248-S252 PolarHBondContact O-OG 3Å |
| 249 | A | 96.7 | Very high | 95.9 | Very high | 11 Ų | 11 | 45.2 Ų | 45.2 | 9% | 0.091 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.3 | -45.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | F203 H206 F245 T246 A247 S252 L253 | F203-A249 WeakPolarHBondContact CE2-O 3.37Å; H206-A249 HydrophobicContact CB-CB 3.95Å; F245-A249 PolarHBondContact O-N 3.13Å; T246-A249 PolarHBondContact O-N 3.13Å; A247-A249 PolarHBondContact O-N 3.37Å; A249-S252 WeakPolarHBondContact O-CB 3.45Å; A249-S252 PolarHBondContact O-N 2.99Å; A249-L253 PolarHBondContact O-N 3.23Å |
| 250 | V | 97.5 | Very high | 95.5 | Very high | 84 Ų | 84 | 47 Ų | 47 | 51% | 0.509 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -63.9 | -49.3 | 179.5 | 172.5 | 0 | 0 | 0 | 0 | 111.1 | T246 A247 S252 L253 V254 | T246-V250 WeakPolarHBondContact O-CG2 3.47Å; T246-V250 PolarHBondContact O-N 3.15Å; A247-V250 PolarHBondContact O-N 3.36Å; V250-S252 VanDerWaalsContact C-N 3.31Å; V250-S252 PolarHBondContact O-N 2.64Å; V250-L253 PolarHBondContact O-N 3.12Å; V250-V254 WeakPolarHBondContact O-CG2 3.49Å; V250-V254 PolarHBondContact O-N 3.23Å |
| 251 | I | 95.4 | Very high | 94.9 | Very high | 66 Ų | 66 | 43.8 Ų | 43.8 | 34% | 0.338 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62.6 | -41.8 | 178.1 | -62.4 | 164.8 | 0 | 0 | 0 | 109.7 | L129 A247 L253 V254 M255 | L129-I251 HydrophobicContact CD1-CB 3.96Å; L129-I251 HydrophobicContact CD1-CG2 3.75Å; L129-I251 HydrophobicContact CD2-CG2 4.23Å; L129-I251 HydrophobicContact CG-CG2 4.41Å; A247-I251 WeakPolarHBondContact O-CB 3.31Å; A247-I251 WeakPolarHBondContact O-CD1 3.41Å; A247-I251 WeakPolarHBondContact O-CG1 3.5Å; A247-I251 PolarHBondContact O-N 3.33Å; I251-L253 VanDerWaalsContact C-N 3.33Å; I251-L253 PolarHBondContact O-N 2.82Å; I251-V254 PolarHBondContact O-N 3.34Å; I251-M255 HydrophobicContact CG2-CG 4.1Å; I251-M255 WeakPolarHBondContact O-CB 3.39Å; I251-M255 VanDerWaalsContact O-CG 3.26Å; I251-M255 WeakPolarHBondContact O-CG 3.32Å; I251-M255 PolarHBondContact O-N 3.05Å |
| 252 | S | 94.9 | Very high | 94.3 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -56.1 | -44 | 173.8 | -86.6 | 0 | 0 | 0 | 0 | 112.9 | Y199 H206 S248 A249 V250 M255 F256 | Y199-S252 WeakPolarHBondContact OH-CA 3.36Å; Y199-S252 PolarHBondContact OH-OG 3.33Å; Y199-S252 VanDerWaalsContact OH-OG 3.07Å; H206-S252 PolarHBondContact CE1-OG 2.98Å; H206-S252 PolarHBondContact ND1-OG 2.94Å; S248-S252 VanDerWaalsContact O-CB 3.22Å; S248-S252 WeakPolarHBondContact O-CB 3.48Å; S248-S252 PolarHBondContact O-N 2.89Å; S248-S252 PolarHBondContact O-OG 3Å; A249-S252 WeakPolarHBondContact O-CB 3.45Å; A249-S252 PolarHBondContact O-N 2.99Å; V250-S252 VanDerWaalsContact C-N 3.31Å; V250-S252 PolarHBondContact O-N 2.64Å; S252-M255 PolarHBondContact O-N 3.22Å; S252-F256 VanDerWaalsContact O-CB 3.29Å; S252-F256 WeakPolarHBondContact O-CB 3.48Å; S252-F256 PolarHBondContact O-N 2.82Å |
| 253 | L | 96 | Very high | 93.6 | Very high | 81 Ų | 81 | 46.7 Ų | 46.7 | 42% | 0.424 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -65.2 | -45.3 | 179 | -177.6 | 61.5 | 0 | 0 | 0 | 111.8 | F203 A249 V250 I251 M255 F256 K257 | F203-L253 HydrophobicContact CE2-CB 3.84Å; F203-L253 HydrophobicContact CE2-CD1 4.38Å; F203-L253 HydrophobicContact CZ-CB 4.31Å; F203-L253 HydrophobicContact CZ-CD1 4.16Å; A249-L253 PolarHBondContact O-N 3.23Å; V250-L253 PolarHBondContact O-N 3.12Å; I251-L253 VanDerWaalsContact C-N 3.33Å; I251-L253 PolarHBondContact O-N 2.82Å; L253-M255 VanDerWaalsContact C-N 3.31Å; L253-M255 PolarHBondContact O-N 3.11Å; L253-F256 PolarHBondContact O-N 3.46Å; L253-K257 WeakPolarHBondContact O-CG 3Å; L253-K257 PolarHBondContact O-N 2.91Å |
| 254 | V | 95.6 | Very high | 92.7 | Very high | 91 Ų | 91 | 53.4 Ų | 53.4 | 55% | 0.552 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -60.1 | -45.3 | 176.9 | 172.3 | 0 | 0 | 0 | 0 | 110.3 | V250 I251 K257 K258 | V250-V254 WeakPolarHBondContact O-CG2 3.49Å; V250-V254 PolarHBondContact O-N 3.23Å; I251-V254 PolarHBondContact O-N 3.34Å; V254-K257 PolarHBondContact O-N 3.37Å; V254-K258 WeakPolarHBondContact O-CB 3.46Å; V254-K258 PolarHBondContact O-N 3.19Å |
| 255 | M | 93.4 | Very high | 91.7 | Very high | 3 Ų | 3 | 56.8 Ų | 56.8 | 2% | 0.015 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -69.6 | -37.2 | -179.8 | -70.1 | -54.1 | -70.3 | 0 | 0 | 112.9 | T122 L125 M126 L129 I251 S252 L253 K258 V259 | T122-M255 HydrophobicContact CG2-CE 3.79Å; T122-M255 WeakPolarHBondContact O-CE 3.38Å; L125-M255 HydrophobicContact CB-CE 3.8Å; L125-M255 HydrophobicContact CB-SD 4.38Å; L125-M255 HydrophobicContact CD2-CE 3.85Å; L125-M255 HydrophobicContact CD2-SD 3.34Å; L125-M255 WeakPolarHBondContact CD2-SD 3.47Å; L125-M255 HydrophobicContact CG-CE 3.83Å; L125-M255 HydrophobicContact CG-SD 3.76Å; M126-M255 HydrophobicContact CG-CE 3.54Å; M126-M255 HydrophobicContact SD-CB 3.49Å; M126-M255 WeakPolarHBondContact SD-CB 3.16Å; M126-M255 HydrophobicContact SD-CE 3.79Å; M126-M255 HydrophobicContact SD-CG 4.01Å; L129-M255 HydrophobicContact CD2-CB 4.45Å; L129-M255 HydrophobicContact CD2-CG 4.36Å; I251-M255 HydrophobicContact CG2-CG 4.1Å; I251-M255 WeakPolarHBondContact O-CB 3.39Å; I251-M255 VanDerWaalsContact O-CG 3.26Å; I251-M255 WeakPolarHBondContact O-CG 3.32Å; I251-M255 PolarHBondContact O-N 3.05Å; S252-M255 PolarHBondContact O-N 3.22Å; L253-M255 VanDerWaalsContact C-N 3.31Å; L253-M255 PolarHBondContact O-N 3.11Å; M255-K258 HydrophobicContact CE-CD 4.38Å; M255-K258 PolarHBondContact O-N 3.36Å; M255-K258 HydrophobicContact SD-CD 4.11Å; M255-V259 WeakPolarHBondContact O-CB 3.5Å; M255-V259 WeakPolarHBondContact O-CG2 3.2Å; M255-V259 PolarHBondContact O-N 3.22Å |
