| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 32.6 | Very low | 35.2 | Very low | 233 Ų | 233 | 171.5 Ų | 171.5 | 100% | 1.148 | 83% | 0.829 | S | S | * | * | 0 | 124.9 | 0 | -156.8 | 161.8 | -172.8 | 0 | 0 | 107.3 | |||||
| 2 | R | 38.9 | Very low | 35.6 | Very low | 218 Ų | 218 | 172.3 Ų | 172.3 | 82% | 0.823 | 83% | 0.83 | S | S | * | * | trans | 47.5 | 112.1 | 167.1 | -75.3 | -179.5 | 177 | 161 | -1.3 | 119.5 | ||||
| 3 | L | 38.1 | Very low | 36.6 | Very low | 186 Ų | 186 | 167.7 Ų | 167.7 | 97% | 0.974 | 82% | 0.823 | S | S | * | * | trans | -115.8 | 120.1 | 138.8 | -77.1 | 167.2 | 0 | 0 | 0 | 106.9 | ||||
| 4 | T | 38.1 | Very low | 37.2 | Very low | 118 Ų | 118 | 168.5 Ų | 168.5 | 72% | 0.724 | 82% | 0.82 | S | S | * | * | trans | -119.1 | 127.4 | 167.5 | -44.6 | 0 | 0 | 0 | 0 | 105 | ||||
| 5 | E | 36.1 | Very low | 37.4 | Very low | 161 Ų | 161 | 165.3 Ų | 165.3 | 75% | 0.752 | 82% | 0.817 | S | S | * | * | trans | -177.4 | 129.6 | 141.6 | -105.5 | -175.8 | 165.4 | 0 | 0 | 111.3 | ||||
| 6 | K | 34.1 | Very low | 37.1 | Very low | 184 Ų | 184 | 163.2 Ų | 163.2 | 80% | 0.8 | 81% | 0.81 | S | S | * | * | trans | 49 | 143.4 | 134.5 | -74.6 | 174.7 | 170.5 | 172.6 | 0 | 118.9 | ||||
| 7 | S | 33.3 | Very low | 37 | Very low | 97 Ų | 97 | 163.4 Ų | 163.4 | 68% | 0.678 | 82% | 0.815 | S | S | * | * | cis | 179.2 | 138.1 | 40.1 | -158.3 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 8 | E | 33.5 | Very low | 37.4 | Very low | 180 Ų | 180 | 160 Ų | 160 | 84% | 0.841 | 81% | 0.809 | S | S | * | * | 155.4 | 117.1 | 99.1 | -101.1 | 157.7 | -171 | 0 | 0 | 102.7 | |||||
| 9 | E | 35.3 | Very low | 37.2 | Very low | 175 Ų | 175 | 160.2 Ų | 160.2 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | 66.5 | 96.9 | 55 | -146.3 | 177.5 | -150.2 | 0 | 0 | 115.5 | |||||
| 10 | E | 33.3 | Very low | 37.4 | Very low | 181 Ų | 181 | 161.5 Ų | 161.5 | 85% | 0.846 | 82% | 0.816 | S | S | * | * | trans | -159.1 | 95.6 | 147.8 | -111.7 | -177.9 | 141.6 | 0 | 0 | 108.1 | ||||
| 11 | Q | 34.1 | Very low | 38.1 | Very low | 154 Ų | 154 | 158.7 Ų | 158.7 | 72% | 0.72 | 81% | 0.808 | S | S | * | * | 63.8 | 92.2 | 99.6 | -69.3 | -175.8 | 5.4 | 0 | 0 | 114.6 | |||||
| 12 | Q | 40.2 | Very low | 37.9 | Very low | 180 Ų | 180 | 153.9 Ų | 153.9 | 84% | 0.841 | 79% | 0.788 | S | S | * | * | 90.5 | 162.6 | 97.1 | -99.6 | -168.3 | -0.4 | 0 | 0 | 114.3 | |||||
| 13 | P | 48.2 | Very low | 37.7 | Very low | 113 Ų | 113 | 151.2 Ų | 151.2 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | cis | -132.7 | 167.8 | -12.8 | 31.9 | -11 | 0 | 0 | 0 | 115.1 | ||||
| 14 | K | 45 | Very low | 37.4 | Very low | 179 Ų | 179 | 148.9 Ų | 148.9 | 78% | 0.778 | 77% | 0.773 | S | S | * | * | trans | -98.2 | 145.7 | 167.5 | -164.5 | -175.3 | -168 | -173 | 0 | 108.2 | ||||
| 15 | P | 40.5 | Very low | 37.4 | Very low | 121 Ų | 121 | 151.4 Ų | 151.4 | 79% | 0.786 | 78% | 0.777 | S | S | * | * | trans | -105 | 119.8 | 156.5 | 30.5 | -20.3 | 0 | 0 | 0 | 110.2 | ||||
| 16 | N | 32.8 | Very low | 37.4 | Very low | 131 Ų | 131 | 152 Ų | 152 | 70% | 0.701 | 78% | 0.779 | S | S | * | * | trans | -71.9 | 146.5 | 156 | -87.7 | -12.7 | 0 | 0 | 0 | 108.6 | ||||
| 17 | N | 34.1 | Very low | 37.4 | Very low | 167 Ų | 167 | 150.9 Ų | 150.9 | 89% | 0.893 | 78% | 0.777 | S | S | * | * | trans | -136.4 | 117 | 141.9 | -85.1 | -29.4 | 0 | 0 | 0 | 107.7 | ||||
| 18 | S | 44.3 | Very low | 37.3 | Very low | 102 Ų | 102 | 154.6 Ų | 154.6 | 71% | 0.713 | 78% | 0.784 | S | S | * | * | trans | -72.6 | 150.6 | 170.4 | 50.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 19 | N | 34.6 | Very low | 37.8 | Very low | 163 Ų | 163 | 153.5 Ų | 153.5 | 87% | 0.872 | 78% | 0.782 | S | S | * | * | trans | -167 | 116 | 131.3 | -87.4 | -19.2 | 0 | 0 | 0 | 108.4 | ||||
| 20 | E | 40.3 | Very low | 37.6 | Very low | 187 Ų | 187 | 152.8 Ų | 152.8 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | trans | -107.2 | 176.4 | 159.7 | -112.4 | 178.7 | -171.2 | 0 | 0 | 106.8 | ||||
| 21 | P | 52 | Low | 37.6 | Very low | 102 Ų | 102 | 152.2 Ų | 152.2 | 66% | 0.662 | 78% | 0.776 | S | S | * | * | cis | -139.1 | 173.1 | 6 | 30.3 | -6.7 | 0 | 0 | 0 | 115 | ||||
| 22 | N | 29.6 | Very low | 37.5 | Very low | 133 Ų | 133 | 149.5 Ų | 149.5 | 71% | 0.711 | 77% | 0.774 | S | S | * | * | 162.7 | 120.1 | 118.4 | -97.3 | 4.8 | 0 | 0 | 0 | 113.9 | |||||
| 23 | E | 33.2 | Very low | 37.2 | Very low | 161 Ų | 161 | 148.9 Ų | 148.9 | 75% | 0.752 | 77% | 0.771 | S | S | * | * | trans | 44.8 | 139 | 130.4 | -63.2 | -173.3 | 167.9 | 0 | 0 | 124 | ||||
| 24 | D | 32.8 | Very low | 36.9 | Very low | 138 Ų | 138 | 152 Ų | 152 | 74% | 0.738 | 78% | 0.776 | S | S | * | * | trans | 90.9 | 98.2 | 150.5 | -59.6 | -17.6 | 0 | 0 | 0 | 121.6 | ||||
| 25 | Q | 38.7 | Very low | 36.5 | Very low | 171 Ų | 171 | 152.1 Ų | 152.1 | 80% | 0.799 | 78% | 0.778 | S | S | * | * | 31.7 | 155.9 | 121.5 | -70 | -172.4 | -16 | 0 | 0 | 122.6 | |||||
| 26 | E | 34.8 | Very low | 36.8 | Very low | 172 Ų | 172 | 152.5 Ų | 152.5 | 80% | 0.804 | 78% | 0.779 | S | S | * | * | trans | 76.7 | 147.1 | 164.3 | -72.8 | 172.8 | 174.4 | 0 | 0 | 116.1 | ||||
| 27 | E | 34.4 | Very low | 37.2 | Very low | 162 Ų | 162 | 151.5 Ų | 151.5 | 76% | 0.757 | 78% | 0.78 | S | S | * | * | cis | -169.5 | 175.8 | -27.8 | -140.9 | 176.6 | -165.3 | 0 | 0 | 102.9 | ||||
| 28 | E | 31.3 | Very low | 37.4 | Very low | 175 Ų | 175 | 147.8 Ų | 147.8 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | trans | 70.3 | 107.6 | 157.4 | -72.8 | -169.1 | 142.7 | 0 | 0 | 122 | ||||
| 29 | I | 45.2 | Very low | 37.3 | Very low | 157 Ų | 157 | 154.9 Ų | 154.9 | 81% | 0.805 | 78% | 0.783 | S | S | * | * | trans | -51 | 126.7 | 147.1 | -56 | 156 | 0 | 0 | 0 | 110.7 | ||||
| 30 | Q | 31.1 | Very low | 37.4 | Very low | 159 Ų | 159 | 155.7 Ų | 155.7 | 74% | 0.743 | 78% | 0.782 | S | S | * | * | 178.8 | 135.5 | 125.6 | -100.3 | 171.6 | 63 | 0 | 0 | 114.5 | |||||
| 31 | Q | 33.5 | Very low | 37.7 | Very low | 170 Ų | 170 | 158.6 Ų | 158.6 | 79% | 0.794 | 79% | 0.785 | S | S | * | * | trans | 40.5 | 125.7 | 142.5 | -66.7 | 178.2 | -27.3 | 0 | 0 | 119.9 | ||||
| 32 | S | 31.2 | Very low | 37.2 | Very low | 96 Ų | 96 | 159.6 Ų | 159.6 | 67% | 0.671 | 79% | 0.789 | S | S | * | * | 167 | 140.5 | 90.4 | -156.7 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 33 | E | 33.2 | Very low | 38 | Very low | 167 Ų | 167 | 162.7 Ų | 162.7 | 78% | 0.78 | 80% | 0.8 | S | S | * | * | trans | 31.5 | 114.8 | 147.4 | -68.6 | 174.5 | 145 | 0 | 0 | 121.7 | ||||
| 34 | Q | 43.2 | Very low | 38.5 | Very low | 179 Ų | 179 | 166.3 Ų | 166.3 | 84% | 0.836 | 81% | 0.806 | S | S | * | * | 42.4 | 93.5 | 120.7 | -165.8 | 168.3 | -12.5 | 0 | 0 | 117.5 | |||||
| 35 | H | 35.4 | Very low | 39.2 | Very low | 181 Ų | 181 | 163.5 Ų | 163.5 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | trans | -143.8 | 110.7 | 145.9 | -131.2 | -32 | 0 | 0 | 0 | 109.7 | P37 | H35-P37 VanDerWaalsContact O-CD 3.27Å; H35-P37 WeakPolarHBondContact O-CD 3.27Å | ||
| 36 | T | 46.7 | Very low | 39.8 | Very low | 129 Ų | 129 | 163.5 Ų | 163.5 | 79% | 0.791 | 81% | 0.808 | S | S | * | * | trans | -69.1 | 128.4 | 170.2 | -38.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 37 | P | 41.5 | Very low | 40.6 | Very low | 111 Ų | 111 | 161.1 Ų | 161.1 | 72% | 0.721 | 81% | 0.805 | S | S | * | * | trans | -112.3 | 130.2 | 162.8 | 13.6 | 8.8 | 0 | 0 | 0 | 111.4 | H35 | H35-P37 VanDerWaalsContact O-CD 3.27Å; H35-P37 WeakPolarHBondContact O-CD 3.27Å | ||
| 38 | A | 38.3 | Very low | 41.7 | Very low | 89 Ų | 89 | 162.2 Ų | 162.2 | 74% | 0.736 | 81% | 0.81 | S | S | * | * | trans | 53.7 | 98.6 | 139.1 | 0 | 0 | 0 | 0 | 0 | 118.3 | Q40 | A38-Q40 PolarHBondContact O-N 3.44Š| ||
| 39 | R | 41.5 | Very low | 42.6 | Very low | 250 Ų | 250 | 159.4 Ų | 159.4 | 94% | 0.943 | 81% | 0.807 | S | S | * | * | trans | -43.3 | 93.1 | 157.8 | -163.7 | -178.7 | -164.2 | 178.2 | 5.2 | 112.2 | R41 | R39-R41 PolarHBondContact O-N 3.32Š| ||
| 40 | Q | 37.8 | Very low | 43.3 | Very low | 181 Ų | 181 | 156.8 Ų | 156.8 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | trans | -75.5 | 116.1 | 162.9 | -92.1 | -176.9 | -14.6 | 0 | 0 | 109.3 | A38 T42 | A38-Q40 PolarHBondContact O-N 3.44Å; Q40-T42 PolarHBondContact O-N 2.91Å | ||
| 41 | R | 45.6 | Very low | 44.4 | Very low | 247 Ų | 247 | 160.7 Ų | 160.7 | 93% | 0.932 | 81% | 0.811 | S | S | * | * | trans | -87.7 | 88.5 | 178.9 | -159.3 | 179.1 | -166.7 | 169 | 1.6 | 108 | R39 | R39-R41 PolarHBondContact O-N 3.32Š| ||
| 42 | T | 41.7 | Very low | 45.4 | Very low | 124 Ų | 124 | 158 Ų | 158 | 76% | 0.761 | 81% | 0.809 | S | S | * | * | trans | -73.2 | 125.7 | 169.3 | 27.2 | 0 | 0 | 0 | 0 | 109.6 | Q40 R44 | Q40-T42 PolarHBondContact O-N 2.91Å; T42-R44 PolarHBondContact O-N 3.14Å; T42-R44 VanDerWaalsContact O-N 3.14Å | ||
| 43 | Q | 46.4 | Very low | 46.9 | Very low | 198 Ų | 198 | 164.8 Ų | 164.8 | 93% | 0.925 | 82% | 0.82 | S | S | * | * | trans | -54.5 | 115.4 | 168.3 | -92.5 | 171.9 | -26.6 | 0 | 0 | 108.5 | A45 | Q43-A45 PolarHBondContact O-N 3.34Š| ||
| 44 | R | 45 | Very low | 48.3 | Very low | 236 Ų | 236 | 164.4 Ų | 164.4 | 89% | 0.891 | 82% | 0.823 | S | S | * | * | trans | -72.3 | 116.5 | 168 | -89.3 | -177.5 | 173.2 | 152.8 | -1.3 | 107.6 | T42 | T42-R44 PolarHBondContact O-N 3.14Å; T42-R44 VanDerWaalsContact O-N 3.14Å | ||
| 45 | A | 46.7 | Very low | 48.6 | Very low | 79 Ų | 79 | 161.5 Ų | 161.5 | 65% | 0.653 | 82% | 0.819 | S | S | * | * | trans | -61.2 | 134 | 155.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | Q43 T47 | Q43-A45 PolarHBondContact O-N 3.34Å; A45-T47 PolarHBondContact O-N 3.12Å; A45-T47 PolarHBondContact O-OG1 2.72Å; A45-T47 VanDerWaalsContact O-OG1 3.12Å | ||
| 46 | D | 50.6 | Low | 49.5 | Very low | 172 Ų | 172 | 158 Ų | 158 | 92% | 0.92 | 82% | 0.815 | S | S | * | * | trans | -62 | 81.4 | 177.2 | -71.1 | -50.9 | 0 | 0 | 0 | 110.6 | ||||
| 47 | T | 51.7 | Low | 50 | Low | 122 Ų | 122 | 163.4 Ų | 163.4 | 75% | 0.748 | 82% | 0.821 | S | S | * | * | trans | -101.9 | 112.2 | 166.8 | 24.6 | 0 | 0 | 0 | 0 | 106.7 | A45 | A45-T47 PolarHBondContact O-N 3.12Å; A45-T47 PolarHBondContact O-OG1 2.72Å; A45-T47 VanDerWaalsContact O-OG1 3.12Å | ||
| 48 | Q | 57.9 | Low | 50.5 | Low | 185 Ų | 185 | 168.8 Ų | 168.8 | 86% | 0.864 | 83% | 0.827 | S | S | * | * | trans | -52.9 | 126.3 | 174.2 | -170.5 | 172.3 | 5.6 | 0 | 0 | 108.6 | S50 | Q48-S50 PolarHBondContact O-N 3.01Š| ||