| 256 | F | 93.4 | Very high | 90.3 | Very high | 47 Ų | 47 | 58.3 Ų | 58.3 | 21% | 0.206 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -57.8 | -49.5 | 172.4 | 180 | -97.6 | 0 | 0 | 0 | 111.1 | F196 Y199 I200 S252 L253 K258 V259 H260 | F196-F256 HydrophobicContact CD1-CD2 4.19Å; F196-F256 AromaticContact CD1-CE2 3.66Å; F196-F256 HydrophobicContact CD1-CE2 3.66Å; F196-F256 HydrophobicContact CD1-CZ 4.25Å; F196-F256 HydrophobicContact CE1-CE2 4.36Å; Y199-F256 HydrophobicContact CD1-CB 4.28Å; Y199-F256 AromaticContact CD1-CD2 3.68Å; Y199-F256 HydrophobicContact CD1-CD2 3.68Å; Y199-F256 HydrophobicContact CD1-CG 4.43Å; Y199-F256 HydrophobicContact CE1-CB 4.02Å; Y199-F256 HydrophobicContact CE1-CD2 4.29Å; I200-F256 HydrophobicContact CD1-CZ 4.35Å; I200-F256 HydrophobicContact CG1-CE2 3.95Å; I200-F256 HydrophobicContact CG1-CZ 4.07Å; S252-F256 VanDerWaalsContact O-CB 3.29Å; S252-F256 WeakPolarHBondContact O-CB 3.48Å; S252-F256 PolarHBondContact O-N 2.82Å; L253-F256 PolarHBondContact O-N 3.46Å; F256-K258 VanDerWaalsContact C-N 3.32Å; F256-K258 PolarHBondContact O-N 3.25Å; F256-V259 PolarHBondContact O-N 3.17Å; F256-H260 VanDerWaalsContact O-CB 3.24Å; F256-H260 WeakPolarHBondContact O-CB 3.49Å; F256-H260 PolarHBondContact O-N 3.49Å |
| 257 | K | 92.3 | Very high | 88.6 | Confident | 147 Ų | 147 | 58.9 Ų | 58.9 | 64% | 0.639 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -59.4 | -43 | 176.1 | -71.6 | -76.8 | -175.1 | 171.6 | 0 | 111.6 | L253 V254 G261 | L253-K257 WeakPolarHBondContact O-CG 3Å; L253-K257 PolarHBondContact O-N 2.91Å; V254-K257 PolarHBondContact O-N 3.37Å; K257-G261 PolarHBondContact O-N 3.26Å |
| 258 | K | 90.9 | Very high | 87 | Confident | 103 Ų | 103 | 57.8 Ų | 57.8 | 45% | 0.448 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.2 | -50.5 | 178.9 | -171.8 | 179.1 | 176.3 | 74.3 | 0 | 111.8 | T122 V254 M255 F256 H260 G261 L262 | T122-K258 HydrophobicContact CG2-CD 4.28Å; T122-K258 HydrophobicContact CG2-CG 4.49Å; T122-K258 WeakPolarHBondContact OG1-CE 3.35Å; V254-K258 WeakPolarHBondContact O-CB 3.46Å; V254-K258 PolarHBondContact O-N 3.19Å; M255-K258 HydrophobicContact CE-CD 4.38Å; M255-K258 PolarHBondContact O-N 3.36Å; M255-K258 HydrophobicContact SD-CD 4.11Å; F256-K258 VanDerWaalsContact C-N 3.32Å; F256-K258 PolarHBondContact O-N 3.25Å; K258-H260 VanDerWaalsContact C-N 3.34Å; K258-H260 PolarHBondContact O-N 3.42Å; K258-G261 PolarHBondContact O-N 3.24Å; K258-L262 HydrophobicContact CG-CD1 4Å; K258-L262 WeakPolarHBondContact O-CD1 3.41Å; K258-L262 PolarHBondContact O-N 3.01Å |
| 259 | V | 91.1 | Very high | 85.7 | Confident | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -64.9 | -38.9 | 179.4 | 174.2 | 0 | 0 | 0 | 0 | 111.2 | T122 M126 L180 F184 F192 F195 F196 M255 F256 L262 Y263 | T122-V259 HydrophobicContact CG2-CG2 3.73Å; M126-V259 HydrophobicContact CE-CG2 4.21Å; M126-V259 HydrophobicContact CG-CG2 4.45Å; L180-V259 HydrophobicContact CD1-CG1 3.88Å; L180-V259 HydrophobicContact CD1-CG2 4.25Å; F184-V259 HydrophobicContact CE2-CG1 4.06Å; F184-V259 HydrophobicContact CE2-CG2 4.42Å; F184-V259 HydrophobicContact CZ-CG1 4.1Å; F192-V259 HydrophobicContact CE1-CG1 4.29Å; F195-V259 HydrophobicContact CD1-CG1 4.18Å; F195-V259 HydrophobicContact CE1-CB 4.25Å; F195-V259 HydrophobicContact CE1-CG1 3.54Å; F195-V259 HydrophobicContact CZ-CG1 4.26Å; F196-V259 HydrophobicContact CE1-CG1 4.03Å; F196-V259 HydrophobicContact CZ-CG1 3.95Å; M255-V259 WeakPolarHBondContact O-CB 3.5Å; M255-V259 WeakPolarHBondContact O-CG2 3.2Å; M255-V259 PolarHBondContact O-N 3.22Å; F256-V259 PolarHBondContact O-N 3.17Å; V259-L262 WeakPolarHBondContact O-CB 3Å; V259-L262 PolarHBondContact O-N 3.46Å; V259-Y263 WeakPolarHBondContact O-CB 3.41Å; V259-Y263 PolarHBondContact O-N 3.14Å |
| 260 | H | 89.7 | Confident | 84.1 | Confident | 80 Ų | 80 | 66 Ų | 66 | 37% | 0.37 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.7 | -39.7 | 173.2 | -176.6 | -91.8 | 0 | 0 | 0 | 112.4 | F196 F256 K258 Y263 R264 | F196-H260 HydrophobicContact CE1-CB 3.91Å; F196-H260 HydrophobicContact CZ-CB 4.16Å; F256-H260 VanDerWaalsContact O-CB 3.24Å; F256-H260 WeakPolarHBondContact O-CB 3.49Å; F256-H260 PolarHBondContact O-N 3.49Å; K258-H260 VanDerWaalsContact C-N 3.34Å; K258-H260 PolarHBondContact O-N 3.42Å; H260-Y263 PolarHBondContact O-N 2.94Å; H260-R264 WeakPolarHBondContact O-CG 3.34Å; H260-R264 PolarHBondContact O-N 3.22Å; H260-R264 VanDerWaalsContact O-N 3.13Å |