| 49 | P | 50.8 | Low | 51.2 | Low | 115 Ų | 115 | 170.1 Ų | 170.1 | 75% | 0.747 | 83% | 0.826 | S | S | * | * | trans | -66.8 | 113.7 | -177.2 | 24.9 | -30.8 | 0 | 0 | 0 | 108 | R51 | P49-R51 PolarHBondContact O-N 3.12Å; P49-R51 VanDerWaalsContact O-N 3.12Å | ||
| 50 | S | 60 | Low | 51.4 | Low | 102 Ų | 102 | 163.3 Ų | 163.3 | 71% | 0.713 | 81% | 0.814 | S | S | * | * | trans | -58.7 | 119.9 | 167 | 53.6 | 0 | 0 | 0 | 0 | 106.8 | Q48 C52 | Q48-S50 PolarHBondContact O-N 3.01Å; S50-C52 PolarHBondContact O-N 2.77Å | ||
| 51 | R | 53.5 | Low | 52 | Low | 241 Ų | 241 | 159.3 Ų | 159.3 | 91% | 0.909 | 81% | 0.812 | S | S | * | * | trans | -66.8 | 86.6 | 173.7 | -81.3 | -176 | 177.1 | -173.4 | -0.6 | 107.8 | P49 R53 | P49-R51 PolarHBondContact O-N 3.12Å; P49-R51 VanDerWaalsContact O-N 3.12Å; R51-R53 VanDerWaalsContact C-N 3.29Å; R51-R53 PolarHBondContact O-N 3.1Å | ||
| 52 | C | 55.8 | Low | 52 | Low | 114 Ų | 114 | 153.5 Ų | 153.5 | 77% | 0.77 | 80% | 0.804 | S | S | * | * | trans | -59.3 | 100.1 | 158.7 | -68 | 0 | 0 | 0 | 0 | 106.4 | S50 L54 | S50-C52 PolarHBondContact O-N 2.77Å; C52-L54 PolarHBondContact O-N 2.9Å; C52-L54 VanDerWaalsContact O-N 3.1Å | ||
| 53 | R | 61.4 | Low | 52.2 | Low | 239 Ų | 239 | 151.9 Ų | 151.9 | 90% | 0.902 | 80% | 0.798 | S | S | * | * | trans | -61.9 | 114.3 | 166.4 | -86.3 | -177.7 | 170.8 | 169.7 | -2 | 106.1 | R51 | R51-R53 VanDerWaalsContact C-N 3.29Å; R51-R53 PolarHBondContact O-N 3.1Å | ||
| 54 | L | 62 | Low | 52 | Low | 159 Ų | 159 | 150 Ų | 150 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -47 | 134.7 | 163.4 | -85.4 | 152.8 | 0 | 0 | 0 | 108.1 | C52 S56 | C52-L54 PolarHBondContact O-N 2.9Å; C52-L54 VanDerWaalsContact O-N 3.1Å; L54-S56 PolarHBondContact O-N 3.02Å |
| 55 | P | 51.3 | Low | 52 | Low | 118 Ų | 118 | 144 Ų | 144 | 77% | 0.766 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 121.5 | 171.9 | 22.7 | -29.9 | 0 | 0 | 0 | 107.1 | R57 | P55-R57 PolarHBondContact O-N 3.13Å; P55-R57 VanDerWaalsContact O-N 3.13Å |
| 56 | S | 54 | Low | 51.9 | Low | 107 Ų | 107 | 151.2 Ų | 151.2 | 75% | 0.748 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 123.8 | 174.4 | 173.3 | 0 | 0 | 0 | 0 | 107.6 | L54 R58 | L54-S56 PolarHBondContact O-N 3.02Å; S56-R58 PolarHBondContact O-N 3.06Å |
| 57 | R | 57.5 | Low | 51.5 | Low | 242 Ų | 242 | 145.2 Ų | 145.2 | 91% | 0.913 | 76% | 0.76 | S | S | * | * | trans | -65.5 | 79.4 | 171.5 | -164.7 | -175.5 | -170.1 | -164.8 | 3.7 | 106.9 | P55 T59 | P55-R57 PolarHBondContact O-N 3.13Å; P55-R57 VanDerWaalsContact O-N 3.13Å; R57-T59 PolarHBondContact O-N 2.71Å | ||
| 58 | R | 50.7 | Low | 51.1 | Low | 225 Ų | 225 | 145.4 Ų | 145.4 | 85% | 0.849 | 76% | 0.755 | S | S | * | * | trans | -69.7 | 102.5 | 169.5 | -167.6 | 175.6 | -137 | 145.9 | 3 | 105 | S56 P60 | S56-R58 PolarHBondContact O-N 3.06Å; R58-P60 WeakPolarHBondContact O-CD 3.45Å; R58-P60 VanDerWaalsContact O-N 3.14Å | ||
| 59 | T | 52.5 | Low | 50.6 | Low | 117 Ų | 117 | 141 Ų | 141 | 72% | 0.718 | 74% | 0.738 | S | S | * | * | trans | -49.6 | 122.6 | 162.9 | -30.4 | 0 | 0 | 0 | 0 | 105.8 | R57 A61 | R57-T59 PolarHBondContact O-N 2.71Å; T59-A61 PolarHBondContact O-N 2.84Å | ||
| 60 | P | 47 | Very low | 50.4 | Low | 107 Ų | 107 | 137.8 Ų | 137.8 | 70% | 0.695 | 71% | 0.714 | S | S | * | * | trans | -52.7 | 125.2 | 172 | -18.4 | 28.6 | 0 | 0 | 0 | 105.8 | R58 T62 | R58-P60 WeakPolarHBondContact O-CD 3.45Å; R58-P60 VanDerWaalsContact O-N 3.14Å; P60-T62 VanDerWaalsContact C-N 3.28Å; P60-T62 PolarHBondContact O-N 2.78Å | ||
| 61 | A | 50 | Low | 49.6 | Very low | 96 Ų | 96 | 137 Ų | 137 | 79% | 0.793 | 70% | 0.701 | S | S | * | * | trans | -58.2 | 106.7 | 166.5 | 0 | 0 | 0 | 0 | 0 | 104.8 | T59 S63 | T59-A61 PolarHBondContact O-N 2.84Å; A61-S63 PolarHBondContact O-N 3.06Å | ||
| 62 | T | 46.2 | Very low | 49.3 | Very low | 126 Ų | 126 | 133.6 Ų | 133.6 | 77% | 0.773 | 70% | 0.696 | S | S | * | * | trans | -62.1 | 92.6 | 163.1 | 35.2 | 0 | 0 | 0 | 0 | 104.8 | P60 N64 | P60-T62 VanDerWaalsContact C-N 3.28Å; P60-T62 PolarHBondContact O-N 2.78Å; T62-N64 PolarHBondContact O-N 3.21Å | ||
| 63 | S | 44.5 | Very low | 48.9 | Very low | 89 Ų | 89 | 133.4 Ų | 133.4 | 62% | 0.622 | 69% | 0.69 | S | S | * | * | trans | -51.3 | 109.3 | 161.3 | 172.9 | 0 | 0 | 0 | 0 | 105.7 | A61 D65 | A61-S63 PolarHBondContact O-N 3.06Å; S63-D65 PolarHBondContact O-N 2.97Å; S63-D65 VanDerWaalsContact O-N 3.08Å; S63-D65 WeakPolarHBondContact OG-CB 3.16Å; S63-D65 PolarHBondContact OG-N 3.08Å | ||
| 64 | N | 42.8 | Very low | 48.4 | Very low | 158 Ų | 158 | 125.7 Ų | 125.7 | 85% | 0.845 | 67% | 0.667 | S | S | * | * | trans | -68.8 | 10.5 | 168.2 | -94.9 | -13.7 | 0 | 0 | 0 | 111.5 | T62 R66 | T62-N64 PolarHBondContact O-N 3.21Å; N64-R66 PolarHBondContact O-N 2.58Å | ||
| 65 | D | 45.5 | Very low | 47.6 | Very low | 112 Ų | 112 | 124 Ų | 124 | 60% | 0.599 | 67% | 0.665 | S | S | * | * | trans | -77.7 | 67.4 | 168.7 | -153.7 | 1.7 | 0 | 0 | 0 | 108.9 | S63 T67 | S63-D65 PolarHBondContact O-N 2.97Å; S63-D65 VanDerWaalsContact O-N 3.08Å; S63-D65 WeakPolarHBondContact OG-CB 3.16Å; S63-D65 PolarHBondContact OG-N 3.08Å; D65-T67 PolarHBondContact O-N 2.86Å; D65-T67 WeakPolarHBondContact OD1-CB 3.34Å; D65-T67 PolarHBondContact OD1-OG1 2.84Å | ||
| 66 | R | 44.6 | Very low | 47.5 | Very low | 229 Ų | 229 | 120.7 Ų | 120.7 | 86% | 0.864 | 64% | 0.638 | S | S | * | * | trans | -72.4 | 43.3 | 166 | -137.6 | -178.7 | -163.7 | 176.1 | 3.8 | 108.9 | N64 I68 | N64-R66 PolarHBondContact O-N 2.58Å; R66-I68 PolarHBondContact O-N 2.84Å | ||
| 67 | T | 42.5 | Very low | 47.3 | Very low | 47 Ų | 47 | 119 Ų | 119 | 29% | 0.288 | 62% | 0.624 | S | S | . | * | trans | -70.6 | 90.3 | 162.7 | -67.4 | 0 | 0 | 0 | 0 | 105.2 | D65 N69 | D65-T67 PolarHBondContact O-N 2.86Å; D65-T67 WeakPolarHBondContact OD1-CB 3.34Å; D65-T67 PolarHBondContact OD1-OG1 2.84Å; T67-N69 VanDerWaalsContact C-N 3.26Å; T67-N69 PolarHBondContact O-N 2.95Å | ||
| 68 | I | 43.6 | Very low | 47.1 | Very low | 125 Ų | 125 | 113.2 Ų | 113.2 | 64% | 0.641 | 62% | 0.616 | S | S | * | * | trans | -60.2 | 101 | 167.4 | -55.7 | 171.2 | 0 | 0 | 0 | 104.4 | R66 L70 | R66-I68 PolarHBondContact O-N 2.84Å; I68-L70 PolarHBondContact O-N 3.48Å | ||
| 69 | N | 45.7 | Very low | 47.1 | Very low | 94 Ų | 94 | 111.2 Ų | 111.2 | 50% | 0.503 | 62% | 0.616 | S | S | . | * | trans | -63.4 | 95.9 | 169.8 | -94.7 | -34.6 | 0 | 0 | 0 | 105.7 | T67 L71 E72 | T67-N69 VanDerWaalsContact C-N 3.26Å; T67-N69 PolarHBondContact O-N 2.95Å; N69-L71 PolarHBondContact O-N 2.83Å; N69-E72 HydrophobicContact CB-CB 4.02Å; N69-E72 WeakPolarHBondContact O-CB 3.39Å; N69-E72 PolarHBondContact O-N 2.83Å | ||
| 70 | L | 46.4 | Very low | 47 | Very low | 47 Ų | 47 | 106.5 Ų | 106.5 | 25% | 0.246 | 59% | 0.588 | C | S | . | * | H | α-helix | trans | -52.2 | -27 | 172.6 | -94.5 | 159.6 | 0 | 0 | 0 | 111.6 | I68 E72 V73 L74 F97 I108 | I68-L70 PolarHBondContact O-N 3.48Å; L70-E72 VanDerWaalsContact C-N 3.32Å; L70-E72 PolarHBondContact O-N 3.03Å; L70-V73 PolarHBondContact O-N 2.91Å; L70-L74 WeakPolarHBondContact O-CB 3.3Å; L70-L74 PolarHBondContact O-N 3.27Å; L70-F97 HydrophobicContact CD2-CZ 4.29Å; L70-I108 HydrophobicContact CD1-CB 4.12Å; L70-I108 HydrophobicContact CD1-CD1 3.9Å; L70-I108 HydrophobicContact CD1-CG1 3.55Å; L70-I108 HydrophobicContact CD1-CG2 3.64Å |
| 71 | L | 44.7 | Very low | 47.3 | Very low | 84 Ų | 84 | 106.5 Ų | 106.5 | 44% | 0.44 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -69 | -21 | 173.8 | -111 | 110.5 | 0 | 0 | 0 | 115.2 | N69 V73 W76 Q115 | N69-L71 PolarHBondContact O-N 2.83Å; L71-V73 VanDerWaalsContact C-N 3.33Å; L71-W76 HydrophobicContact CD2-CB 4.18Å; L71-W76 HydrophobicContact CD2-CG 4.22Å; L71-Q115 HydrophobicContact CD1-CG 4.43Å |
| 72 | E | 46.7 | Very low | 47.5 | Very low | 171 Ų | 171 | 107.1 Ų | 107.1 | 80% | 0.799 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -82.6 | -21.7 | 174.6 | -150.7 | 170.8 | -151.6 | 0 | 0 | 110.7 | N69 L70 | N69-E72 HydrophobicContact CB-CB 4.02Å; N69-E72 WeakPolarHBondContact O-CB 3.39Å; N69-E72 PolarHBondContact O-N 2.83Å; L70-E72 VanDerWaalsContact C-N 3.32Å; L70-E72 PolarHBondContact O-N 3.03Å |
| 73 | V | 46.5 | Very low | 48 | Very low | 109 Ų | 109 | 105.3 Ų | 105.3 | 66% | 0.661 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -90 | -32.4 | 176.7 | -175.8 | 0 | 0 | 0 | 0 | 111.5 | L70 L71 | L70-V73 PolarHBondContact O-N 2.91Å; L71-V73 VanDerWaalsContact C-N 3.33Å |
| 74 | L | 50.8 | Low | 48.5 | Very low | 78 Ų | 78 | 106.6 Ų | 106.6 | 41% | 0.408 | 57% | 0.571 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.7 | 130 | 173.7 | -82 | 151 | 0 | 0 | 0 | 109.3 | L70 W76 F91 | L70-L74 WeakPolarHBondContact O-CB 3.3Å; L70-L74 PolarHBondContact O-N 3.27Å; L74-W76 PolarHBondContact O-N 2.72Å; L74-F91 HydrophobicContact CD1-CE1 4.35Å; L74-F91 HydrophobicContact CD2-CE1 4.35Å |
| 75 | P | 46.6 | Very low | 49.2 | Very low | 123 Ų | 123 | 108.9 Ų | 108.9 | 80% | 0.799 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72 | 78.9 | 178.9 | 31.2 | -33.2 | 0 | 0 | 0 | 108.6 | P77 | P75-P77 WeakPolarHBondContact O-CD 3.36Š|
| 76 | W | 48 | Very low | 49.9 | Very low | 49 Ų | 49 | 106.9 Ų | 106.9 | 19% | 0.186 | 55% | 0.554 | C | S | . | * | trans | -87.7 | 119.5 | 175.3 | -163.9 | -98.5 | 0 | 0 | 0 | 108.6 | L71 L74 T78 A89 F91 | L71-W76 HydrophobicContact CD2-CB 4.18Å; L71-W76 HydrophobicContact CD2-CG 4.22Å; L74-W76 PolarHBondContact O-N 2.72Å; W76-T78 PolarHBondContact O-N 3.18Å; W76-A89 HydrophobicContact CH2-CB 4.3Å; W76-F91 HydrophobicContact CE3-CE2 4.19Å; W76-F91 AromaticContact CE3-CZ 3.7Å; W76-F91 HydrophobicContact CE3-CZ 3.7Å; W76-F91 AromaticContact CH2-CE2 3.66Å; W76-F91 HydrophobicContact CH2-CE2 3.66Å; W76-F91 HydrophobicContact CH2-CZ 4.03Å; W76-F91 HydrophobicContact CZ3-CD2 4.42Å; W76-F91 HydrophobicContact CZ3-CE1 4.37Å; W76-F91 AromaticContact CZ3-CE2 3.21Å; W76-F91 HydrophobicContact CZ3-CE2 3.21Å; W76-F91 AromaticContact CZ3-CZ 3.18Å; W76-F91 HydrophobicContact CZ3-CZ 3.18Å | ||
| 77 | P | 51.1 | Low | 50.6 | Low | 71 Ų | 71 | 103.1 Ų | 103.1 | 46% | 0.461 | 55% | 0.55 | S | S | . | . | trans | -69.2 | 105 | 175.3 | 24.8 | -28.4 | 0 | 0 | 0 | 108.5 | P75 E79 S80 | P75-P77 WeakPolarHBondContact O-CD 3.36Å; P77-E79 PolarHBondContact O-N 3.13Å; P77-E79 VanDerWaalsContact O-N 3.12Å; P77-S80 WeakPolarHBondContact O-CB 3.3Å; P77-S80 PolarHBondContact O-N 2.95Å; P77-S80 VanDerWaalsContact O-N 3.09Å; P77-S80 PolarHBondContact O-OG 3.12Å | ||