| 261 | G | 86.4 | Confident | 82.7 | Confident | 33 Ų | 33 | 68.7 Ų | 68.7 | 34% | 0.34 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -60.5 | -46.5 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | K257 K258 Y263 R264 T265 | K257-G261 PolarHBondContact O-N 3.26Å; K258-G261 PolarHBondContact O-N 3.24Å; G261-Y263 PolarHBondContact O-N 3.25Å; G261-R264 PolarHBondContact O-N 2.86Å; G261-T265 PolarHBondContact O-N 3.35Å |
| 262 | L | 85.4 | Confident | 81.8 | Confident | 27 Ų | 27 | 68.6 Ų | 68.6 | 14% | 0.141 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -59.4 | -45 | 175.7 | -79.4 | 147.8 | 0 | 0 | 0 | 112.3 | F119 T122 F184 K258 V259 R264 T265 T266 | F119-L262 HydrophobicContact CD1-CD2 3.4Å; F119-L262 HydrophobicContact CE1-CD2 3.43Å; F119-L262 VanDerWaalsContact CE1-CD2 3.43Å; T122-L262 HydrophobicContact CG2-CD1 3.7Å; T122-L262 WeakPolarHBondContact OG1-CD1 3.48Å; F184-L262 HydrophobicContact CE1-CB 4.35Å; F184-L262 HydrophobicContact CZ-CB 4.32Å; F184-L262 HydrophobicContact CZ-CD1 4.43Å; K258-L262 HydrophobicContact CG-CD1 4Å; K258-L262 WeakPolarHBondContact O-CD1 3.41Å; K258-L262 PolarHBondContact O-N 3.01Å; V259-L262 WeakPolarHBondContact O-CB 3Å; V259-L262 PolarHBondContact O-N 3.46Å; L262-R264 VanDerWaalsContact C-N 3.27Å; L262-R264 PolarHBondContact O-N 3.43Å; L262-T265 WeakPolarHBondContact CA-OG1 3.49Å; L262-T265 PolarHBondContact O-N 2.85Å; L262-T265 PolarHBondContact O-OG1 3.32Å; L262-T266 PolarHBondContact O-N 2.94Å; L262-T266 PolarHBondContact O-OG1 3.1Å; L262-T266 VanDerWaalsContact O-OG1 3.06Å |
| 263 | Y | 82.3 | Confident | 80.5 | Confident | 41 Ų | 41 | 69 Ų | 69 | 16% | 0.161 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -56.9 | -39 | 175.3 | 170.8 | -101 | 0 | 0 | 0 | 112.5 | F192 F196 V259 H260 G261 T265 T266 A268 | F192-Y263 HydrophobicContact CB-CD2 3.66Å; F192-Y263 HydrophobicContact CB-CE2 3.77Å; F192-Y263 HydrophobicContact CD1-CD2 4.1Å; F192-Y263 AromaticContact CD2-CD2 3.98Å; F192-Y263 HydrophobicContact CD2-CD2 3.98Å; F192-Y263 HydrophobicContact CD2-CE2 4.47Å; F192-Y263 AromaticContact CG-CD2 3.66Å; F192-Y263 HydrophobicContact CG-CD2 3.66Å; F192-Y263 HydrophobicContact CG-CE2 4.21Å; F196-Y263 HydrophobicContact CE2-CD1 4.07Å; F196-Y263 AromaticContact CE2-CD2 3.98Å; F196-Y263 HydrophobicContact CE2-CD2 3.98Å; F196-Y263 AromaticContact CE2-CG 3.73Å; F196-Y263 HydrophobicContact CE2-CG 3.73Å; F196-Y263 HydrophobicContact CZ-CG 4.13Å; V259-Y263 WeakPolarHBondContact O-CB 3.41Å; V259-Y263 PolarHBondContact O-N 3.14Å; H260-Y263 PolarHBondContact O-N 2.94Å; G261-Y263 PolarHBondContact O-N 3.25Å; Y263-T265 VanDerWaalsContact C-N 3.3Å; Y263-T265 PolarHBondContact O-N 3.38Å; Y263-T266 WeakPolarHBondContact CA-OG1 3.42Å; Y263-T266 PolarHBondContact O-OG1 3.05Å; Y263-T266 VanDerWaalsContact O-OG1 3.12Å; Y263-A268 HydrophobicContact CD2-CB 3.54Å; Y263-A268 HydrophobicContact CE2-CB 3.27Å; Y263-A268 HydrophobicContact CG-CB 4.46Å; Y263-A268 PolarHBondContact OH-O 3.3Å |
| 264 | R | 80.1 | Confident | 79.3 | Confident | 187 Ų | 187 | 71.1 Ų | 71.1 | 71% | 0.706 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -69.6 | -27.1 | 175.6 | -70.7 | -177.4 | 61.9 | 78.4 | 3.9 | 113.2 | H260 G261 L262 | H260-R264 WeakPolarHBondContact O-CG 3.34Å; H260-R264 PolarHBondContact O-N 3.22Å; H260-R264 VanDerWaalsContact O-N 3.13Å; G261-R264 PolarHBondContact O-N 2.86Å; L262-R264 VanDerWaalsContact C-N 3.27Å; L262-R264 PolarHBondContact O-N 3.43Å |
| 265 | T | 75.8 | Confident | 78.4 | Confident | 111 Ų | 111 | 73 Ų | 73 | 68% | 0.681 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -84.2 | -25.1 | 179.1 | 56.1 | 0 | 0 | 0 | 0 | 113.6 | G261 L262 Y263 G267 | G261-T265 PolarHBondContact O-N 3.35Å; L262-T265 WeakPolarHBondContact CA-OG1 3.49Å; L262-T265 PolarHBondContact O-N 2.85Å; L262-T265 PolarHBondContact O-OG1 3.32Å; Y263-T265 VanDerWaalsContact C-N 3.3Å; Y263-T265 PolarHBondContact O-N 3.38Å; T265-G267 PolarHBondContact O-N 3.06Å |
| 266 | T | 67.8 | Low | 77.7 | Confident | 32 Ų | 32 | 75.3 Ų | 75.3 | 20% | 0.196 | 38% | 0.378 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.2 | 3.9 | 179.1 | 34.3 | 0 | 0 | 0 | 0 | 114.3 | F119 L262 Y263 A268 | F119-T266 HydrophobicContact CE1-CG2 4.27Å; F119-T266 HydrophobicContact CE2-CG2 4.07Å; F119-T266 HydrophobicContact CZ-CG2 3.47Å; F119-T266 VanDerWaalsContact CZ-CG2 3.47Å; L262-T266 PolarHBondContact O-N 2.94Å; L262-T266 PolarHBondContact O-OG1 3.1Å; L262-T266 VanDerWaalsContact O-OG1 3.06Å; Y263-T266 WeakPolarHBondContact CA-OG1 3.42Å; Y263-T266 PolarHBondContact O-OG1 3.05Å; Y263-T266 VanDerWaalsContact O-OG1 3.12Å; T266-A268 PolarHBondContact O-N 2.88Å; T266-A268 VanDerWaalsContact O-N 3.15Å |
| 267 | G | 64 | Low | 76.9 | Confident | 57 Ų | 57 | 78.4 Ų | 78.4 | 59% | 0.588 | 39% | 0.392 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.5 | 15.5 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | T265 S269 | T265-G267 PolarHBondContact O-N 3.06Å; G267-S269 PolarHBondContact O-N 3.33Å |
| 268 | A | 63.5 | Low | 76.1 | Confident | 12 Ų | 12 | 73.2 Ų | 73.2 | 10% | 0.099 | 38% | 0.376 | C | S | . | . | trans | -69.7 | 127.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | Y263 T266 | Y263-A268 HydrophobicContact CD2-CB 3.54Å; Y263-A268 HydrophobicContact CE2-CB 3.27Å; Y263-A268 HydrophobicContact CG-CB 4.46Å; Y263-A268 PolarHBondContact OH-O 3.3Å; T266-A268 PolarHBondContact O-N 2.88Å; T266-A268 VanDerWaalsContact O-N 3.15Å | ||
| 269 | S | 67.1 | Low | 75.3 | Confident | 44 Ų | 44 | 72.4 Ų | 72.4 | 31% | 0.308 | 38% | 0.38 | S | S | . | . | trans | -132.3 | 163.8 | -176.2 | 76.9 | 0 | 0 | 0 | 0 | 111.3 | G267 E271 K272 A273 | G267-S269 PolarHBondContact O-N 3.33Å; S269-E271 VanDerWaalsContact C-N 3.3Å; S269-E271 PolarHBondContact O-N 3.45Å; S269-K272 PolarHBondContact O-N 3.35Å; S269-K272 PolarHBondContact OG-N 2.96Å; S269-K272 VanDerWaalsContact OG-N 3.09Å; S269-A273 PolarHBondContact O-N 3.22Å | ||
| 270 | F | 64.6 | Low | 74.3 | Confident | 140 Ų | 140 | 74.1 Ų | 74.1 | 61% | 0.614 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -62.8 | -37.9 | 174.9 | -175.5 | -98.2 | 0 | 0 | 0 | 111.9 | A273 Q274 | F270-A273 WeakPolarHBondContact O-CB 3.17Å; F270-A273 PolarHBondContact O-N 3.47Å; F270-Q274 PolarHBondContact O-N 3.26Å |
| 271 | E | 68.3 | Low | 73.4 | Confident | 141 Ų | 141 | 73.1 Ų | 73.1 | 66% | 0.659 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -64 | -43.2 | 175.6 | -71.9 | 169.7 | 146.2 | 0 | 0 | 111.8 | S269 A273 Q274 Q275 | S269-E271 VanDerWaalsContact C-N 3.3Å; S269-E271 PolarHBondContact O-N 3.45Å; E271-A273 VanDerWaalsContact C-N 3.29Å; E271-A273 PolarHBondContact O-N 2.85Å; E271-Q274 PolarHBondContact O-N 2.93Å; E271-Q275 WeakPolarHBondContact O-CG 3.38Å; E271-Q275 PolarHBondContact O-N 3.04Å |
| 272 | K | 75.3 | Confident | 72.4 | Confident | 63 Ų | 63 | 77.4 Ų | 77.4 | 27% | 0.274 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61.1 | -39.7 | 172.8 | -175 | 178.7 | 169.3 | -168.5 | 0 | 110.8 | D187 S189 S269 Q275 E276 | D187-K272 IonicContact OD2-NZ 3.02Å; D187-K272 PolarHBondContact OD2-NZ 3.36Å; S189-K272 WeakPolarHBondContact OG-CD 3.28Å; S189-K272 WeakPolarHBondContact OG-CG 3.4Å; S269-K272 PolarHBondContact O-N 3.35Å; S269-K272 PolarHBondContact OG-N 2.96Å; S269-K272 VanDerWaalsContact OG-N 3.09Å; K272-Q275 PolarHBondContact O-N 3.02Å; K272-E276 WeakPolarHBondContact CE-OE1 3.46Å; K272-E276 WeakPolarHBondContact O-CB 3.31Å; K272-E276 VanDerWaalsContact O-CG 3.31Å; K272-E276 WeakPolarHBondContact O-CG 3.09Å; K272-E276 PolarHBondContact O-N 3.01Å |
| 273 | A | 67.3 | Low | 71.6 | Confident | 9 Ų | 9 | 79.7 Ų | 79.7 | 7% | 0.074 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -65.1 | -38.5 | 175 | 0 | 0 | 0 | 0 | 0 | 113 | S269 F270 E271 E276 F277 | S269-A273 PolarHBondContact O-N 3.22Å; F270-A273 WeakPolarHBondContact O-CB 3.17Å; F270-A273 PolarHBondContact O-N 3.47Å; E271-A273 VanDerWaalsContact C-N 3.29Å; E271-A273 PolarHBondContact O-N 2.85Å; A273-E276 PolarHBondContact O-N 2.71Å; A273-F277 VanDerWaalsContact O-CB 3.31Å; A273-F277 WeakPolarHBondContact O-CB 3.28Å; A273-F277 PolarHBondContact O-N 3.45Å |
| 274 | Q | 71.5 | Confident | 71 | Confident | 125 Ų | 125 | 81.4 Ų | 81.4 | 58% | 0.584 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -67.3 | -40.5 | 175.8 | -174.4 | 177.1 | -6.3 | 0 | 0 | 111.4 | F270 E271 F277 A278 | F270-Q274 PolarHBondContact O-N 3.26Å; E271-Q274 PolarHBondContact O-N 2.93Å; Q274-F277 PolarHBondContact O-N 3.48Å; Q274-A278 VanDerWaalsContact O-CB 3.22Å; Q274-A278 WeakPolarHBondContact O-CB 3.46Å; Q274-A278 PolarHBondContact O-N 2.8Å |
| 275 | Q | 76.6 | Confident | 70.4 | Confident | 132 Ų | 132 | 80.5 Ų | 80.5 | 62% | 0.617 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -63.9 | -47.6 | 173.6 | -71.4 | 174.7 | -2.7 | 0 | 0 | 111.3 | E271 K272 F277 A278 T279 | E271-Q275 WeakPolarHBondContact O-CG 3.38Å; E271-Q275 PolarHBondContact O-N 3.04Å; K272-Q275 PolarHBondContact O-N 3.02Å; Q275-F277 VanDerWaalsContact C-N 3.32Å; Q275-F277 PolarHBondContact O-N 3.31Å; Q275-A278 PolarHBondContact O-N 2.86Å; Q275-T279 WeakPolarHBondContact O-CB 3.39Å; Q275-T279 PolarHBondContact O-N 3.29Å; Q275-T279 PolarHBondContact O-OG1 2.77Å |
| 276 | E | 78.4 | Confident | 70.4 | Confident | 50 Ų | 50 | 80.3 Ų | 80.3 | 23% | 0.234 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -60.1 | -40.3 | 176 | -76.2 | 175.9 | -150.8 | 0 | 0 | 112.3 | S188 S189 F190 K272 A273 G280 | S188-E276 VanDerWaalsContact C-OE2 3.31Å; S188-E276 WeakPolarHBondContact CA-OE2 3.49Å; S188-E276 WeakPolarHBondContact CB-OE2 3.45Å; S188-E276 PolarHBondContact OG-OE2 2.87Å; S189-E276 VanDerWaalsContact N-CD 3.35Å; S189-E276 PolarHBondContact N-OE1 3.22Å; S189-E276 PolarHBondContact N-OE2 2.93Å; S189-E276 PolarHBondContact OG-OE1 2.94Å; F190-E276 PolarHBondContact N-OE2 3.37Å; K272-E276 WeakPolarHBondContact CE-OE1 3.46Å; K272-E276 WeakPolarHBondContact O-CB 3.31Å; K272-E276 VanDerWaalsContact O-CG 3.31Å; K272-E276 WeakPolarHBondContact O-CG 3.09Å; K272-E276 PolarHBondContact O-N 3.01Å; A273-E276 PolarHBondContact O-N 2.71Å; E276-G280 WeakPolarHBondContact O-CA 3.43Å; E276-G280 PolarHBondContact O-N 3.3Å |