| 78 | T | 52.9 | Low | 51.6 | Low | 121 Ų | 121 | 103.8 Ų | 103.8 | 74% | 0.742 | 56% | 0.555 | S | S | * | * | G | 310 helix | trans | -58.6 | -23.3 | -178 | -33.5 | 0 | 0 | 0 | 0 | 112.5 | W76 S80 | W76-T78 PolarHBondContact O-N 3.18Å; T78-S80 PolarHBondContact O-N 3.03Å |
| 79 | E | 51.1 | Low | 52.6 | Low | 182 Ų | 182 | 99 Ų | 99 | 85% | 0.85 | 53% | 0.534 | S | S | * | . | G | 310 helix | trans | -77 | -6.1 | 179.3 | -74.1 | 159.4 | 162.8 | 0 | 0 | 114.2 | P77 I81 | P77-E79 PolarHBondContact O-N 3.13Å; P77-E79 VanDerWaalsContact O-N 3.12Å; E79-I81 PolarHBondContact O-N 3.48Å |
| 80 | S | 50.3 | Low | 53.8 | Low | 19 Ų | 19 | 99.7 Ų | 99.7 | 13% | 0.133 | 54% | 0.537 | C | S | . | . | G | 310 helix | trans | -92.3 | -1.8 | -162.7 | 75.9 | 0 | 0 | 0 | 0 | 115.5 | P77 T78 S82 R86 | P77-S80 WeakPolarHBondContact O-CB 3.3Å; P77-S80 PolarHBondContact O-N 2.95Å; P77-S80 VanDerWaalsContact O-N 3.09Å; P77-S80 PolarHBondContact O-OG 3.12Å; T78-S80 PolarHBondContact O-N 3.03Å; S80-S82 VanDerWaalsContact C-N 3.3Å; S80-S82 PolarHBondContact O-N 2.79Å; S80-R86 VanDerWaalsContact C-NH1 3.32Å; S80-R86 VanDerWaalsContact CB-NH1 3.28Å; S80-R86 VanDerWaalsContact O-CD 3.24Å; S80-R86 WeakPolarHBondContact O-CD 3.46Å; S80-R86 PolarHBondContact O-NE 2.93Å; S80-R86 PolarHBondContact O-NH1 3.44Å; S80-R86 PolarHBondContact OG-NH1 3.19Å; S80-R86 PolarHBondContact OG-NH2 3.34Å |
| 81 | I | 53.5 | Low | 54.8 | Low | 107 Ų | 107 | 99 Ų | 99 | 55% | 0.549 | 53% | 0.532 | S | S | . | . | G | 310 helix | trans | -76.2 | -12.6 | -169.7 | -60.7 | 171.8 | 0 | 0 | 0 | 113 | E79 | E79-I81 PolarHBondContact O-N 3.48Š|
| 82 | S | 52.8 | Low | 55.9 | Low | 108 Ų | 108 | 99.5 Ų | 99.5 | 76% | 0.755 | 53% | 0.532 | S | S | * | . | G | 310 helix | trans | -103 | 1.5 | -169.9 | 56.5 | 0 | 0 | 0 | 0 | 116.8 | S80 P84 | S80-S82 VanDerWaalsContact C-N 3.3Å; S80-S82 PolarHBondContact O-N 2.79Å; S82-P84 WeakPolarHBondContact O-CD 3.44Å |
| 83 | N | 57.6 | Low | 57 | Low | 88 Ų | 88 | 92.7 Ų | 92.7 | 47% | 0.471 | 50% | 0.501 | S | S | . | . | trans | -97.4 | 114.7 | -174.5 | -174.7 | -6.1 | 0 | 0 | 0 | 112.9 | Y85 R86 | N83-Y85 PolarHBondContact O-N 3.42Å; N83-Y85 PolarHBondContact OD1-N 2.91Å; N83-R86 HydrophobicContact CB-CG 4.05Å | ||
| 84 | P | 54.9 | Low | 57.9 | Low | 116 Ų | 116 | 94.7 Ų | 94.7 | 75% | 0.753 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.5 | -7.9 | -179.2 | 29.7 | -35.3 | 0 | 0 | 0 | 114.9 | S82 | S82-P84 WeakPolarHBondContact O-CD 3.44Š|
| 85 | Y | 57.2 | Low | 58.5 | Low | 206 Ų | 206 | 92.9 Ų | 92.9 | 81% | 0.808 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.7 | 20.8 | 178.8 | -61 | -76.5 | 0 | 0 | 0 | 113.5 | N83 L87 | N83-Y85 PolarHBondContact O-N 3.42Å; N83-Y85 PolarHBondContact OD1-N 2.91Å; Y85-L87 PolarHBondContact O-N 3.22Å |
| 86 | R | 59.9 | Low | 59.6 | Low | 71 Ų | 71 | 92.7 Ų | 92.7 | 27% | 0.268 | 48% | 0.479 | S | S | . | . | P | Polyproline II helix | trans | -71.7 | 130.3 | -176.2 | -84.8 | -179.4 | 106.7 | -169.1 | 1.7 | 112.7 | S80 N83 L121 | S80-R86 VanDerWaalsContact C-NH1 3.32Å; S80-R86 VanDerWaalsContact CB-NH1 3.28Å; S80-R86 VanDerWaalsContact O-CD 3.24Å; S80-R86 WeakPolarHBondContact O-CD 3.46Å; S80-R86 PolarHBondContact O-NE 2.93Å; S80-R86 PolarHBondContact O-NH1 3.44Å; S80-R86 PolarHBondContact OG-NH1 3.19Å; S80-R86 PolarHBondContact OG-NH2 3.34Å; N83-R86 HydrophobicContact CB-CG 4.05Å; R86-L121 HydrophobicContact CB-CD2 3.59Å; R86-L121 HydrophobicContact CG-CD2 4.42Å |
| 87 | L | 59.5 | Low | 60.6 | Low | 149 Ų | 149 | 92.6 Ų | 92.6 | 78% | 0.78 | 48% | 0.48 | S | S | * | . | P | Polyproline II helix | trans | -57.8 | 152.3 | 164.4 | -82.4 | 108 | 0 | 0 | 0 | 110.9 | Y85 A89 | Y85-L87 PolarHBondContact O-N 3.22Å; L87-A89 PolarHBondContact O-N 2.85Å |
| 88 | P | 63.1 | Low | 61.3 | Low | 62 Ų | 62 | 89.9 Ų | 89.9 | 40% | 0.403 | 46% | 0.461 | S | S | . | . | P | Polyproline II helix | trans | -53.7 | 127.5 | 172.1 | -20.8 | 30.3 | 0 | 0 | 0 | 110.5 | L90 P122 I124 | P88-L90 PolarHBondContact O-N 3.09Å; P88-P122 CarbonylContact C-O 3.59Å; P88-P122 WeakPolarHBondContact CA-O 3.23Å; P88-P122 HydrophobicContact CB-CB 4.33Å; P88-P122 HydrophobicContact CB-CG 4.22Å; P88-P122 VanDerWaalsContact CB-O 3.25Å; P88-P122 WeakPolarHBondContact CB-O 3.28Å; P88-P122 HydrophobicContact CG-CB 4.48Å; P88-P122 HydrophobicContact CG-CG 4.13Å; P88-I124 HydrophobicContact CB-CD1 3.97Å; P88-I124 HydrophobicContact CB-CG1 4.09Å; P88-I124 HydrophobicContact CG-CD1 4.46Å |
| 89 | A | 66.4 | Low | 62 | Low | 23 Ų | 23 | 89.6 Ų | 89.6 | 19% | 0.19 | 45% | 0.454 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.3 | 123.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 108.4 | W76 L87 P122 I123 I124 | W76-A89 HydrophobicContact CH2-CB 4.3Å; L87-A89 PolarHBondContact O-N 2.85Å; A89-P122 PolarHBondContact N-O 2.98Å; A89-I123 HydrophobicContact CB-CG1 4.08Å; A89-I123 VanDerWaalsContact O-CA 3.31Å; A89-I123 WeakPolarHBondContact O-CA 3.31Å; A89-I124 PolarHBondContact O-N 2.88Å |
| 90 | L | 69.8 | Low | 62.8 | Low | 109 Ų | 109 | 86.1 Ų | 86.1 | 57% | 0.571 | 45% | 0.445 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86.9 | 119.1 | 175.1 | -173.4 | 70.8 | 0 | 0 | 0 | 108.4 | P88 I124 H126 | P88-L90 PolarHBondContact O-N 3.09Å; L90-I124 HydrophobicContact CD1-CB 3.97Å; L90-I124 HydrophobicContact CD1-CG2 3.82Å; L90-H126 HydrophobicContact CD1-CB 4.01Å |
| 91 | F | 66.9 | Low | 63.8 | Low | 34 Ų | 34 | 88.9 Ų | 88.9 | 15% | 0.149 | 46% | 0.455 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.7 | 110.3 | 169.7 | -93.7 | -89.9 | 0 | 0 | 0 | 109 | L74 W76 I123 I124 L125 H126 | L74-F91 HydrophobicContact CD1-CE1 4.35Å; L74-F91 HydrophobicContact CD2-CE1 4.35Å; W76-F91 HydrophobicContact CE3-CE2 4.19Å; W76-F91 AromaticContact CE3-CZ 3.7Å; W76-F91 HydrophobicContact CE3-CZ 3.7Å; W76-F91 AromaticContact CH2-CE2 3.66Å; W76-F91 HydrophobicContact CH2-CE2 3.66Å; W76-F91 HydrophobicContact CH2-CZ 4.03Å; W76-F91 HydrophobicContact CZ3-CD2 4.42Å; W76-F91 HydrophobicContact CZ3-CE1 4.37Å; W76-F91 AromaticContact CZ3-CE2 3.21Å; W76-F91 HydrophobicContact CZ3-CE2 3.21Å; W76-F91 AromaticContact CZ3-CZ 3.18Å; W76-F91 HydrophobicContact CZ3-CZ 3.18Å; F91-I123 HydrophobicContact CB-CG2 4.38Å; F91-I123 HydrophobicContact CD2-CG2 3.58Å; F91-I123 HydrophobicContact CE2-CD1 4.44Å; F91-I123 HydrophobicContact CE2-CG2 4.31Å; F91-I123 HydrophobicContact CG-CG2 4.41Å; F91-I124 PolarHBondContact N-O 3.31Å; F91-L125 HydrophobicContact CB-CD1 3.77Å; F91-H126 PolarHBondContact O-N 3.35Å |
| 92 | E | 68.5 | Low | 64.6 | Low | 94 Ų | 94 | 91.2 Ų | 91.2 | 44% | 0.439 | 46% | 0.461 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.6 | 117.9 | 176.3 | -166.8 | 153.4 | -138.6 | 0 | 0 | 109.7 | H126 | E92-H126 HydrophobicContact CG-CB 4.42Å; E92-H126 IonicContact OE1-CE1 3.7Å; E92-H126 IonicContact OE1-ND1 3.05Å; E92-H126 PolarHBondContact OE1-ND1 3.45Å |
| 93 | L | 68.9 | Low | 65.6 | Low | 27 Ų | 27 | 94.8 Ų | 94.8 | 14% | 0.141 | 47% | 0.466 | C | S | . | . | P | Polyproline II helix | trans | -98.2 | 116.1 | 177.2 | -71.3 | 166.9 | 0 | 0 | 0 | 108.9 | F97 F98 F105 L125 H126 L127 A129 | L93-F97 HydrophobicContact CD2-CD1 3.89Å; L93-F97 HydrophobicContact CD2-CE1 4.03Å; L93-F97 HydrophobicContact CD2-CG 4.36Å; L93-F98 HydrophobicContact CB-CE2 3.61Å; L93-F98 HydrophobicContact CB-CZ 4.22Å; L93-F98 HydrophobicContact CD1-CE2 4.26Å; L93-F98 HydrophobicContact CD1-CZ 4.03Å; L93-F105 HydrophobicContact CD1-CE2 4.13Å; L93-L125 HydrophobicContact CD1-CD1 3.86Å; L93-L125 HydrophobicContact CD1-CG 4.37Å; L93-L125 HydrophobicContact CG-CD1 4.36Å; L93-H126 PolarHBondContact N-O 3.48Å; L93-L127 HydrophobicContact CD1-CD2 3.83Å; L93-A129 VanDerWaalsContact O-CB 3.28Å; L93-A129 WeakPolarHBondContact O-CB 3.36Å |
| 94 | Y | 67.1 | Low | 66.5 | Low | 152 Ų | 152 | 92.4 Ų | 92.4 | 60% | 0.596 | 46% | 0.458 | S | S | * | . | P | Polyproline II helix | trans | -69.7 | 149.9 | 179.3 | -76.1 | -81.5 | 0 | 0 | 0 | 112.7 | E96 F97 | Y94-E96 WeakPolarHBondContact CB-OE2 3.35Å; Y94-E96 PolarHBondContact O-N 3.4Å; Y94-F97 VanDerWaalsContact O-CB 3.22Å; Y94-F97 WeakPolarHBondContact O-CB 3.49Å; Y94-F97 PolarHBondContact O-N 2.98Å |
| 95 | P | 63.2 | Low | 67.4 | Low | 39 Ų | 39 | 89 Ų | 89 | 25% | 0.253 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -53.6 | -38.1 | 178.9 | -24.1 | 32 | 0 | 0 | 0 | 114.2 | F97 F98 L99 A129 | P95-F97 PolarHBondContact O-N 3.04Å; P95-F98 PolarHBondContact O-N 2.87Å; P95-L99 PolarHBondContact O-N 2.96Å; P95-A129 VanDerWaalsContact CA-CB 3.45Å; P95-A129 HydrophobicContact CB-CB 4.21Å; P95-A129 HydrophobicContact CG-CB 4.14Å |
| 96 | E | 69.7 | Low | 68.2 | Low | 119 Ų | 119 | 85.6 Ų | 85.6 | 56% | 0.556 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -63.4 | -33.1 | -179.3 | -62.1 | 75.1 | -165.3 | 0 | 0 | 111.1 | Y94 F98 L99 V100 | Y94-E96 WeakPolarHBondContact CB-OE2 3.35Å; Y94-E96 PolarHBondContact O-N 3.4Å; E96-F98 VanDerWaalsContact C-N 3.31Å; E96-F98 PolarHBondContact O-N 3.38Å; E96-L99 PolarHBondContact O-N 2.71Å; E96-V100 WeakPolarHBondContact O-CG2 3.41Å; E96-V100 PolarHBondContact O-N 3.39Å; E96-V100 VanDerWaalsContact O-N 3.09Å |
| 97 | F | 68.6 | Low | 68.9 | Low | 48 Ų | 48 | 86.9 Ų | 86.9 | 21% | 0.211 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -63 | -39.4 | 177.6 | -167.7 | -92.8 | 0 | 0 | 0 | 111.5 | L70 L93 Y94 P95 L99 V100 F101 I108 | L70-F97 HydrophobicContact CD2-CZ 4.29Å; L93-F97 HydrophobicContact CD2-CD1 3.89Å; L93-F97 HydrophobicContact CD2-CE1 4.03Å; L93-F97 HydrophobicContact CD2-CG 4.36Å; Y94-F97 VanDerWaalsContact O-CB 3.22Å; Y94-F97 WeakPolarHBondContact O-CB 3.49Å; Y94-F97 PolarHBondContact O-N 2.98Å; P95-F97 PolarHBondContact O-N 3.04Å; F97-L99 VanDerWaalsContact C-N 3.35Å; F97-V100 PolarHBondContact O-N 2.92Å; F97-F101 HydrophobicContact CD1-CD2 4.08Å; F97-F101 AromaticContact CD2-CD2 3.63Å; F97-F101 HydrophobicContact CD2-CD2 3.63Å; F97-F101 AromaticContact CD2-CE2 3.73Å; F97-F101 HydrophobicContact CD2-CE2 3.73Å; F97-F101 HydrophobicContact CE1-CB 4.36Å; F97-F101 AromaticContact CE1-CD2 3.99Å; F97-F101 HydrophobicContact CE1-CD2 3.99Å; F97-F101 HydrophobicContact CE1-CG 4.42Å; F97-F101 AromaticContact CE2-CD2 3.52Å; F97-F101 HydrophobicContact CE2-CD2 3.52Å; F97-F101 AromaticContact CE2-CE2 3.53Å; F97-F101 HydrophobicContact CE2-CE2 3.53Å; F97-F101 HydrophobicContact CE2-CG 4.48Å; F97-F101 HydrophobicContact CE2-CZ 4.49Å; F97-F101 AromaticContact CG-CD2 3.91Å; F97-F101 HydrophobicContact CG-CD2 3.91Å; F97-F101 HydrophobicContact CG-CE2 4.44Å; F97-F101 AromaticContact CZ-CD2 3.71Å; F97-F101 HydrophobicContact CZ-CD2 3.71Å; F97-F101 HydrophobicContact CZ-CE2 4.11Å; F97-F101 HydrophobicContact CZ-CG 4.28Å; F97-F101 WeakPolarHBondContact O-CB 3.19Å; F97-F101 VanDerWaalsContact O-CD2 3.3Å; F97-F101 WeakPolarHBondContact O-CD2 3.46Å; F97-F101 PolarHBondContact O-N 3.29Å; F97-I108 HydrophobicContact CE1-CD1 4.26Å; F97-I108 HydrophobicContact CE1-CG2 4.49Å; F97-I108 HydrophobicContact CZ-CD1 4.2Å |
| 98 | F | 65.1 | Low | 69.6 | Low | 13 Ų | 13 | 81 Ų | 81 | 6% | 0.057 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -71.3 | -30.7 | 178.1 | -75.6 | -89.9 | 0 | 0 | 0 | 113.3 | L93 P95 E96 K102 F105 L127 A129 L130 | L93-F98 HydrophobicContact CB-CE2 3.61Å; L93-F98 HydrophobicContact CB-CZ 4.22Å; L93-F98 HydrophobicContact CD1-CE2 4.26Å; L93-F98 HydrophobicContact CD1-CZ 4.03Å; P95-F98 PolarHBondContact O-N 2.87Å; E96-F98 VanDerWaalsContact C-N 3.31Å; E96-F98 PolarHBondContact O-N 3.38Å; F98-K102 WeakPolarHBondContact O-CA 3.34Å; F98-K102 WeakPolarHBondContact O-CB 3.45Å; F98-K102 PolarHBondContact O-N 3.48Å; F98-F105 AromaticContact CD1-CD2 3.83Å; F98-F105 HydrophobicContact CD1-CD2 3.83Å; F98-F105 AromaticContact CD1-CE2 3.95Å; F98-F105 HydrophobicContact CD1-CE2 3.95Å; F98-F105 HydrophobicContact CD1-CG 4.17Å; F98-F105 HydrophobicContact CD1-CZ 4.36Å; F98-F105 HydrophobicContact CE1-CD1 4.05Å; F98-F105 AromaticContact CE1-CD2 3.41Å; F98-F105 HydrophobicContact CE1-CD2 3.41Å; F98-F105 VanDerWaalsContact CE1-CD2 3.41Å; F98-F105 AromaticContact CE1-CE1 3.74Å; F98-F105 HydrophobicContact CE1-CE1 3.74Å; F98-F105 AromaticContact CE1-CE2 3.06Å; F98-F105 HydrophobicContact CE1-CE2 3.06Å; F98-F105 AromaticContact CE1-CG 3.91Å; F98-F105 HydrophobicContact CE1-CG 3.91Å; F98-F105 AromaticContact CE1-CZ 3.25Å; F98-F105 HydrophobicContact CE1-CZ 3.25Å; F98-F105 HydrophobicContact CE2-CE2 4.43Å; F98-F105 HydrophobicContact CZ-CD2 4.08Å; F98-F105 HydrophobicContact CZ-CE1 4.5Å; F98-F105 AromaticContact CZ-CE2 3.36Å; F98-F105 HydrophobicContact CZ-CE2 3.36Å; F98-F105 AromaticContact CZ-CZ 3.62Å; F98-F105 HydrophobicContact CZ-CZ 3.62Å; F98-L127 HydrophobicContact CZ-CD2 3.76Å; F98-A129 HydrophobicContact CD2-CB 3.27Å; F98-A129 HydrophobicContact CE2-CB 3.37Å; F98-A129 HydrophobicContact CG-CB 4.3Å; F98-A129 HydrophobicContact CZ-CB 4.46Å; F98-L130 HydrophobicContact CD1-CD2 4.13Å; F98-L130 HydrophobicContact CD1-CG 4.07Å; F98-L130 HydrophobicContact CE1-CD1 3.65Å; F98-L130 HydrophobicContact CE1-CD2 3.89Å; F98-L130 HydrophobicContact CE1-CG 3.48Å; F98-L130 VanDerWaalsContact CE1-CG 3.48Å; F98-L130 HydrophobicContact CE2-CG 4.49Å; F98-L130 HydrophobicContact CZ-CD1 3.81Å; F98-L130 HydrophobicContact CZ-CG 3.74Å |
| 99 | L | 67 | Low | 70.1 | Confident | 115 Ų | 115 | 80 Ų | 80 | 60% | 0.602 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -70.3 | -40.4 | 176.5 | -67.9 | 173.8 | 0 | 0 | 0 | 111.1 | P95 E96 F97 L133 | P95-L99 PolarHBondContact O-N 2.96Å; E96-L99 PolarHBondContact O-N 2.71Å; F97-L99 VanDerWaalsContact C-N 3.35Å; L99-L133 HydrophobicContact CD2-CD1 3.98Å |
| 100 | V | 69.6 | Low | 70.5 | Confident | 109 Ų | 109 | 84.7 Ų | 84.7 | 66% | 0.661 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -76.9 | -38.5 | -179.3 | 178.1 | 0 | 0 | 0 | 0 | 111.9 | E96 F97 | E96-V100 WeakPolarHBondContact O-CG2 3.41Å; E96-V100 PolarHBondContact O-N 3.39Å; E96-V100 VanDerWaalsContact O-N 3.09Å; F97-V100 PolarHBondContact O-N 2.92Å |
| 101 | F | 70.3 | Confident | 70.7 | Confident | 78 Ų | 78 | 86 Ų | 86 | 34% | 0.342 | 41% | 0.414 | S | S | . | . | S | Bend | trans | -110.2 | 24.6 | -172 | -60.8 | -74.7 | 0 | 0 | 0 | 114 | F97 E103 A104 F105 I108 | F97-F101 HydrophobicContact CD1-CD2 4.08Å; F97-F101 AromaticContact CD2-CD2 3.63Å; F97-F101 HydrophobicContact CD2-CD2 3.63Å; F97-F101 AromaticContact CD2-CE2 3.73Å; F97-F101 HydrophobicContact CD2-CE2 3.73Å; F97-F101 HydrophobicContact CE1-CB 4.36Å; F97-F101 AromaticContact CE1-CD2 3.99Å; F97-F101 HydrophobicContact CE1-CD2 3.99Å; F97-F101 HydrophobicContact CE1-CG 4.42Å; F97-F101 AromaticContact CE2-CD2 3.52Å; F97-F101 HydrophobicContact CE2-CD2 3.52Å; F97-F101 AromaticContact CE2-CE2 3.53Å; F97-F101 HydrophobicContact CE2-CE2 3.53Å; F97-F101 HydrophobicContact CE2-CG 4.48Å; F97-F101 HydrophobicContact CE2-CZ 4.49Å; F97-F101 AromaticContact CG-CD2 3.91Å; F97-F101 HydrophobicContact CG-CD2 3.91Å; F97-F101 HydrophobicContact CG-CE2 4.44Å; F97-F101 AromaticContact CZ-CD2 3.71Å; F97-F101 HydrophobicContact CZ-CD2 3.71Å; F97-F101 HydrophobicContact CZ-CE2 4.11Å; F97-F101 HydrophobicContact CZ-CG 4.28Å; F97-F101 WeakPolarHBondContact O-CB 3.19Å; F97-F101 VanDerWaalsContact O-CD2 3.3Å; F97-F101 WeakPolarHBondContact O-CD2 3.46Å; F97-F101 PolarHBondContact O-N 3.29Å; F101-E103 VanDerWaalsContact C-N 3.29Å; F101-E103 PolarHBondContact O-N 3.08Å; F101-E103 VanDerWaalsContact O-N 3.13Å; F101-A104 HydrophobicContact CB-CB 4.46Å; F101-A104 CarbonylContact O-C 3.49Å; F101-A104 PolarHBondContact O-N 3.19Å; F101-F105 WeakPolarHBondContact O-CB 3.26Å; F101-F105 PolarHBondContact O-N 3.39Å; F101-I108 HydrophobicContact CB-CD1 3.99Å; F101-I108 HydrophobicContact CD1-CD1 4.31Å; F101-I108 HydrophobicContact CG-CD1 4.21Å |
| 102 | K | 70.3 | Confident | 71.1 | Confident | 155 Ų | 155 | 86.4 Ų | 86.4 | 67% | 0.674 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -47.6 | -46.5 | -174.5 | -173.3 | -169.9 | 172.3 | -158.2 | 0 | 114.1 | F98 | F98-K102 WeakPolarHBondContact O-CA 3.34Å; F98-K102 WeakPolarHBondContact O-CB 3.45Å; F98-K102 PolarHBondContact O-N 3.48Å |
| 103 | E | 74.1 | Confident | 71.4 | Confident | 184 Ų | 184 | 87.9 Ų | 87.9 | 86% | 0.86 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.1 | -35.5 | -179.3 | -80.1 | 165 | 176.1 | 0 | 0 | 112.5 | F101 F105 | F101-E103 VanDerWaalsContact C-N 3.29Å; F101-E103 PolarHBondContact O-N 3.08Å; F101-E103 VanDerWaalsContact O-N 3.13Å; E103-F105 VanDerWaalsContact C-N 3.3Å; E103-F105 PolarHBondContact O-N 2.99Å |
| 104 | A | 76.3 | Confident | 71.9 | Confident | 37 Ų | 37 | 89 Ų | 89 | 31% | 0.306 | 44% | 0.435 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80 | -11.3 | 179 | 0 | 0 | 0 | 0 | 0 | 113.1 | F101 H106 D107 I108 | F101-A104 HydrophobicContact CB-CB 4.46Å; F101-A104 CarbonylContact O-C 3.49Å; F101-A104 PolarHBondContact O-N 3.19Å; A104-H106 PolarHBondContact O-N 3.41Å; A104-D107 PolarHBondContact O-N 3.13Å; A104-D107 VanDerWaalsContact O-N 3.09Å; A104-I108 HydrophobicContact CB-CD1 3.93Å; A104-I108 HydrophobicContact CB-CG1 4.38Å; A104-I108 WeakPolarHBondContact O-CG1 3.46Å; A104-I108 PolarHBondContact O-N 3.46Å |
| 105 | F | 74.6 | Confident | 72.1 | Confident | 44 Ų | 44 | 85.2 Ų | 85.2 | 19% | 0.193 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -58.2 | -37.4 | -173.3 | -176.5 | -102.8 | 0 | 0 | 0 | 112.2 | L93 F98 F101 E103 I108 S109 L127 L130 | L93-F105 HydrophobicContact CD1-CE2 4.13Å; F98-F105 AromaticContact CD1-CD2 3.83Å; F98-F105 HydrophobicContact CD1-CD2 3.83Å; F98-F105 AromaticContact CD1-CE2 3.95Å; F98-F105 HydrophobicContact CD1-CE2 3.95Å; F98-F105 HydrophobicContact CD1-CG 4.17Å; F98-F105 HydrophobicContact CD1-CZ 4.36Å; F98-F105 HydrophobicContact CE1-CD1 4.05Å; F98-F105 AromaticContact CE1-CD2 3.41Å; F98-F105 HydrophobicContact CE1-CD2 3.41Å; F98-F105 VanDerWaalsContact CE1-CD2 3.41Å; F98-F105 AromaticContact CE1-CE1 3.74Å; F98-F105 HydrophobicContact CE1-CE1 3.74Å; F98-F105 AromaticContact CE1-CE2 3.06Å; F98-F105 HydrophobicContact CE1-CE2 3.06Å; F98-F105 AromaticContact CE1-CG 3.91Å; F98-F105 HydrophobicContact CE1-CG 3.91Å; F98-F105 AromaticContact CE1-CZ 3.25Å; F98-F105 HydrophobicContact CE1-CZ 3.25Å; F98-F105 HydrophobicContact CE2-CE2 4.43Å; F98-F105 HydrophobicContact CZ-CD2 4.08Å; F98-F105 HydrophobicContact CZ-CE1 4.5Å; F98-F105 AromaticContact CZ-CE2 3.36Å; F98-F105 HydrophobicContact CZ-CE2 3.36Å; F98-F105 AromaticContact CZ-CZ 3.62Å; F98-F105 HydrophobicContact CZ-CZ 3.62Å; F101-F105 WeakPolarHBondContact O-CB 3.26Å; F101-F105 PolarHBondContact O-N 3.39Å; E103-F105 VanDerWaalsContact C-N 3.3Å; E103-F105 PolarHBondContact O-N 2.99Å; F105-I108 PolarHBondContact O-N 3.24Å; F105-S109 VanDerWaalsContact O-CB 3.26Å; F105-S109 WeakPolarHBondContact O-CB 3.23Å; F105-S109 PolarHBondContact O-N 3.14Å; F105-S109 PolarHBondContact O-OG 3.22Å; F105-L127 HydrophobicContact CZ-CD2 4.24Å; F105-L130 HydrophobicContact CE1-CD1 4.44Å; F105-L130 HydrophobicContact CZ-CD1 4.39Å |
| 106 | H | 73.2 | Confident | 72.4 | Confident | 136 Ų | 136 | 85.8 Ų | 85.8 | 63% | 0.63 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -60.5 | -50.4 | 176.7 | -171 | 62.9 | 0 | 0 | 0 | 111.4 | A104 I108 S109 H110 | A104-H106 PolarHBondContact O-N 3.41Å; H106-I108 PolarHBondContact O-N 3.41Å; H106-S109 PolarHBondContact O-N 2.73Å; H106-S109 PolarHBondContact O-OG 3.44Å; H106-H110 WeakPolarHBondContact O-CB 3.5Å; H106-H110 PolarHBondContact O-N 2.89Å |
| 107 | D | 75.3 | Confident | 72.5 | Confident | 97 Ų | 97 | 86.8 Ų | 86.8 | 52% | 0.519 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -65 | -39.3 | 179 | -66.6 | -19.4 | 0 | 0 | 0 | 112.2 | A104 H110 R111 | A104-D107 PolarHBondContact O-N 3.13Å; A104-D107 VanDerWaalsContact O-N 3.09Å; D107-H110 PolarHBondContact O-N 3.35Å; D107-R111 WeakPolarHBondContact O-CB 3.22Å; D107-R111 VanDerWaalsContact O-CG 3.3Å; D107-R111 WeakPolarHBondContact O-CG 3.44Å; D107-R111 PolarHBondContact O-N 3.09Å |
| 108 | I | 74 | Confident | 72.7 | Confident | 26 Ų | 26 | 92.5 Ų | 92.5 | 13% | 0.133 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -63.7 | -45.8 | 177.3 | -65.9 | 171.4 | 0 | 0 | 0 | 110.3 | L70 F97 F101 A104 F105 H106 H110 R111 L112 | L70-I108 HydrophobicContact CD1-CB 4.12Å; L70-I108 HydrophobicContact CD1-CD1 3.9Å; L70-I108 HydrophobicContact CD1-CG1 3.55Å; L70-I108 HydrophobicContact CD1-CG2 3.64Å; F97-I108 HydrophobicContact CE1-CD1 4.26Å; F97-I108 HydrophobicContact CE1-CG2 4.49Å; F97-I108 HydrophobicContact CZ-CD1 4.2Å; F101-I108 HydrophobicContact CB-CD1 3.99Å; F101-I108 HydrophobicContact CD1-CD1 4.31Å; F101-I108 HydrophobicContact CG-CD1 4.21Å; A104-I108 HydrophobicContact CB-CD1 3.93Å; A104-I108 HydrophobicContact CB-CG1 4.38Å; A104-I108 WeakPolarHBondContact O-CG1 3.46Å; A104-I108 PolarHBondContact O-N 3.46Å; F105-I108 PolarHBondContact O-N 3.24Å; H106-I108 PolarHBondContact O-N 3.41Å; I108-H110 VanDerWaalsContact C-N 3.34Å; I108-H110 PolarHBondContact O-N 3.04Å; I108-R111 PolarHBondContact O-N 3.33Å; I108-L112 WeakPolarHBondContact O-CB 3.43Å; I108-L112 PolarHBondContact O-N 2.83Å |