| 277 | F | 77 | Confident | 70.8 | Confident | 112 Ų | 112 | 81.5 Ų | 81.5 | 49% | 0.491 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -67.8 | -46.6 | 175.9 | -179.5 | -98.8 | 0 | 0 | 0 | 111.5 | F190 A273 Q274 Q275 G280 V281 | F190-F277 HydrophobicContact CD2-CB 4.24Å; F190-F277 HydrophobicContact CD2-CD2 4.07Å; F190-F277 AromaticContact CE2-CD2 3.64Å; F190-F277 HydrophobicContact CE2-CD2 3.64Å; F190-F277 HydrophobicContact CE2-CE2 4.24Å; F190-F277 HydrophobicContact CE2-CG 4.43Å; F190-F277 AromaticContact CZ-CD2 3.98Å; F190-F277 HydrophobicContact CZ-CD2 3.98Å; F190-F277 HydrophobicContact CZ-CE2 4.32Å; A273-F277 VanDerWaalsContact O-CB 3.31Å; A273-F277 WeakPolarHBondContact O-CB 3.28Å; A273-F277 PolarHBondContact O-N 3.45Å; Q274-F277 PolarHBondContact O-N 3.48Å; Q275-F277 VanDerWaalsContact C-N 3.32Å; Q275-F277 PolarHBondContact O-N 3.31Å; F277-G280 PolarHBondContact O-N 2.8Å; F277-V281 HydrophobicContact CD1-CG2 4.22Å; F277-V281 HydrophobicContact CD2-CG2 4.41Å; F277-V281 HydrophobicContact CE1-CG2 3.83Å; F277-V281 HydrophobicContact CE2-CG2 4.04Å; F277-V281 HydrophobicContact CZ-CG2 3.73Å; F277-V281 WeakPolarHBondContact O-CB 3.34Å; F277-V281 VanDerWaalsContact O-CG2 3.31Å; F277-V281 WeakPolarHBondContact O-CG2 3.43Å; F277-V281 PolarHBondContact O-N 3.25Å |
| 278 | A | 75.5 | Confident | 71.3 | Confident | 38 Ų | 38 | 83.6 Ų | 83.6 | 31% | 0.314 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62.5 | -45.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q274 Q275 G280 V281 M282 | Q274-A278 VanDerWaalsContact O-CB 3.22Å; Q274-A278 WeakPolarHBondContact O-CB 3.46Å; Q274-A278 PolarHBondContact O-N 2.8Å; Q275-A278 PolarHBondContact O-N 2.86Å; A278-G280 VanDerWaalsContact C-N 3.35Å; A278-V281 PolarHBondContact O-N 2.93Å; A278-M282 HydrophobicContact CB-CE 4.11Å; A278-M282 VanDerWaalsContact O-CB 3.3Å; A278-M282 WeakPolarHBondContact O-CB 3.45Å; A278-M282 WeakPolarHBondContact O-CE 3.44Å; A278-M282 VanDerWaalsContact O-CG 3.3Å; A278-M282 WeakPolarHBondContact O-CG 3.47Å; A278-M282 PolarHBondContact O-N 3.02Å |
| 279 | T | 74.2 | Confident | 72 | Confident | 86 Ų | 86 | 86.8 Ų | 86.8 | 53% | 0.528 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -65 | -39 | 174 | -58.3 | 0 | 0 | 0 | 0 | 111.1 | Q275 M282 S283 | Q275-T279 WeakPolarHBondContact O-CB 3.39Å; Q275-T279 PolarHBondContact O-N 3.29Å; Q275-T279 PolarHBondContact O-OG1 2.77Å; T279-M282 PolarHBondContact O-N 2.81Å; T279-S283 WeakPolarHBondContact O-CB 3.15Å; T279-S283 PolarHBondContact O-N 3.25Å; T279-S283 PolarHBondContact O-OG 3.14Å |
| 280 | G | 69.8 | Low | 72.5 | Confident | 36 Ų | 36 | 87.4 Ų | 87.4 | 37% | 0.371 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60.8 | -46.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | E276 F277 A278 S283 N284 | E276-G280 WeakPolarHBondContact O-CA 3.43Å; E276-G280 PolarHBondContact O-N 3.3Å; F277-G280 PolarHBondContact O-N 2.8Å; A278-G280 VanDerWaalsContact C-N 3.35Å; G280-S283 PolarHBondContact O-N 2.81Å; G280-S283 PolarHBondContact O-OG 3.31Å; G280-N284 PolarHBondContact O-N 3.48Å |
| 281 | V | 69.9 | Low | 73.2 | Confident | 59 Ų | 59 | 83.5 Ų | 83.5 | 36% | 0.358 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -66.8 | -42.5 | 175.6 | 173 | 0 | 0 | 0 | 0 | 111.1 | F277 A278 N284 V287 | F277-V281 HydrophobicContact CD1-CG2 4.22Å; F277-V281 HydrophobicContact CD2-CG2 4.41Å; F277-V281 HydrophobicContact CE1-CG2 3.83Å; F277-V281 HydrophobicContact CE2-CG2 4.04Å; F277-V281 HydrophobicContact CZ-CG2 3.73Å; F277-V281 WeakPolarHBondContact O-CB 3.34Å; F277-V281 VanDerWaalsContact O-CG2 3.31Å; F277-V281 WeakPolarHBondContact O-CG2 3.43Å; F277-V281 PolarHBondContact O-N 3.25Å; A278-V281 PolarHBondContact O-N 2.93Å; V281-N284 WeakPolarHBondContact O-CB 3.18Å; V281-N284 PolarHBondContact O-N 3Å; V281-V287 HydrophobicContact CG1-CG1 4.02Å; V281-V287 HydrophobicContact CG1-CG2 4.45Å; V281-V287 WeakPolarHBondContact O-CB 3.45Å; V281-V287 WeakPolarHBondContact O-CG1 3.4Å |
| 282 | M | 66.8 | Low | 73.6 | Confident | 123 Ų | 123 | 79.4 Ų | 79.4 | 61% | 0.606 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -69.3 | -30.7 | 177.8 | -76.7 | -171.9 | -78.2 | 0 | 0 | 113.4 | A278 T279 N284 Q288 | A278-M282 HydrophobicContact CB-CE 4.11Å; A278-M282 VanDerWaalsContact O-CB 3.3Å; A278-M282 WeakPolarHBondContact O-CB 3.45Å; A278-M282 WeakPolarHBondContact O-CE 3.44Å; A278-M282 VanDerWaalsContact O-CG 3.3Å; A278-M282 WeakPolarHBondContact O-CG 3.47Å; A278-M282 PolarHBondContact O-N 3.02Å; T279-M282 PolarHBondContact O-N 2.81Å; M282-N284 VanDerWaalsContact C-N 3.3Å; M282-Q288 WeakPolarHBondContact O-CG 3.03Å; M282-Q288 PolarHBondContact O-NE2 2.84Å |