| 109 | S | 74.3 | Confident | 72.9 | Confident | 40 Ų | 40 | 93.6 Ų | 93.6 | 28% | 0.28 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63.9 | -40 | 178.4 | 72.7 | 0 | 0 | 0 | 0 | 111.8 | F105 H106 L112 K113 | F105-S109 VanDerWaalsContact O-CB 3.26Å; F105-S109 WeakPolarHBondContact O-CB 3.23Å; F105-S109 PolarHBondContact O-N 3.14Å; F105-S109 PolarHBondContact O-OG 3.22Å; H106-S109 PolarHBondContact O-N 2.73Å; H106-S109 PolarHBondContact O-OG 3.44Å; S109-L112 PolarHBondContact O-N 3.5Å; S109-K113 WeakPolarHBondContact O-CB 3.38Å; S109-K113 PolarHBondContact O-N 2.68Å |
| 110 | H | 73.8 | Confident | 72.8 | Confident | 122 Ų | 122 | 91.3 Ų | 91.3 | 57% | 0.565 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -64.7 | -44.3 | 176.9 | -176 | -86.7 | 0 | 0 | 0 | 111.5 | H106 D107 I108 K113 A114 | H106-H110 WeakPolarHBondContact O-CB 3.5Å; H106-H110 PolarHBondContact O-N 2.89Å; D107-H110 PolarHBondContact O-N 3.35Å; I108-H110 VanDerWaalsContact C-N 3.34Å; I108-H110 PolarHBondContact O-N 3.04Å; H110-K113 PolarHBondContact O-N 2.86Å; H110-A114 PolarHBondContact O-N 3.09Å |
| 111 | R | 74.8 | Confident | 72.5 | Confident | 138 Ų | 138 | 87.5 Ų | 87.5 | 52% | 0.521 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -64.6 | -41.1 | 175.8 | -73.1 | 174.6 | -176.4 | -106.5 | 6.2 | 112.1 | D107 I108 A114 Q115 | D107-R111 WeakPolarHBondContact O-CB 3.22Å; D107-R111 VanDerWaalsContact O-CG 3.3Å; D107-R111 WeakPolarHBondContact O-CG 3.44Å; D107-R111 PolarHBondContact O-N 3.09Å; I108-R111 PolarHBondContact O-N 3.33Å; R111-A114 PolarHBondContact O-N 2.99Å; R111-Q115 WeakPolarHBondContact O-CG 3.4Å; R111-Q115 PolarHBondContact O-N 3.22Å; R111-Q115 VanDerWaalsContact O-N 3.08Å |
| 112 | L | 74.8 | Confident | 72.1 | Confident | 41 Ų | 41 | 87.6 Ų | 87.6 | 22% | 0.215 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -61.8 | -45.1 | 176.6 | -172.6 | 67.1 | 0 | 0 | 0 | 110.7 | I108 S109 A114 Q115 M116 L125 | I108-L112 WeakPolarHBondContact O-CB 3.43Å; I108-L112 PolarHBondContact O-N 2.83Å; S109-L112 PolarHBondContact O-N 3.5Å; L112-A114 PolarHBondContact O-N 3.1Å; L112-Q115 PolarHBondContact O-N 3.35Å; L112-M116 HydrophobicContact CG-SD 4.17Å; L112-M116 VanDerWaalsContact O-CG 3.26Å; L112-M116 WeakPolarHBondContact O-CG 3.26Å; L112-M116 PolarHBondContact O-N 3.33Å; L112-L125 HydrophobicContact CD2-CD1 3.78Å; L112-L125 HydrophobicContact CD2-CD2 4.4Å |
| 113 | K | 75.5 | Confident | 71.8 | Confident | 126 Ų | 126 | 81.2 Ų | 81.2 | 55% | 0.548 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -58 | -48.6 | 175.5 | -175.9 | -175.3 | 175.6 | -170.2 | 0 | 112.3 | S109 H110 Q115 M116 E117 | S109-K113 WeakPolarHBondContact O-CB 3.38Å; S109-K113 PolarHBondContact O-N 2.68Å; H110-K113 PolarHBondContact O-N 2.86Å; K113-Q115 PolarHBondContact O-N 3.17Å; K113-M116 WeakPolarHBondContact O-CB 3.19Å; K113-M116 PolarHBondContact O-N 3.4Å; K113-M116 VanDerWaalsContact O-N 3.13Å; K113-E117 VanDerWaalsContact CE-OE1 3.27Å; K113-E117 WeakPolarHBondContact CE-OE1 3.27Å; K113-E117 PolarHBondContact O-N 2.88Å |
| 114 | A | 78.3 | Confident | 71.4 | Confident | 49 Ų | 49 | 77 Ų | 77 | 41% | 0.405 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -60.8 | -34.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | H110 R111 L112 K118 | H110-A114 PolarHBondContact O-N 3.09Å; R111-A114 PolarHBondContact O-N 2.99Å; L112-A114 PolarHBondContact O-N 3.1Å; A114-K118 PolarHBondContact O-N 2.97Å |
| 115 | Q | 71.1 | Confident | 70.9 | Confident | 73 Ų | 73 | 77.9 Ų | 77.9 | 34% | 0.341 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -73.5 | -38.9 | 174.4 | -72.4 | -65.9 | -17.4 | 0 | 0 | 112.6 | L71 R111 L112 K113 E117 K118 I119 | L71-Q115 HydrophobicContact CD1-CG 4.43Å; R111-Q115 WeakPolarHBondContact O-CG 3.4Å; R111-Q115 PolarHBondContact O-N 3.22Å; R111-Q115 VanDerWaalsContact O-N 3.08Å; L112-Q115 PolarHBondContact O-N 3.35Å; K113-Q115 PolarHBondContact O-N 3.17Å; Q115-E117 VanDerWaalsContact C-N 3.31Å; Q115-E117 PolarHBondContact O-N 2.95Å; Q115-K118 PolarHBondContact O-N 2.99Å; Q115-K118 VanDerWaalsContact O-N 3.14Å; Q115-I119 HydrophobicContact CB-CD1 4.43Å; Q115-I119 WeakPolarHBondContact O-CB 3.24Å; Q115-I119 VanDerWaalsContact O-CG1 3.23Å; Q115-I119 WeakPolarHBondContact O-CG1 3.44Å; Q115-I119 PolarHBondContact O-N 3.32Å |
| 116 | M | 69.5 | Low | 70.4 | Confident | 52 Ų | 52 | 79.2 Ų | 79.2 | 26% | 0.256 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -58.8 | -44.2 | 174.4 | -68.1 | 165.1 | 83.1 | 0 | 0 | 111 | L112 K113 K118 I119 G120 I123 | L112-M116 HydrophobicContact CG-SD 4.17Å; L112-M116 VanDerWaalsContact O-CG 3.26Å; L112-M116 WeakPolarHBondContact O-CG 3.26Å; L112-M116 PolarHBondContact O-N 3.33Å; K113-M116 WeakPolarHBondContact O-CB 3.19Å; K113-M116 PolarHBondContact O-N 3.4Å; K113-M116 VanDerWaalsContact O-N 3.13Å; M116-K118 VanDerWaalsContact C-N 3.29Å; M116-K118 PolarHBondContact O-N 3.28Å; M116-I119 PolarHBondContact O-N 3.24Å; M116-G120 PolarHBondContact O-N 2.83Å; M116-I123 HydrophobicContact CB-CD1 4.46Å; M116-I123 HydrophobicContact CE-CB 3.5Å; M116-I123 HydrophobicContact CE-CG2 3.76Å; M116-I123 WeakPolarHBondContact CE-O 3.25Å; M116-I123 HydrophobicContact CG-CB 4.22Å; M116-I123 HydrophobicContact CG-CD1 3.66Å; M116-I123 HydrophobicContact SD-CB 4.45Å; M116-I123 HydrophobicContact SD-CG2 4.44Å |
| 117 | E | 71.3 | Confident | 70.1 | Confident | 140 Ų | 140 | 75.8 Ų | 75.8 | 65% | 0.654 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -61.6 | -36.9 | 175.6 | -73.8 | 176.1 | -172.9 | 0 | 0 | 112.2 | K113 Q115 | K113-E117 VanDerWaalsContact CE-OE1 3.27Å; K113-E117 WeakPolarHBondContact CE-OE1 3.27Å; K113-E117 PolarHBondContact O-N 2.88Å; Q115-E117 VanDerWaalsContact C-N 3.31Å; Q115-E117 PolarHBondContact O-N 2.95Å |
| 118 | K | 74 | Confident | 69.5 | Low | 167 Ų | 167 | 76.1 Ų | 76.1 | 73% | 0.726 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -73.3 | -37 | 178.4 | -171 | 178.6 | -179.6 | -177.3 | 0 | 113.3 | A114 Q115 M116 | A114-K118 PolarHBondContact O-N 2.97Å; Q115-K118 PolarHBondContact O-N 2.99Å; Q115-K118 VanDerWaalsContact O-N 3.14Å; M116-K118 VanDerWaalsContact C-N 3.29Å; M116-K118 PolarHBondContact O-N 3.28Å |
| 119 | I | 69.8 | Low | 68.8 | Low | 37 Ų | 37 | 74.9 Ų | 74.9 | 19% | 0.19 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -83.1 | -24.1 | -175.2 | -66.7 | 167.3 | 0 | 0 | 0 | 110.9 | Q115 M116 L121 | Q115-I119 HydrophobicContact CB-CD1 4.43Å; Q115-I119 WeakPolarHBondContact O-CB 3.24Å; Q115-I119 VanDerWaalsContact O-CG1 3.23Å; Q115-I119 WeakPolarHBondContact O-CG1 3.44Å; Q115-I119 PolarHBondContact O-N 3.32Å; M116-I119 PolarHBondContact O-N 3.24Å; I119-L121 HydrophobicContact CG2-CB 3.97Å; I119-L121 HydrophobicContact CG2-CD1 3.35Å; I119-L121 HydrophobicContact CG2-CG 4.25Å; I119-L121 PolarHBondContact O-N 3.28Å; I119-L121 VanDerWaalsContact O-N 3.1Å |
| 120 | G | 64.1 | Low | 68.2 | Low | 66 Ų | 66 | 76.3 Ų | 76.3 | 68% | 0.68 | 39% | 0.388 | S | S | * | . | trans | 67 | 8.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | M116 | M116-G120 PolarHBondContact O-N 2.83Š| ||
| 121 | L | 64.3 | Low | 67.7 | Low | 29 Ų | 29 | 76.5 Ų | 76.5 | 15% | 0.152 | 39% | 0.388 | C | S | . | . | trans | -87.7 | 141.5 | 176.6 | -94 | 111 | 0 | 0 | 0 | 111.3 | R86 I119 I123 | R86-L121 HydrophobicContact CB-CD2 3.59Å; R86-L121 HydrophobicContact CG-CD2 4.42Å; I119-L121 HydrophobicContact CG2-CB 3.97Å; I119-L121 HydrophobicContact CG2-CD1 3.35Å; I119-L121 HydrophobicContact CG2-CG 4.25Å; I119-L121 PolarHBondContact O-N 3.28Å; I119-L121 VanDerWaalsContact O-N 3.1Å; L121-I123 PolarHBondContact O-N 3.04Å | ||
| 122 | P | 60.3 | Low | 67.2 | Low | 80 Ų | 80 | 73.4 Ų | 73.4 | 52% | 0.519 | 38% | 0.381 | S | S | . | . | trans | -66.1 | 107.7 | 166.1 | 27.5 | -30.6 | 0 | 0 | 0 | 108.2 | P88 A89 | P88-P122 CarbonylContact C-O 3.59Å; P88-P122 WeakPolarHBondContact CA-O 3.23Å; P88-P122 HydrophobicContact CB-CB 4.33Å; P88-P122 HydrophobicContact CB-CG 4.22Å; P88-P122 VanDerWaalsContact CB-O 3.25Å; P88-P122 WeakPolarHBondContact CB-O 3.28Å; P88-P122 HydrophobicContact CG-CB 4.48Å; P88-P122 HydrophobicContact CG-CG 4.13Å; A89-P122 PolarHBondContact N-O 2.98Å | ||
| 123 | I | 64.5 | Low | 66.6 | Low | 21 Ų | 21 | 73.9 Ų | 73.9 | 11% | 0.108 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 122.4 | 172.4 | -73.4 | 158.2 | 0 | 0 | 0 | 107.5 | A89 F91 M116 L121 | A89-I123 HydrophobicContact CB-CG1 4.08Å; A89-I123 VanDerWaalsContact O-CA 3.31Å; A89-I123 WeakPolarHBondContact O-CA 3.31Å; F91-I123 HydrophobicContact CB-CG2 4.38Å; F91-I123 HydrophobicContact CD2-CG2 3.58Å; F91-I123 HydrophobicContact CE2-CD1 4.44Å; F91-I123 HydrophobicContact CE2-CG2 4.31Å; F91-I123 HydrophobicContact CG-CG2 4.41Å; M116-I123 HydrophobicContact CB-CD1 4.46Å; M116-I123 HydrophobicContact CE-CB 3.5Å; M116-I123 HydrophobicContact CE-CG2 3.76Å; M116-I123 WeakPolarHBondContact CE-O 3.25Å; M116-I123 HydrophobicContact CG-CB 4.22Å; M116-I123 HydrophobicContact CG-CD1 3.66Å; M116-I123 HydrophobicContact SD-CB 4.45Å; M116-I123 HydrophobicContact SD-CG2 4.44Å; L121-I123 PolarHBondContact O-N 3.04Å |
| 124 | I | 66.3 | Low | 66.2 | Low | 96 Ų | 96 | 74.9 Ų | 74.9 | 49% | 0.492 | 39% | 0.385 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.8 | 112.5 | 174.7 | -60.5 | 175.3 | 0 | 0 | 0 | 106.6 | P88 A89 L90 F91 | P88-I124 HydrophobicContact CB-CD1 3.97Å; P88-I124 HydrophobicContact CB-CG1 4.09Å; P88-I124 HydrophobicContact CG-CD1 4.46Å; A89-I124 PolarHBondContact O-N 2.88Å; L90-I124 HydrophobicContact CD1-CB 3.97Å; L90-I124 HydrophobicContact CD1-CG2 3.82Å; F91-I124 PolarHBondContact N-O 3.31Å |