| 283 | S | 68.6 | Low | 73.9 | Confident | 75 Ų | 75 | 80.9 Ų | 80.9 | 52% | 0.524 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -79.7 | -12.8 | 179.6 | 68.8 | 0 | 0 | 0 | 0 | 113.3 | T279 G280 K285 | T279-S283 WeakPolarHBondContact O-CB 3.15Å; T279-S283 PolarHBondContact O-N 3.25Å; T279-S283 PolarHBondContact O-OG 3.14Å; G280-S283 PolarHBondContact O-N 2.81Å; G280-S283 PolarHBondContact O-OG 3.31Å; S283-K285 PolarHBondContact O-N 3Å |
| 284 | N | 68.9 | Low | 74.5 | Confident | 77 Ų | 77 | 83.4 Ų | 83.4 | 41% | 0.412 | 48% | 0.483 | S | S | . | . | trans | -71.8 | 114.9 | -179 | -172.6 | -33 | 0 | 0 | 0 | 110.6 | G280 V281 M282 T286 V287 Q288 | G280-N284 PolarHBondContact O-N 3.48Å; V281-N284 WeakPolarHBondContact O-CB 3.18Å; V281-N284 PolarHBondContact O-N 3Å; M282-N284 VanDerWaalsContact C-N 3.3Å; N284-T286 PolarHBondContact O-N 3.36Å; N284-T286 VanDerWaalsContact O-N 3.13Å; N284-T286 WeakPolarHBondContact OD1-CB 3.05Å; N284-T286 PolarHBondContact OD1-N 2.88Å; N284-V287 HydrophobicContact CB-CB 4.1Å; N284-V287 HydrophobicContact CB-CG2 3.89Å; N284-V287 CarbonylContact O-C 3.59Å; N284-V287 WeakPolarHBondContact O-CA 3.17Å; N284-V287 PolarHBondContact O-N 3.45Å; N284-Q288 WeakPolarHBondContact O-CG 3.43Å; N284-Q288 PolarHBondContact O-N 2.98Å | ||
| 285 | K | 67.8 | Low | 75.1 | Confident | 169 Ų | 169 | 80.3 Ų | 80.3 | 74% | 0.735 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -50.8 | -37.8 | 178.5 | -80.1 | -174.7 | 177.1 | 178.4 | 0 | 113 | S283 Q288 T289 | S283-K285 PolarHBondContact O-N 3Å; K285-Q288 PolarHBondContact O-N 3.4Å; K285-T289 WeakPolarHBondContact O-CB 3.19Å; K285-T289 PolarHBondContact O-N 2.84Å; K285-T289 PolarHBondContact O-OG1 3.47Å |
| 286 | T | 75.8 | Confident | 75.2 | Confident | 107 Ų | 107 | 76.8 Ų | 76.8 | 66% | 0.656 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -67 | -39.8 | 178 | -53.6 | 0 | 0 | 0 | 0 | 111.9 | N284 A290 | N284-T286 PolarHBondContact O-N 3.36Å; N284-T286 VanDerWaalsContact O-N 3.13Å; N284-T286 WeakPolarHBondContact OD1-CB 3.05Å; N284-T286 PolarHBondContact OD1-N 2.88Å; T286-A290 VanDerWaalsContact O-CB 3.26Å; T286-A290 WeakPolarHBondContact O-CB 3.08Å; T286-A290 PolarHBondContact O-N 3.47Å |
| 287 | V | 74.9 | Confident | 75.4 | Confident | 57 Ų | 57 | 78.9 Ų | 78.9 | 35% | 0.345 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -71.7 | -39.7 | 176.3 | 179.2 | 0 | 0 | 0 | 0 | 110.5 | V281 N284 A290 A291 | V281-V287 HydrophobicContact CG1-CG1 4.02Å; V281-V287 HydrophobicContact CG1-CG2 4.45Å; V281-V287 WeakPolarHBondContact O-CB 3.45Å; V281-V287 WeakPolarHBondContact O-CG1 3.4Å; N284-V287 HydrophobicContact CB-CB 4.1Å; N284-V287 HydrophobicContact CB-CG2 3.89Å; N284-V287 CarbonylContact O-C 3.59Å; N284-V287 WeakPolarHBondContact O-CA 3.17Å; N284-V287 PolarHBondContact O-N 3.45Å; V287-A290 PolarHBondContact O-N 3.39Å; V287-A291 WeakPolarHBondContact O-CB 3.18Å; V287-A291 PolarHBondContact O-N 3.28Å |
| 288 | Q | 76.3 | Confident | 75.7 | Confident | 100 Ų | 100 | 76.2 Ų | 76.2 | 47% | 0.467 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.1 | -45.2 | 173.1 | -69.7 | -179.3 | 1.3 | 0 | 0 | 111.5 | M282 N284 K285 A291 A292 | M282-Q288 WeakPolarHBondContact O-CG 3.03Å; M282-Q288 PolarHBondContact O-NE2 2.84Å; N284-Q288 WeakPolarHBondContact O-CG 3.43Å; N284-Q288 PolarHBondContact O-N 2.98Å; K285-Q288 PolarHBondContact O-N 3.4Å; Q288-A291 PolarHBondContact O-N 2.87Å; Q288-A292 WeakPolarHBondContact O-CB 3.47Å; Q288-A292 PolarHBondContact O-N 3.44Å |
| 289 | T | 77.6 | Confident | 76 | Confident | 79 Ų | 79 | 77.2 Ų | 77.2 | 49% | 0.485 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.9 | -41.9 | 176.8 | -58.4 | 0 | 0 | 0 | 0 | 111.3 | K285 A292 N293 | K285-T289 WeakPolarHBondContact O-CB 3.19Å; K285-T289 PolarHBondContact O-N 2.84Å; K285-T289 PolarHBondContact O-OG1 3.47Å; T289-A292 PolarHBondContact O-N 3.35Å; T289-N293 VanDerWaalsContact O-CB 3.29Å; T289-N293 WeakPolarHBondContact O-CB 3.46Å; T289-N293 PolarHBondContact O-N 3.2Å; T289-N293 PolarHBondContact O-ND2 3.16Å |
| 290 | A | 76.9 | Confident | 76.2 | Confident | 57 Ų | 57 | 76.5 Ų | 76.5 | 47% | 0.471 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.9 | -43.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | T286 V287 N293 A294 | T286-A290 VanDerWaalsContact O-CB 3.26Å; T286-A290 WeakPolarHBondContact O-CB 3.08Å; T286-A290 PolarHBondContact O-N 3.47Å; V287-A290 PolarHBondContact O-N 3.39Å; A290-N293 PolarHBondContact O-N 3.42Å; A290-A294 WeakPolarHBondContact O-CB 3.33Å; A290-A294 PolarHBondContact O-N 3.49Å |
| 291 | A | 78.9 | Confident | 76.6 | Confident | 58 Ų | 58 | 77.2 Ų | 77.2 | 48% | 0.479 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.6 | -41.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | V287 Q288 A294 A295 | V287-A291 WeakPolarHBondContact O-CB 3.18Å; V287-A291 PolarHBondContact O-N 3.28Å; Q288-A291 PolarHBondContact O-N 2.87Å; A291-A294 PolarHBondContact O-N 2.91Å; A291-A295 VanDerWaalsContact O-CB 3.29Å; A291-A295 WeakPolarHBondContact O-CB 3.33Å; A291-A295 PolarHBondContact O-N 3.32Å |
| 292 | A | 78.3 | Confident | 77 | Confident | 56 Ų | 56 | 77.1 Ų | 77.1 | 46% | 0.463 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.5 | -40 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q288 T289 S296 | Q288-A292 WeakPolarHBondContact O-CB 3.47Å; Q288-A292 PolarHBondContact O-N 3.44Å; T289-A292 PolarHBondContact O-N 3.35Å; A292-S296 WeakPolarHBondContact O-CB 3.43Å; A292-S296 PolarHBondContact O-N 3.37Å; A292-S296 PolarHBondContact O-OG 2.63Å |
| 293 | N | 80.3 | Confident | 77.6 | Confident | 94 Ų | 94 | 73.4 Ų | 73.4 | 50% | 0.503 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -69.2 | -37.5 | 176.2 | -72 | -18.7 | 0 | 0 | 0 | 112.4 | T289 A290 S296 T297 | T289-N293 VanDerWaalsContact O-CB 3.29Å; T289-N293 WeakPolarHBondContact O-CB 3.46Å; T289-N293 PolarHBondContact O-N 3.2Å; T289-N293 PolarHBondContact O-ND2 3.16Å; A290-N293 PolarHBondContact O-N 3.42Å; N293-S296 WeakPolarHBondContact CA-OG 3.24Å; N293-S296 PolarHBondContact O-OG 2.98Å; N293-T297 WeakPolarHBondContact O-CB 3.39Å; N293-T297 PolarHBondContact O-N 3.33Å; N293-T297 VanDerWaalsContact O-N 3.13Å; N293-T297 PolarHBondContact O-OG1 3.04Å |
| 294 | A | 81.4 | Confident | 78 | Confident | 61 Ų | 61 | 76.2 Ų | 76.2 | 50% | 0.504 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -68.2 | -42.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | A290 A291 T297 A298 | A290-A294 WeakPolarHBondContact O-CB 3.33Å; A290-A294 PolarHBondContact O-N 3.49Å; A291-A294 PolarHBondContact O-N 2.91Å; A294-T297 PolarHBondContact O-N 3.41Å; A294-A298 WeakPolarHBondContact O-CB 3.37Å; A294-A298 PolarHBondContact O-N 3.46Å |
| 295 | A | 82.8 | Confident | 78.2 | Confident | 60 Ų | 60 | 78 Ų | 78 | 50% | 0.496 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.3 | -41.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A291 A298 A299 | A291-A295 VanDerWaalsContact O-CB 3.29Å; A291-A295 WeakPolarHBondContact O-CB 3.33Å; A291-A295 PolarHBondContact O-N 3.32Å; A295-A298 PolarHBondContact O-N 3.33Å; A295-A299 WeakPolarHBondContact O-CB 3.39Å; A295-A299 PolarHBondContact O-N 3.17Å |
| 296 | S | 79.8 | Confident | 78.3 | Confident | 59 Ų | 59 | 73.1 Ų | 73.1 | 41% | 0.413 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.4 | -41.3 | 175.7 | 65.2 | 0 | 0 | 0 | 0 | 111.5 | A292 N293 A299 S300 | A292-S296 WeakPolarHBondContact O-CB 3.43Å; A292-S296 PolarHBondContact O-N 3.37Å; A292-S296 PolarHBondContact O-OG 2.63Å; N293-S296 WeakPolarHBondContact CA-OG 3.24Å; N293-S296 PolarHBondContact O-OG 2.98Å; S296-A299 PolarHBondContact O-N 3.24Å; S296-S300 WeakPolarHBondContact O-CB 3.37Å; S296-S300 PolarHBondContact O-N 3.15Å; S296-S300 PolarHBondContact O-OG 2.93Å |
| 297 | T | 81.4 | Confident | 77.8 | Confident | 93 Ų | 93 | 76.1 Ų | 76.1 | 57% | 0.571 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -64.4 | -41.5 | 176.3 | -55.5 | 0 | 0 | 0 | 0 | 111.8 | N293 A294 S301 | N293-T297 WeakPolarHBondContact O-CB 3.39Å; N293-T297 PolarHBondContact O-N 3.33Å; N293-T297 VanDerWaalsContact O-N 3.13Å; N293-T297 PolarHBondContact O-OG1 3.04Å; A294-T297 PolarHBondContact O-N 3.41Å; T297-S301 WeakPolarHBondContact O-CB 3.38Å; T297-S301 PolarHBondContact O-N 3.41Å; T297-S301 PolarHBondContact O-OG 3.31Å |
| 298 | A | 83.6 | Confident | 77.1 | Confident | 56 Ų | 56 | 81.2 Ų | 81.2 | 46% | 0.463 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.3 | -40.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A294 A295 S301 A302 | A294-A298 WeakPolarHBondContact O-CB 3.37Å; A294-A298 PolarHBondContact O-N 3.46Å; A295-A298 PolarHBondContact O-N 3.33Å; A298-S301 VanDerWaalsContact CA-OG 3.31Å; A298-S301 WeakPolarHBondContact CA-OG 3.49Å; A298-S301 PolarHBondContact O-N 3.37Å; A298-S301 PolarHBondContact O-OG 3.33Å; A298-A302 VanDerWaalsContact O-CB 3.29Å; A298-A302 WeakPolarHBondContact O-CB 3.42Å; A298-A302 PolarHBondContact O-N 3.37Å |
| 299 | A | 81.6 | Confident | 76.2 | Confident | 60 Ų | 60 | 78.9 Ų | 78.9 | 50% | 0.496 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.8 | -42.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | A295 S296 A302 A303 | A295-A299 WeakPolarHBondContact O-CB 3.39Å; A295-A299 PolarHBondContact O-N 3.17Å; S296-A299 PolarHBondContact O-N 3.24Å; A299-A302 PolarHBondContact O-N 2.91Å; A299-A303 VanDerWaalsContact O-CB 3.3Å; A299-A303 WeakPolarHBondContact O-CB 3.09Å; A299-A303 PolarHBondContact O-N 3.22Å |
| 300 | S | 79.3 | Confident | 75 | Confident | 71 Ų | 71 | 82.2 Ų | 82.2 | 50% | 0.497 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.4 | -40 | 176.2 | -62.4 | 0 | 0 | 0 | 0 | 112.3 | S296 Q304 | S296-S300 WeakPolarHBondContact O-CB 3.37Å; S296-S300 PolarHBondContact O-N 3.15Å; S296-S300 PolarHBondContact O-OG 2.93Å; S300-Q304 WeakPolarHBondContact O-CB 3.47Å; S300-Q304 VanDerWaalsContact O-CG 3.26Å; S300-Q304 WeakPolarHBondContact O-CG 3.3Å; S300-Q304 PolarHBondContact O-N 3.1Å |