| 125 | L | 65.7 | Low | 65.4 | Low | 56 Ų | 56 | 75.3 Ų | 75.3 | 29% | 0.293 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88 | 109.2 | 176.6 | -167.2 | 67.9 | 0 | 0 | 0 | 109 | F91 L93 L112 L127 | F91-L125 HydrophobicContact CB-CD1 3.77Å; L93-L125 HydrophobicContact CD1-CD1 3.86Å; L93-L125 HydrophobicContact CD1-CG 4.37Å; L93-L125 HydrophobicContact CG-CD1 4.36Å; L112-L125 HydrophobicContact CD2-CD1 3.78Å; L112-L125 HydrophobicContact CD2-CD2 4.4Å; L125-L127 HydrophobicContact CD2-CD1 4.15Å; L125-L127 HydrophobicContact CD2-CD2 3.77Å; L125-L127 HydrophobicContact CD2-CG 4.02Å; L125-L127 HydrophobicContact CG-CD2 3.98Å; L125-L127 HydrophobicContact CG-CG 4.02Å; L125-L127 PolarHBondContact O-N 2.89Å |
| 126 | H | 64.2 | Low | 65.3 | Low | 72 Ų | 72 | 79.5 Ų | 79.5 | 33% | 0.333 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.7 | 99.6 | 178.5 | -159.3 | -106.9 | 0 | 0 | 0 | 109.4 | L90 F91 E92 L93 F128 | L90-H126 HydrophobicContact CD1-CB 4.01Å; F91-H126 PolarHBondContact O-N 3.35Å; E92-H126 HydrophobicContact CG-CB 4.42Å; E92-H126 IonicContact OE1-CE1 3.7Å; E92-H126 IonicContact OE1-ND1 3.05Å; E92-H126 PolarHBondContact OE1-ND1 3.45Å; L93-H126 PolarHBondContact N-O 3.48Å; H126-F128 VanDerWaalsContact C-N 3.27Å; H126-F128 AromaticContact CE1-CD2 3.54Å; H126-F128 AromaticContact CE1-CG 3.91Å; H126-F128 PolarHBondContact O-N 3.48Å |
| 127 | L | 65.9 | Low | 65.2 | Low | 64 Ų | 64 | 82.3 Ų | 82.3 | 34% | 0.335 | 40% | 0.404 | S | S | . | . | trans | -91.4 | 38.6 | -176.3 | -67.9 | 166.4 | 0 | 0 | 0 | 112.6 | L93 F98 F105 L125 A129 L130 F131 | L93-L127 HydrophobicContact CD1-CD2 3.83Å; F98-L127 HydrophobicContact CZ-CD2 3.76Å; F105-L127 HydrophobicContact CZ-CD2 4.24Å; L125-L127 HydrophobicContact CD2-CD1 4.15Å; L125-L127 HydrophobicContact CD2-CD2 3.77Å; L125-L127 HydrophobicContact CD2-CG 4.02Å; L125-L127 HydrophobicContact CG-CD2 3.98Å; L125-L127 HydrophobicContact CG-CG 4.02Å; L125-L127 PolarHBondContact O-N 2.89Å; L127-A129 PolarHBondContact O-N 2.86Å; L127-A129 VanDerWaalsContact O-N 3.09Å; L127-L130 HydrophobicContact CB-CB 4.39Å; L127-L130 HydrophobicContact CB-CD1 4.07Å; L127-L130 HydrophobicContact CD1-CD1 4.04Å; L127-L130 HydrophobicContact CD2-CD1 3.73Å; L127-L130 HydrophobicContact CG-CD1 4.15Å; L127-L130 PolarHBondContact O-N 2.96Å; L127-F131 PolarHBondContact O-N 3.49Å | ||
| 128 | F | 63.6 | Low | 64.9 | Low | 103 Ų | 103 | 81.9 Ų | 81.9 | 45% | 0.452 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -52.9 | -36 | -177.5 | -159 | -109.6 | 0 | 0 | 0 | 112.7 | H126 F131 I132 | H126-F128 VanDerWaalsContact C-N 3.27Å; H126-F128 AromaticContact CE1-CD2 3.54Å; H126-F128 AromaticContact CE1-CG 3.91Å; H126-F128 PolarHBondContact O-N 3.48Å; F128-F131 WeakPolarHBondContact O-CB 3.04Å; F128-F131 PolarHBondContact O-N 3.39Å; F128-I132 HydrophobicContact CD1-CD1 3.73Å; F128-I132 HydrophobicContact CD1-CG1 4.19Å; F128-I132 HydrophobicContact CE1-CD1 3.35Å; F128-I132 HydrophobicContact CE1-CG1 4.07Å; F128-I132 HydrophobicContact CZ-CD1 4.14Å; F128-I132 PolarHBondContact O-N 3.09Å |
| 129 | A | 59 | Low | 64.6 | Low | 1 Ų | 1 | 79 Ų | 79 | 1% | 0.008 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -57.7 | -44.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | L93 P95 F98 L127 F131 I132 L133 | L93-A129 VanDerWaalsContact O-CB 3.28Å; L93-A129 WeakPolarHBondContact O-CB 3.36Å; P95-A129 VanDerWaalsContact CA-CB 3.45Å; P95-A129 HydrophobicContact CB-CB 4.21Å; P95-A129 HydrophobicContact CG-CB 4.14Å; F98-A129 HydrophobicContact CD2-CB 3.27Å; F98-A129 HydrophobicContact CE2-CB 3.37Å; F98-A129 HydrophobicContact CG-CB 4.3Å; F98-A129 HydrophobicContact CZ-CB 4.46Å; L127-A129 PolarHBondContact O-N 2.86Å; L127-A129 VanDerWaalsContact O-N 3.09Å; A129-F131 VanDerWaalsContact C-N 3.3Å; A129-F131 PolarHBondContact O-N 3.45Å; A129-I132 PolarHBondContact O-N 3.31Å; A129-L133 VanDerWaalsContact O-CB 3.23Å; A129-L133 WeakPolarHBondContact O-CB 3.49Å; A129-L133 PolarHBondContact O-N 3.05Å |
| 130 | L | 62.3 | Low | 64.8 | Low | 69 Ų | 69 | 81.8 Ų | 81.8 | 36% | 0.361 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -66.6 | -37.6 | 178.8 | -84.2 | 163 | 0 | 0 | 0 | 110.9 | F98 F105 L127 Y134 | F98-L130 HydrophobicContact CD1-CD2 4.13Å; F98-L130 HydrophobicContact CD1-CG 4.07Å; F98-L130 HydrophobicContact CE1-CD1 3.65Å; F98-L130 HydrophobicContact CE1-CD2 3.89Å; F98-L130 HydrophobicContact CE1-CG 3.48Å; F98-L130 VanDerWaalsContact CE1-CG 3.48Å; F98-L130 HydrophobicContact CE2-CG 4.49Å; F98-L130 HydrophobicContact CZ-CD1 3.81Å; F98-L130 HydrophobicContact CZ-CG 3.74Å; F105-L130 HydrophobicContact CE1-CD1 4.44Å; F105-L130 HydrophobicContact CZ-CD1 4.39Å; L127-L130 HydrophobicContact CB-CB 4.39Å; L127-L130 HydrophobicContact CB-CD1 4.07Å; L127-L130 HydrophobicContact CD1-CD1 4.04Å; L127-L130 HydrophobicContact CD2-CD1 3.73Å; L127-L130 HydrophobicContact CG-CD1 4.15Å; L127-L130 PolarHBondContact O-N 2.96Å; L130-Y134 WeakPolarHBondContact O-CB 3.5Å; L130-Y134 PolarHBondContact O-N 3.41Å |
| 131 | F | 62.1 | Low | 65.5 | Low | 127 Ų | 127 | 82 Ų | 82 | 56% | 0.557 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -65.3 | -47.1 | 176.6 | -177.8 | -106.6 | 0 | 0 | 0 | 111.6 | L127 F128 A129 Y134 L135 | L127-F131 PolarHBondContact O-N 3.49Å; F128-F131 WeakPolarHBondContact O-CB 3.04Å; F128-F131 PolarHBondContact O-N 3.39Å; A129-F131 VanDerWaalsContact C-N 3.3Å; A129-F131 PolarHBondContact O-N 3.45Å; F131-Y134 PolarHBondContact O-N 3.4Å; F131-L135 HydrophobicContact CD1-CD1 3.68Å; F131-L135 HydrophobicContact CE1-CD1 3.31Å; F131-L135 HydrophobicContact CE2-CD1 4.22Å; F131-L135 HydrophobicContact CG-CD1 4.28Å; F131-L135 HydrophobicContact CZ-CD1 3.62Å; F131-L135 HydrophobicContact CZ-CG 4.46Å; F131-L135 WeakPolarHBondContact O-CB 3.4Å; F131-L135 WeakPolarHBondContact O-CG 3.33Å; F131-L135 PolarHBondContact O-N 2.65Å |
| 132 | I | 63.9 | Low | 66 | Low | 73 Ų | 73 | 85.1 Ų | 85.1 | 37% | 0.374 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -65 | -42.2 | 176.1 | -70.8 | -163.5 | 0 | 0 | 0 | 111.7 | F128 A129 L135 Y136 | F128-I132 HydrophobicContact CD1-CD1 3.73Å; F128-I132 HydrophobicContact CD1-CG1 4.19Å; F128-I132 HydrophobicContact CE1-CD1 3.35Å; F128-I132 HydrophobicContact CE1-CG1 4.07Å; F128-I132 HydrophobicContact CZ-CD1 4.14Å; F128-I132 PolarHBondContact O-N 3.09Å; A129-I132 PolarHBondContact O-N 3.31Å; I132-L135 PolarHBondContact O-N 3.3Å; I132-Y136 WeakPolarHBondContact O-CB 3.33Å; I132-Y136 PolarHBondContact O-N 2.96Å |
| 133 | L | 63.7 | Low | 67 | Low | 50 Ų | 50 | 85.1 Ų | 85.1 | 26% | 0.262 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -66 | -39.8 | 178.5 | -161.1 | 86.7 | 0 | 0 | 0 | 111.5 | L99 A129 Y136 K137 | L99-L133 HydrophobicContact CD2-CD1 3.98Å; A129-L133 VanDerWaalsContact O-CB 3.23Å; A129-L133 WeakPolarHBondContact O-CB 3.49Å; A129-L133 PolarHBondContact O-N 3.05Å; L133-Y136 PolarHBondContact O-N 3.42Å; L133-K137 HydrophobicContact CG-CD 4.48Å; L133-K137 WeakPolarHBondContact O-CB 3.46Å; L133-K137 PolarHBondContact O-N 3.38Å |
| 134 | Y | 66.1 | Low | 67.9 | Low | 147 Ų | 147 | 90.1 Ų | 90.1 | 58% | 0.576 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -62.4 | -47.3 | 174.7 | 175.2 | -98.1 | 0 | 0 | 0 | 111.4 | L130 F131 Y136 F138 F139 | L130-Y134 WeakPolarHBondContact O-CB 3.5Å; L130-Y134 PolarHBondContact O-N 3.41Å; F131-Y134 PolarHBondContact O-N 3.4Å; Y134-Y136 PolarHBondContact O-N 2.87Å; Y134-F138 HydrophobicContact CD2-CB 4.41Å; Y134-F138 AromaticContact CD2-CD2 3.97Å; Y134-F138 HydrophobicContact CD2-CD2 3.97Å; Y134-F138 HydrophobicContact CD2-CG 4.47Å; Y134-F138 HydrophobicContact CE2-CB 4.28Å; Y134-F138 HydrophobicContact CE2-CD2 4.37Å; Y134-F138 HydrophobicContact CE2-CG 4.47Å; Y134-F138 WeakPolarHBondContact O-CB 3.16Å; Y134-F138 PolarHBondContact O-N 3.39Å; Y134-F139 PolarHBondContact O-N 3.03Å |
| 135 | L | 62.3 | Low | 68.5 | Low | 58 Ų | 58 | 89.3 Ų | 89.3 | 30% | 0.304 | 44% | 0.437 | S | S | . | . | I | π-helix | trans | -58.2 | -48 | 174.8 | -82.7 | 162 | 0 | 0 | 0 | 111.6 | F131 I132 F139 L140 | F131-L135 HydrophobicContact CD1-CD1 3.68Å; F131-L135 HydrophobicContact CE1-CD1 3.31Å; F131-L135 HydrophobicContact CE2-CD1 4.22Å; F131-L135 HydrophobicContact CG-CD1 4.28Å; F131-L135 HydrophobicContact CZ-CD1 3.62Å; F131-L135 HydrophobicContact CZ-CG 4.46Å; F131-L135 WeakPolarHBondContact O-CB 3.4Å; F131-L135 WeakPolarHBondContact O-CG 3.33Å; F131-L135 PolarHBondContact O-N 2.65Å; I132-L135 PolarHBondContact O-N 3.3Å; L135-F139 HydrophobicContact CD2-CB 4.02Å; L135-F139 HydrophobicContact CD2-CD1 3.61Å; L135-F139 HydrophobicContact CD2-CE1 4.19Å; L135-F139 HydrophobicContact CD2-CG 3.94Å; L135-F139 WeakPolarHBondContact O-CA 3.32Å; L135-F139 WeakPolarHBondContact O-CB 3.49Å; L135-F139 PolarHBondContact O-N 2.94Å; L135-F139 VanDerWaalsContact O-N 3.13Å; L135-L140 PolarHBondContact O-N 3.5Å |
| 136 | Y | 68.4 | Low | 69.6 | Low | 161 Ų | 161 | 91.6 Ų | 91.6 | 63% | 0.631 | 45% | 0.449 | S | S | * | . | I | π-helix | trans | -70.1 | -42.8 | -177.1 | -173.6 | -97.1 | 0 | 0 | 0 | 112.9 | I132 L133 Y134 L140 P141 | I132-Y136 WeakPolarHBondContact O-CB 3.33Å; I132-Y136 PolarHBondContact O-N 2.96Å; L133-Y136 PolarHBondContact O-N 3.42Å; Y134-Y136 PolarHBondContact O-N 2.87Å; Y136-L140 HydrophobicContact CD2-CD2 3.88Å; Y136-L140 HydrophobicContact CE2-CD2 3.84Å; Y136-L140 WeakPolarHBondContact O-CB 3.45Å; Y136-P141 WeakPolarHBondContact O-CD 3.43Å |
| 137 | K | 67.8 | Low | 70.8 | Confident | 111 Ų | 111 | 91.7 Ų | 91.7 | 48% | 0.483 | 46% | 0.457 | S | S | . | . | I | π-helix | trans | -80.4 | -37.8 | -176.1 | -86.9 | -171.1 | 169 | 177.5 | 0 | 114.5 | L133 P141 | L133-K137 HydrophobicContact CG-CD 4.48Å; L133-K137 WeakPolarHBondContact O-CB 3.46Å; L133-K137 PolarHBondContact O-N 3.38Å; K137-P141 WeakPolarHBondContact O-CD 3.44Å; K137-P141 WeakPolarHBondContact O-CG 3.16Å |
| 138 | F | 65.2 | Low | 71.9 | Confident | 131 Ų | 131 | 95.2 Ų | 95.2 | 58% | 0.575 | 47% | 0.47 | S | S | * | . | I | π-helix | trans | -108.4 | -42 | -172.3 | -70.6 | -82 | 0 | 0 | 0 | 111.9 | Y134 T142 | Y134-F138 HydrophobicContact CD2-CB 4.41Å; Y134-F138 AromaticContact CD2-CD2 3.97Å; Y134-F138 HydrophobicContact CD2-CD2 3.97Å; Y134-F138 HydrophobicContact CD2-CG 4.47Å; Y134-F138 HydrophobicContact CE2-CB 4.28Å; Y134-F138 HydrophobicContact CE2-CD2 4.37Å; Y134-F138 HydrophobicContact CE2-CG 4.47Å; Y134-F138 WeakPolarHBondContact O-CB 3.16Å; Y134-F138 PolarHBondContact O-N 3.39Å; F138-T142 WeakPolarHBondContact O-CB 3.44Å; F138-T142 PolarHBondContact O-OG1 3.45Å |