| 301 | S | 77.3 | Confident | 73.8 | Confident | 50 Ų | 50 | 87.9 Ų | 87.9 | 35% | 0.35 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -70.9 | -38.8 | 176.5 | 47.5 | 0 | 0 | 0 | 0 | 112.6 | T297 A298 Q304 N305 | T297-S301 WeakPolarHBondContact O-CB 3.38Å; T297-S301 PolarHBondContact O-N 3.41Å; T297-S301 PolarHBondContact O-OG 3.31Å; A298-S301 VanDerWaalsContact CA-OG 3.31Å; A298-S301 WeakPolarHBondContact CA-OG 3.49Å; A298-S301 PolarHBondContact O-N 3.37Å; A298-S301 PolarHBondContact O-OG 3.33Å; S301-Q304 PolarHBondContact O-N 3.12Å; S301-N305 WeakPolarHBondContact O-CB 3.33Å; S301-N305 VanDerWaalsContact O-CG 3.31Å; S301-N305 PolarHBondContact O-N 3.18Å; S301-N305 PolarHBondContact O-ND2 3.16Å |
| 302 | A | 79.8 | Confident | 72.2 | Confident | 58 Ų | 58 | 95.6 Ų | 95.6 | 48% | 0.479 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -64.2 | -42.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A298 A299 N305 A306 | A298-A302 VanDerWaalsContact O-CB 3.29Å; A298-A302 WeakPolarHBondContact O-CB 3.42Å; A298-A302 PolarHBondContact O-N 3.37Å; A299-A302 PolarHBondContact O-N 2.91Å; A302-N305 PolarHBondContact O-N 2.98Å; A302-A306 WeakPolarHBondContact O-CB 3.24Å; A302-A306 PolarHBondContact O-N 3.41Å |
| 303 | A | 79.5 | Confident | 71.9 | Confident | 45 Ų | 45 | 97.6 Ų | 97.6 | 37% | 0.372 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -63 | -46.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | A299 N305 A306 F307 | A299-A303 VanDerWaalsContact O-CB 3.3Å; A299-A303 WeakPolarHBondContact O-CB 3.09Å; A299-A303 PolarHBondContact O-N 3.22Å; A303-N305 VanDerWaalsContact C-N 3.26Å; A303-N305 PolarHBondContact O-N 2.97Å; A303-A306 PolarHBondContact O-N 3.01Å; A303-F307 VanDerWaalsContact O-CD2 3.23Å; A303-F307 WeakPolarHBondContact O-CD2 3.24Å; A303-F307 PolarHBondContact O-N 2.96Å |
| 304 | Q | 76.6 | Confident | 71.5 | Confident | 133 Ų | 133 | 97.8 Ų | 97.8 | 62% | 0.621 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -58.6 | -37.2 | 175.7 | -78.6 | 174.7 | -15.3 | 0 | 0 | 112.7 | S300 S301 K308 | S300-Q304 WeakPolarHBondContact O-CB 3.47Å; S300-Q304 VanDerWaalsContact O-CG 3.26Å; S300-Q304 WeakPolarHBondContact O-CG 3.3Å; S300-Q304 PolarHBondContact O-N 3.1Å; S301-Q304 PolarHBondContact O-N 3.12Å; Q304-K308 PolarHBondContact O-N 3.32Å |
| 305 | N | 72.3 | Confident | 70.9 | Confident | 114 Ų | 114 | 99.8 Ų | 99.8 | 61% | 0.61 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -72.2 | -38.7 | 176 | -73.8 | -23.3 | 0 | 0 | 0 | 112.6 | S301 A302 A303 K308 G309 | S301-N305 WeakPolarHBondContact O-CB 3.33Å; S301-N305 VanDerWaalsContact O-CG 3.31Å; S301-N305 PolarHBondContact O-N 3.18Å; S301-N305 PolarHBondContact O-ND2 3.16Å; A302-N305 PolarHBondContact O-N 2.98Å; A303-N305 VanDerWaalsContact C-N 3.26Å; A303-N305 PolarHBondContact O-N 2.97Å; N305-K308 PolarHBondContact O-N 3.16Å; N305-G309 PolarHBondContact O-N 3.21Å; N305-G309 VanDerWaalsContact O-N 3.12Å |
| 306 | A | 70.3 | Confident | 70.2 | Confident | 68 Ų | 68 | 102.2 Ų | 102.2 | 56% | 0.562 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -65.4 | -39.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A302 A303 K308 G309 | A302-A306 WeakPolarHBondContact O-CB 3.24Å; A302-A306 PolarHBondContact O-N 3.41Å; A303-A306 PolarHBondContact O-N 3.01Å; A306-K308 VanDerWaalsContact C-N 3.35Å; A306-G309 PolarHBondContact O-N 3.44Å |
| 307 | F | 65.4 | Low | 69.6 | Low | 170 Ų | 170 | 104.9 Ų | 104.9 | 75% | 0.746 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -69.5 | -29.5 | 175.9 | -85.1 | -76.1 | 0 | 0 | 0 | 113.2 | A303 | A303-F307 VanDerWaalsContact O-CD2 3.23Å; A303-F307 WeakPolarHBondContact O-CD2 3.24Å; A303-F307 PolarHBondContact O-N 2.96Å |
| 308 | K | 60.2 | Low | 68.8 | Low | 163 Ų | 163 | 105.7 Ų | 105.7 | 71% | 0.709 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -74.8 | -27.7 | 172.5 | -82.9 | -176.9 | 174.2 | -179.3 | 0 | 113.6 | Q304 N305 A306 N310 | Q304-K308 PolarHBondContact O-N 3.32Å; N305-K308 PolarHBondContact O-N 3.16Å; A306-K308 VanDerWaalsContact C-N 3.35Å; K308-N310 VanDerWaalsContact C-N 3.26Å; K308-N310 PolarHBondContact O-N 2.92Å |
| 309 | G | 56.4 | Low | 67.8 | Low | 52 Ų | 52 | 109.2 Ų | 109.2 | 54% | 0.536 | 62% | 0.623 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.6 | -13.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115 | N305 A306 | N305-G309 PolarHBondContact O-N 3.21Å; N305-G309 VanDerWaalsContact O-N 3.12Å; A306-G309 PolarHBondContact O-N 3.44Å |
| 310 | N | 52.2 | Low | 66.7 | Low | 149 Ų | 149 | 113 Ų | 113 | 80% | 0.797 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.6 | 15.3 | -174.4 | -139.4 | 71 | 0 | 0 | 0 | 113.6 | K308 | K308-N310 VanDerWaalsContact C-N 3.26Å; K308-N310 PolarHBondContact O-N 2.92Å |
| 311 | Q | 52.4 | Low | 65.7 | Low | 176 Ų | 176 | 116.5 Ų | 116.5 | 82% | 0.822 | 64% | 0.644 | S | S | * | * | trans | -111.8 | 23.6 | 177.3 | -76.8 | -160.6 | -25.7 | 0 | 0 | 113.8 | ||||
| 312 | I | 45.5 | Very low | 64.6 | Low | 220 Ų | 220 | 122.5 Ų | 122.5 | 100% | 1.128 | 67% | 0.671 | S | S | * | * | trans | -107.7 | 0 | 173.5 | -41.3 | 179.6 | 0 | 0 | 0 | 109.4 |
Retrieved 312 of 312 residues in 73.4 ms
(Link to these results)