| 139 | F | 67.2 | Low | 73.1 | Confident | 108 Ų | 108 | 95.5 Ų | 95.5 | 47% | 0.474 | 47% | 0.472 | S | S | . | . | I | π-helix | trans | -77.6 | -44.6 | -173.8 | -159.3 | -113.2 | 0 | 0 | 0 | 112 | Y134 L135 T142 I143 | Y134-F139 PolarHBondContact O-N 3.03Å; L135-F139 HydrophobicContact CD2-CB 4.02Å; L135-F139 HydrophobicContact CD2-CD1 3.61Å; L135-F139 HydrophobicContact CD2-CE1 4.19Å; L135-F139 HydrophobicContact CD2-CG 3.94Å; L135-F139 WeakPolarHBondContact O-CA 3.32Å; L135-F139 WeakPolarHBondContact O-CB 3.49Å; L135-F139 PolarHBondContact O-N 2.94Å; L135-F139 VanDerWaalsContact O-N 3.13Å; F139-T142 PolarHBondContact O-N 2.93Å; F139-I143 HydrophobicContact CD1-CD1 3.42Å; F139-I143 VanDerWaalsContact CD1-CD1 3.42Å; F139-I143 HydrophobicContact CD1-CG1 4.37Å; F139-I143 HydrophobicContact CD2-CD1 4.41Å; F139-I143 HydrophobicContact CE1-CD1 3.1Å; F139-I143 HydrophobicContact CE1-CG1 4.31Å; F139-I143 HydrophobicContact CE2-CD1 4.14Å; F139-I143 HydrophobicContact CG-CD1 4.09Å; F139-I143 HydrophobicContact CZ-CD1 3.5Å; F139-I143 HydrophobicContact CZ-CG1 4.47Å; F139-I143 WeakPolarHBondContact O-CG1 3.31Å; F139-I143 PolarHBondContact O-N 2.99Å |
| 140 | L | 74.3 | Confident | 74.7 | Confident | 95 Ų | 95 | 100 Ų | 100 | 50% | 0.497 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.1 | -46.8 | -176.5 | -167 | 68 | 0 | 0 | 0 | 113.6 | L135 Y136 T142 L144 | L135-L140 PolarHBondContact O-N 3.5Å; Y136-L140 HydrophobicContact CD2-CD2 3.88Å; Y136-L140 HydrophobicContact CE2-CD2 3.84Å; Y136-L140 WeakPolarHBondContact O-CB 3.45Å; L140-T142 VanDerWaalsContact C-N 3.32Å; L140-T142 PolarHBondContact O-N 3.44Å; L140-L144 VanDerWaalsContact O-CB 3.31Å; L140-L144 WeakPolarHBondContact O-CB 3.23Å; L140-L144 PolarHBondContact O-N 3.49Å |
| 141 | P | 78 | Confident | 76.2 | Confident | 70 Ų | 70 | 102 Ų | 102 | 46% | 0.455 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.6 | -35.6 | 177.8 | -21.3 | 35.7 | 0 | 0 | 0 | 112.1 | Y136 K137 L144 S145 | Y136-P141 WeakPolarHBondContact O-CD 3.43Å; K137-P141 WeakPolarHBondContact O-CD 3.44Å; K137-P141 WeakPolarHBondContact O-CG 3.16Å; P141-L144 PolarHBondContact O-N 3.44Å; P141-S145 VanDerWaalsContact O-CB 3.23Å; P141-S145 WeakPolarHBondContact O-CB 3.36Å; P141-S145 PolarHBondContact O-N 2.96Å |
| 142 | T | 75.8 | Confident | 77.7 | Confident | 94 Ų | 94 | 100.3 Ų | 100.3 | 58% | 0.577 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -67.1 | -46.1 | -179.9 | -55.7 | 0 | 0 | 0 | 0 | 111.3 | F138 F139 L140 S145 L146 | F138-T142 WeakPolarHBondContact O-CB 3.44Å; F138-T142 PolarHBondContact O-OG1 3.45Å; F139-T142 PolarHBondContact O-N 2.93Å; L140-T142 VanDerWaalsContact C-N 3.32Å; L140-T142 PolarHBondContact O-N 3.44Å; T142-S145 PolarHBondContact O-N 2.93Å; T142-L146 WeakPolarHBondContact O-CB 3.44Å; T142-L146 PolarHBondContact O-N 3.13Å |
| 143 | I | 80.7 | Confident | 79.1 | Confident | 81 Ų | 81 | 102 Ų | 102 | 42% | 0.415 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.9 | -43 | 176.6 | -71.2 | -179.2 | 0 | 0 | 0 | 111.1 | F139 S145 L146 S147 | F139-I143 HydrophobicContact CD1-CD1 3.42Å; F139-I143 VanDerWaalsContact CD1-CD1 3.42Å; F139-I143 HydrophobicContact CD1-CG1 4.37Å; F139-I143 HydrophobicContact CD2-CD1 4.41Å; F139-I143 HydrophobicContact CE1-CD1 3.1Å; F139-I143 HydrophobicContact CE1-CG1 4.31Å; F139-I143 HydrophobicContact CE2-CD1 4.14Å; F139-I143 HydrophobicContact CG-CD1 4.09Å; F139-I143 HydrophobicContact CZ-CD1 3.5Å; F139-I143 HydrophobicContact CZ-CG1 4.47Å; F139-I143 WeakPolarHBondContact O-CG1 3.31Å; F139-I143 PolarHBondContact O-N 2.99Å; I143-S145 VanDerWaalsContact C-N 3.34Å; I143-S145 PolarHBondContact O-N 3.36Å; I143-L146 PolarHBondContact O-N 3.47Å; I143-S147 WeakPolarHBondContact O-CB 3.48Å; I143-S147 PolarHBondContact O-N 3.44Å |
| 144 | L | 82.6 | Confident | 80.6 | Confident | 125 Ų | 125 | 104.9 Ų | 104.9 | 65% | 0.654 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.7 | -42.9 | 179.2 | -166.1 | 71.7 | 0 | 0 | 0 | 111.2 | L140 P141 S147 F148 | L140-L144 VanDerWaalsContact O-CB 3.31Å; L140-L144 WeakPolarHBondContact O-CB 3.23Å; L140-L144 PolarHBondContact O-N 3.49Å; P141-L144 PolarHBondContact O-N 3.44Å; L144-S147 PolarHBondContact O-N 2.88Å; L144-F148 WeakPolarHBondContact O-CB 3.45Å; L144-F148 PolarHBondContact O-N 3.42Å |
| 145 | S | 80.7 | Confident | 82 | Confident | 80 Ų | 80 | 103.1 Ų | 103.1 | 56% | 0.559 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -62 | -44 | 175.2 | -174.1 | 0 | 0 | 0 | 0 | 111.9 | P141 T142 I143 F148 F149 | P141-S145 VanDerWaalsContact O-CB 3.23Å; P141-S145 WeakPolarHBondContact O-CB 3.36Å; P141-S145 PolarHBondContact O-N 2.96Å; T142-S145 PolarHBondContact O-N 2.93Å; I143-S145 VanDerWaalsContact C-N 3.34Å; I143-S145 PolarHBondContact O-N 3.36Å; S145-F148 PolarHBondContact O-N 3.01Å; S145-F149 WeakPolarHBondContact O-CB 3.43Å; S145-F149 PolarHBondContact O-N 2.95Å |
| 146 | L | 87.3 | Confident | 83.5 | Confident | 103 Ų | 103 | 105.4 Ų | 105.4 | 54% | 0.539 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.4 | -43.6 | 178.6 | -175.2 | 66.1 | 0 | 0 | 0 | 111.3 | T142 I143 F148 F149 I150 | T142-L146 WeakPolarHBondContact O-CB 3.44Å; T142-L146 PolarHBondContact O-N 3.13Å; I143-L146 PolarHBondContact O-N 3.47Å; L146-F148 VanDerWaalsContact C-N 3.34Å; L146-F148 PolarHBondContact O-N 3.22Å; L146-F149 PolarHBondContact O-N 3.33Å; L146-I150 HydrophobicContact CG-CD1 4.21Å; L146-I150 WeakPolarHBondContact O-CG1 3.42Å; L146-I150 PolarHBondContact O-N 3.32Å |
| 147 | S | 89.8 | Confident | 84.9 | Confident | 74 Ų | 74 | 102.3 Ų | 102.3 | 52% | 0.517 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.8 | -40.9 | 177.5 | -174.2 | 0 | 0 | 0 | 0 | 111.8 | I143 L144 L151 | I143-S147 WeakPolarHBondContact O-CB 3.48Å; I143-S147 PolarHBondContact O-N 3.44Å; L144-S147 PolarHBondContact O-N 2.88Å; S147-L151 WeakPolarHBondContact O-CB 3.33Å; S147-L151 PolarHBondContact O-N 3.13Å; S147-L151 VanDerWaalsContact O-N 3.13Å |
| 148 | F | 89.6 | Confident | 86.2 | Confident | 138 Ų | 138 | 101.7 Ų | 101.7 | 61% | 0.605 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65.4 | -40.6 | 175.7 | -174.2 | -96.9 | 0 | 0 | 0 | 112 | L144 S145 L146 L151 L152 | L144-F148 WeakPolarHBondContact O-CB 3.45Å; L144-F148 PolarHBondContact O-N 3.42Å; S145-F148 PolarHBondContact O-N 3.01Å; L146-F148 VanDerWaalsContact C-N 3.34Å; L146-F148 PolarHBondContact O-N 3.22Å; F148-L151 PolarHBondContact O-N 3.42Å; F148-L152 WeakPolarHBondContact O-CB 3.45Å; F148-L152 PolarHBondContact O-N 2.95Å |
| 149 | F | 88.8 | Confident | 87.6 | Confident | 109 Ų | 109 | 102 Ų | 102 | 48% | 0.478 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.1 | -47.5 | 177.7 | -176.5 | -96 | 0 | 0 | 0 | 112.1 | S145 L146 L151 L152 E153 | S145-F149 WeakPolarHBondContact O-CB 3.43Å; S145-F149 PolarHBondContact O-N 2.95Å; L146-F149 PolarHBondContact O-N 3.33Å; F149-L151 VanDerWaalsContact C-N 3.32Å; F149-L151 PolarHBondContact O-N 3.05Å; F149-L152 PolarHBondContact O-N 3.27Å; F149-E153 VanDerWaalsContact CE1-CD 3.45Å; F149-E153 HydrophobicContact CE1-CG 4.06Å; F149-E153 WeakPolarHBondContact CE1-OE1 3.37Å; F149-E153 HydrophobicContact CZ-CG 4.21Å; F149-E153 WeakPolarHBondContact CZ-OE1 3.43Å; F149-E153 PolarHBondContact O-N 2.85Å |
| 150 | I | 92.4 | Very high | 89 | Confident | 97 Ų | 97 | 100.6 Ų | 100.6 | 50% | 0.497 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.1 | -42.5 | 177.1 | -65.9 | 166.4 | 0 | 0 | 0 | 111 | L146 L152 E153 L154 | L146-I150 HydrophobicContact CG-CD1 4.21Å; L146-I150 WeakPolarHBondContact O-CG1 3.42Å; L146-I150 PolarHBondContact O-N 3.32Å; I150-L152 VanDerWaalsContact C-N 3.33Å; I150-L152 PolarHBondContact O-N 3.41Å; I150-E153 PolarHBondContact O-N 2.95Å; I150-L154 WeakPolarHBondContact O-CB 3.34Å; I150-L154 PolarHBondContact O-N 2.91Å |
| 151 | L | 93.6 | Very high | 90.1 | Very high | 109 Ų | 109 | 99.9 Ų | 99.9 | 57% | 0.571 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.4 | -41.8 | 177.8 | -174.5 | 72.1 | 0 | 0 | 0 | 111.7 | S147 F148 F149 L154 L155 | S147-L151 WeakPolarHBondContact O-CB 3.33Å; S147-L151 PolarHBondContact O-N 3.13Å; S147-L151 VanDerWaalsContact O-N 3.13Å; F148-L151 PolarHBondContact O-N 3.42Å; F149-L151 VanDerWaalsContact C-N 3.32Å; F149-L151 PolarHBondContact O-N 3.05Å; L151-L154 PolarHBondContact O-N 3.41Å; L151-L155 WeakPolarHBondContact O-CB 3.4Å; L151-L155 PolarHBondContact O-N 2.88Å |
| 152 | L | 93.9 | Very high | 90.9 | Very high | 92 Ų | 92 | 100 Ų | 100 | 48% | 0.482 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.2 | -45 | 178.3 | -177 | 67.6 | 0 | 0 | 0 | 111.6 | F148 F149 I150 L155 L156 | F148-L152 WeakPolarHBondContact O-CB 3.45Å; F148-L152 PolarHBondContact O-N 2.95Å; F149-L152 PolarHBondContact O-N 3.27Å; I150-L152 VanDerWaalsContact C-N 3.33Å; I150-L152 PolarHBondContact O-N 3.41Å; L152-L155 PolarHBondContact O-N 3.49Å; L152-L156 WeakPolarHBondContact O-CB 3.28Å; L152-L156 PolarHBondContact O-N 2.91Å |
| 153 | E | 93.1 | Very high | 91.8 | Very high | 109 Ų | 109 | 100.6 Ų | 100.6 | 51% | 0.509 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.2 | -44.5 | 175.1 | -81.2 | -171 | 154.3 | 0 | 0 | 111.8 | F149 I150 L155 L156 L157 | F149-E153 VanDerWaalsContact CE1-CD 3.45Å; F149-E153 HydrophobicContact CE1-CG 4.06Å; F149-E153 WeakPolarHBondContact CE1-OE1 3.37Å; F149-E153 HydrophobicContact CZ-CG 4.21Å; F149-E153 WeakPolarHBondContact CZ-OE1 3.43Å; F149-E153 PolarHBondContact O-N 2.85Å; I150-E153 PolarHBondContact O-N 2.95Å; E153-L155 VanDerWaalsContact C-N 3.34Å; E153-L155 PolarHBondContact O-N 2.89Å; E153-L156 PolarHBondContact O-N 3.46Å; E153-L157 WeakPolarHBondContact O-CB 3.36Å; E153-L157 PolarHBondContact O-N 3.42Å |
| 154 | L | 95.3 | Very high | 92.5 | Very high | 110 Ų | 110 | 101 Ų | 101 | 58% | 0.576 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.8 | -43.1 | 177.7 | -176.5 | 67.5 | 0 | 0 | 0 | 111.6 | I150 L151 L157 L158 | I150-L154 WeakPolarHBondContact O-CB 3.34Å; I150-L154 PolarHBondContact O-N 2.91Å; L151-L154 PolarHBondContact O-N 3.41Å; L154-L157 PolarHBondContact O-N 3.48Å; L154-L158 WeakPolarHBondContact O-CB 3.42Å; L154-L158 PolarHBondContact O-N 3.45Å |
| 155 | L | 95.2 | Very high | 93 | Very high | 111 Ų | 111 | 100.9 Ų | 100.9 | 58% | 0.581 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.9 | -41.7 | 178.1 | -173 | 70.3 | 0 | 0 | 0 | 111.5 | L151 L152 E153 L158 F159 | L151-L155 WeakPolarHBondContact O-CB 3.4Å; L151-L155 PolarHBondContact O-N 2.88Å; L152-L155 PolarHBondContact O-N 3.49Å; E153-L155 VanDerWaalsContact C-N 3.34Å; E153-L155 PolarHBondContact O-N 2.89Å; L155-L158 PolarHBondContact O-N 3.4Å; L155-F159 WeakPolarHBondContact O-CB 3.49Å; L155-F159 PolarHBondContact O-N 3.31Å |
| 156 | L | 94.9 | Very high | 93.6 | Very high | 105 Ų | 105 | 101.2 Ų | 101.2 | 55% | 0.55 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.6 | -45.7 | 176 | -173.8 | 76.4 | 0 | 0 | 0 | 111 | L152 E153 L158 F159 I160 | L152-L156 WeakPolarHBondContact O-CB 3.28Å; L152-L156 PolarHBondContact O-N 2.91Å; E153-L156 PolarHBondContact O-N 3.46Å; L156-L158 PolarHBondContact O-N 3.33Å; L156-F159 WeakPolarHBondContact O-CB 3.31Å; L156-F159 PolarHBondContact O-N 3.24Å; L156-I160 HydrophobicContact CG-CD1 4.14Å; L156-I160 VanDerWaalsContact O-CG1 3.28Å; L156-I160 WeakPolarHBondContact O-CG1 3.23Å; L156-I160 PolarHBondContact O-N 3Å |
| 157 | L | 95.9 | Very high | 93.5 | Very high | 96 Ų | 96 | 103.4 Ų | 103.4 | 50% | 0.503 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.3 | -46.8 | 177 | -178.1 | 68.1 | 0 | 0 | 0 | 111.1 | E153 L154 F159 I160 I161 | E153-L157 WeakPolarHBondContact O-CB 3.36Å; E153-L157 PolarHBondContact O-N 3.42Å; L154-L157 PolarHBondContact O-N 3.48Å; L157-F159 VanDerWaalsContact C-N 3.3Å; L157-F159 PolarHBondContact O-N 2.89Å; L157-I160 PolarHBondContact O-N 3.46Å; L157-I161 HydrophobicContact CD1-CD1 4.46Å; L157-I161 HydrophobicContact CG-CD1 4.04Å; L157-I161 WeakPolarHBondContact O-CG1 3.41Å; L157-I161 PolarHBondContact O-N 3.49Å |
| 158 | L | 95.9 | Very high | 92.9 | Very high | 99 Ų | 99 | 111 Ų | 111 | 52% | 0.518 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -59.5 | -44.2 | 176.4 | -177.2 | 68.1 | 0 | 0 | 0 | 111.1 | L154 L155 L156 I160 I161 V162 | L154-L158 WeakPolarHBondContact O-CB 3.42Å; L154-L158 PolarHBondContact O-N 3.45Å; L155-L158 PolarHBondContact O-N 3.4Å; L156-L158 PolarHBondContact O-N 3.33Å; L158-I160 VanDerWaalsContact C-N 3.34Å; L158-I160 PolarHBondContact O-N 3.34Å; L158-I161 PolarHBondContact O-N 2.82Å; L158-V162 HydrophobicContact CD1-CG2 4.42Å; L158-V162 HydrophobicContact CG-CG2 4.43Å; L158-V162 WeakPolarHBondContact O-CB 3.18Å; L158-V162 VanDerWaalsContact O-CG2 3.31Å; L158-V162 WeakPolarHBondContact O-CG2 3.47Å; L158-V162 PolarHBondContact O-N 3.43Å |
| 159 | F | 95.3 | Very high | 93.1 | Very high | 138 Ų | 138 | 109.6 Ų | 109.6 | 61% | 0.605 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -59.5 | -44.7 | 176.7 | -179.8 | -96.5 | 0 | 0 | 0 | 111.7 | L155 L156 L157 I161 V162 F163 | L155-F159 WeakPolarHBondContact O-CB 3.49Å; L155-F159 PolarHBondContact O-N 3.31Å; L156-F159 WeakPolarHBondContact O-CB 3.31Å; L156-F159 PolarHBondContact O-N 3.24Å; L157-F159 VanDerWaalsContact C-N 3.3Å; L157-F159 PolarHBondContact O-N 2.89Å; F159-I161 PolarHBondContact O-N 2.95Å; F159-V162 PolarHBondContact O-N 3.26Å; F159-F163 WeakPolarHBondContact O-CB 3.27Å; F159-F163 PolarHBondContact O-N 3.41Å |
| 160 | I | 96 | Very high | 93.3 | Very high | 77 Ų | 77 | 109.6 Ų | 109.6 | 40% | 0.395 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.2 | -45.2 | 176.5 | -67.6 | 163.2 | 0 | 0 | 0 | 110.8 | L156 L157 L158 F163 I164 | L156-I160 HydrophobicContact CG-CD1 4.14Å; L156-I160 VanDerWaalsContact O-CG1 3.28Å; L156-I160 WeakPolarHBondContact O-CG1 3.23Å; L156-I160 PolarHBondContact O-N 3Å; L157-I160 PolarHBondContact O-N 3.46Å; L158-I160 VanDerWaalsContact C-N 3.34Å; L158-I160 PolarHBondContact O-N 3.34Å; I160-F163 WeakPolarHBondContact O-CB 3.33Å; I160-F163 PolarHBondContact O-N 2.93Å; I160-I164 HydrophobicContact CG2-CD1 3.78Å; I160-I164 HydrophobicContact CG2-CG1 4.44Å; I160-I164 VanDerWaalsContact O-CG1 3.27Å; I160-I164 WeakPolarHBondContact O-CG1 3.41Å; I160-I164 PolarHBondContact O-N 2.89Å |
| 161 | I | 96.3 | Very high | 93.4 | Very high | 80 Ų | 80 | 110.3 Ų | 110.3 | 41% | 0.41 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -61.7 | -48.7 | 178.7 | -68.8 | 165.8 | 0 | 0 | 0 | 110.8 | L157 L158 F159 F163 I164 L165 | L157-I161 HydrophobicContact CD1-CD1 4.46Å; L157-I161 HydrophobicContact CG-CD1 4.04Å; L157-I161 WeakPolarHBondContact O-CG1 3.41Å; L157-I161 PolarHBondContact O-N 3.49Å; L158-I161 PolarHBondContact O-N 2.82Å; F159-I161 PolarHBondContact O-N 2.95Å; I161-F163 VanDerWaalsContact C-N 3.31Å; I161-F163 PolarHBondContact O-N 2.71Å; I161-I164 PolarHBondContact O-N 2.92Å; I161-L165 HydrophobicContact CG2-CD1 3.71Å; I161-L165 WeakPolarHBondContact O-CB 3.33Å; I161-L165 WeakPolarHBondContact O-CG 3.49Å; I161-L165 PolarHBondContact O-N 3.09Å |
| 162 | V | 96.2 | Very high | 93.3 | Very high | 74 Ų | 74 | 110.4 Ų | 110.4 | 45% | 0.448 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -62.6 | -40.5 | 178.2 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | L158 F159 L165 S166 | L158-V162 HydrophobicContact CD1-CG2 4.42Å; L158-V162 HydrophobicContact CG-CG2 4.43Å; L158-V162 WeakPolarHBondContact O-CB 3.18Å; L158-V162 VanDerWaalsContact O-CG2 3.31Å; L158-V162 WeakPolarHBondContact O-CG2 3.47Å; L158-V162 PolarHBondContact O-N 3.43Å; F159-V162 PolarHBondContact O-N 3.26Å; V162-L165 PolarHBondContact O-N 3.23Å; V162-S166 WeakPolarHBondContact O-CB 3.44Å; V162-S166 PolarHBondContact O-N 3.42Å; V162-S166 PolarHBondContact O-OG 3.15Å |
| 163 | F | 94.4 | Very high | 93.3 | Very high | 105 Ų | 105 | 111.6 Ų | 111.6 | 46% | 0.461 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -59.7 | -51.7 | 175.4 | -179.3 | -90.9 | 0 | 0 | 0 | 110.5 | F159 I160 I161 L165 S166 F167 | F159-F163 WeakPolarHBondContact O-CB 3.27Å; F159-F163 PolarHBondContact O-N 3.41Å; I160-F163 WeakPolarHBondContact O-CB 3.33Å; I160-F163 PolarHBondContact O-N 2.93Å; I161-F163 VanDerWaalsContact C-N 3.31Å; I161-F163 PolarHBondContact O-N 2.71Å; F163-L165 PolarHBondContact O-N 3.2Å; F163-S166 PolarHBondContact O-N 2.85Å; F163-S166 VanDerWaalsContact O-N 3.09Å; F163-F167 HydrophobicContact CD1-CD2 4.12Å; F163-F167 AromaticContact CD2-CD2 3.66Å; F163-F167 HydrophobicContact CD2-CD2 3.66Å; F163-F167 AromaticContact CD2-CE2 3.43Å; F163-F167 HydrophobicContact CD2-CE2 3.43Å; F163-F167 VanDerWaalsContact CD2-CE2 3.43Å; F163-F167 AromaticContact CE1-CD2 3.98Å; F163-F167 HydrophobicContact CE1-CD2 3.98Å; F163-F167 HydrophobicContact CE1-CE2 4.47Å; F163-F167 AromaticContact CE2-CD2 3.5Å; F163-F167 HydrophobicContact CE2-CD2 3.5Å; F163-F167 AromaticContact CE2-CE2 3.16Å; F163-F167 HydrophobicContact CE2-CE2 3.16Å; F163-F167 HydrophobicContact CE2-CZ 4.05Å; F163-F167 AromaticContact CG-CD2 3.96Å; F163-F167 HydrophobicContact CG-CD2 3.96Å; F163-F167 HydrophobicContact CG-CE2 4.2Å; F163-F167 AromaticContact CZ-CD2 3.66Å; F163-F167 HydrophobicContact CZ-CD2 3.66Å; F163-F167 AromaticContact CZ-CE2 3.75Å; F163-F167 HydrophobicContact CZ-CE2 3.75Å; F163-F167 HydrophobicContact CZ-CG 4.47Å; F163-F167 VanDerWaalsContact O-CD2 3.23Å; F163-F167 WeakPolarHBondContact O-CD2 3.43Å; F163-F167 PolarHBondContact O-N 3.41Å; F163-F167 VanDerWaalsContact O-N 3.15Å |
| 164 | I | 95.6 | Very high | 93.3 | Very high | 90 Ų | 90 | 111.7 Ų | 111.7 | 46% | 0.462 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -57.1 | -50.1 | 177.4 | -66.5 | 164.8 | 0 | 0 | 0 | 110.4 | I160 I161 S166 F167 F168 | I160-I164 HydrophobicContact CG2-CD1 3.78Å; I160-I164 HydrophobicContact CG2-CG1 4.44Å; I160-I164 VanDerWaalsContact O-CG1 3.27Å; I160-I164 WeakPolarHBondContact O-CG1 3.41Å; I160-I164 PolarHBondContact O-N 2.89Å; I161-I164 PolarHBondContact O-N 2.92Å; I164-S166 PolarHBondContact O-N 3.18Å; I164-F167 PolarHBondContact O-N 2.92Å; I164-F168 HydrophobicContact CG2-CB 4.44Å; I164-F168 WeakPolarHBondContact O-CB 3.42Å; I164-F168 PolarHBondContact O-N 3.31Å |
| 165 | L | 93.7 | Very high | 93.2 | Very high | 123 Ų | 123 | 111.9 Ų | 111.9 | 64% | 0.644 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -61.2 | -24.9 | 178.1 | -77.9 | 162.2 | 0 | 0 | 0 | 114.5 | I161 V162 F163 | I161-L165 HydrophobicContact CG2-CD1 3.71Å; I161-L165 WeakPolarHBondContact O-CB 3.33Å; I161-L165 WeakPolarHBondContact O-CG 3.49Å; I161-L165 PolarHBondContact O-N 3.09Å; V162-L165 PolarHBondContact O-N 3.23Å; F163-L165 PolarHBondContact O-N 3.2Å |
| 166 | S | 92.8 | Very high | 93 | Very high | 86 Ų | 86 | 111.9 Ų | 111.9 | 60% | 0.601 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -84.8 | -25.1 | 179.9 | -59.4 | 0 | 0 | 0 | 0 | 112.4 | V162 F163 I164 | V162-S166 WeakPolarHBondContact O-CB 3.44Å; V162-S166 PolarHBondContact O-N 3.42Å; V162-S166 PolarHBondContact O-OG 3.15Å; F163-S166 PolarHBondContact O-N 2.85Å; F163-S166 VanDerWaalsContact O-N 3.09Å; I164-S166 PolarHBondContact O-N 3.18Å |
| 167 | F | 84.6 | Confident | 92.9 | Very high | 149 Ų | 149 | 112.5 Ų | 112.5 | 65% | 0.654 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -111.3 | -19.1 | -173.4 | -73.7 | -74.8 | 0 | 0 | 0 | 114.3 | F163 I164 | F163-F167 HydrophobicContact CD1-CD2 4.12Å; F163-F167 AromaticContact CD2-CD2 3.66Å; F163-F167 HydrophobicContact CD2-CD2 3.66Å; F163-F167 AromaticContact CD2-CE2 3.43Å; F163-F167 HydrophobicContact CD2-CE2 3.43Å; F163-F167 VanDerWaalsContact CD2-CE2 3.43Å; F163-F167 AromaticContact CE1-CD2 3.98Å; F163-F167 HydrophobicContact CE1-CD2 3.98Å; F163-F167 HydrophobicContact CE1-CE2 4.47Å; F163-F167 AromaticContact CE2-CD2 3.5Å; F163-F167 HydrophobicContact CE2-CD2 3.5Å; F163-F167 AromaticContact CE2-CE2 3.16Å; F163-F167 HydrophobicContact CE2-CE2 3.16Å; F163-F167 HydrophobicContact CE2-CZ 4.05Å; F163-F167 AromaticContact CG-CD2 3.96Å; F163-F167 HydrophobicContact CG-CD2 3.96Å; F163-F167 HydrophobicContact CG-CE2 4.2Å; F163-F167 AromaticContact CZ-CD2 3.66Å; F163-F167 HydrophobicContact CZ-CD2 3.66Å; F163-F167 AromaticContact CZ-CE2 3.75Å; F163-F167 HydrophobicContact CZ-CE2 3.75Å; F163-F167 HydrophobicContact CZ-CG 4.47Å; F163-F167 VanDerWaalsContact O-CD2 3.23Å; F163-F167 WeakPolarHBondContact O-CD2 3.43Å; F163-F167 PolarHBondContact O-N 3.41Å; F163-F167 VanDerWaalsContact O-N 3.15Å; I164-F167 PolarHBondContact O-N 2.92Å |
| 168 | F | 77.4 | Confident | 92.6 | Very high | 233 Ų | 233 | 114 Ų | 114 | 100% | 1.022 | 57% | 0.565 | S | S | * | * | trans | -114.6 | 0 | 174.6 | -100.2 | -85.1 | 0 | 0 | 0 | 110.7 | I164 | I164-F168 HydrophobicContact CG2-CB 4.44Å; I164-F168 WeakPolarHBondContact O-CB 3.42Å; I164-F168 PolarHBondContact O-N 3.31Å |
Retrieved 168 of 168 residues in 310.1 ms
(Link to these results)