| 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 | 37.5 | Very low | 38.7 | Very low | 227 Ų | 227 | 152.7 Ų | 152.7 | 100% | 1.118 | 81% | 0.81 | S | S | * | * | 0 | 108.4 | 0 | -65.5 | 134.1 | 68.4 | 0 | 0 | 106.2 | |||||
| 2 | I | 37.1 | Very low | 38.2 | Very low | 147 Ų | 147 | 146.6 Ų | 146.6 | 75% | 0.754 | 81% | 0.81 | S | S | * | * | cis | 93.4 | 109.5 | 37.7 | -61.8 | 170.9 | 0 | 0 | 0 | 112.3 | ||||
| 3 | Q | 36.3 | Very low | 37.8 | Very low | 184 Ų | 184 | 148.8 Ų | 148.8 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | trans | 73.1 | 163.8 | 153.5 | -76.4 | 173.9 | -69.8 | 0 | 0 | 122.2 | ||||
| 4 | S | 44.2 | Very low | 37.9 | Very low | 92 Ų | 92 | 150.3 Ų | 150.3 | 64% | 0.643 | 82% | 0.818 | S | S | * | * | trans | -134.3 | 164.8 | -147.8 | -29 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 5 | D | 47.2 | Very low | 37.7 | Very low | 151 Ų | 151 | 155.7 Ų | 155.7 | 81% | 0.807 | 82% | 0.822 | S | S | * | * | trans | 69.5 | 169.2 | 147.6 | -64.1 | -51.4 | 0 | 0 | 0 | 121.3 | ||||
| 6 | I | 41.4 | Very low | 37.5 | Very low | 161 Ų | 161 | 153.7 Ų | 153.7 | 83% | 0.826 | 82% | 0.824 | S | S | * | * | trans | 98.3 | 108.7 | 163.1 | -53.7 | 173.4 | 0 | 0 | 0 | 117.6 | ||||
| 7 | L | 38.7 | Very low | 37.3 | Very low | 159 Ų | 159 | 152.2 Ų | 152.2 | 83% | 0.832 | 83% | 0.828 | S | S | * | * | trans | -77.4 | 157.3 | 152.8 | -88.3 | 89.9 | 0 | 0 | 0 | 109.6 | ||||
| 8 | P | 48.7 | Very low | 36.9 | Very low | 109 Ų | 109 | 147.3 Ų | 147.3 | 71% | 0.708 | 82% | 0.82 | S | S | * | * | -161 | -173.6 | 50.1 | 43.8 | -20.7 | 0 | 0 | 0 | 119.4 | |||||
| 9 | K | 33 | Very low | 36.6 | Very low | 181 Ų | 181 | 148.6 Ų | 148.6 | 79% | 0.787 | 82% | 0.824 | S | S | * | * | trans | 52.8 | 136 | 141.2 | -90.5 | -177.2 | 171.7 | -178.1 | 0 | 124.5 | ||||
| 10 | M | 29.2 | Very low | 36.5 | Very low | 151 Ų | 151 | 146.4 Ų | 146.4 | 74% | 0.744 | 82% | 0.819 | S | S | * | * | trans | 91.2 | 106.6 | 135.8 | -75.1 | 172 | 63.2 | 0 | 0 | 123.3 | ||||
| 11 | S | 33 | Very low | 36.3 | Very low | 118 Ų | 118 | 147.2 Ų | 147.2 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | 67.6 | 119.5 | 121.2 | -56.1 | 0 | 0 | 0 | 0 | 124.1 | |||||
| 12 | G | 31.9 | Very low | 35.9 | Very low | 79 Ų | 79 | 144.8 Ų | 144.8 | 81% | 0.814 | 80% | 0.802 | S | S | * | * | trans | 126.2 | 149.4 | 145.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 13 | M | 33.2 | Very low | 35.5 | Very low | 175 Ų | 175 | 148.4 Ų | 148.4 | 86% | 0.862 | 81% | 0.806 | S | S | * | * | cis | -169.7 | 110.9 | -11.4 | 172.4 | -175.5 | 60.5 | 0 | 0 | 111.3 | ||||
| 14 | I | 39.2 | Very low | 35.4 | Very low | 170 Ų | 170 | 144.9 Ų | 144.9 | 87% | 0.872 | 80% | 0.801 | S | S | * | * | trans | -151.9 | 138.8 | 157.7 | -51.3 | -179.9 | 0 | 0 | 0 | 107.7 | ||||
| 15 | R | 35 | Very low | 35.4 | Very low | 232 Ų | 232 | 146.1 Ų | 146.1 | 88% | 0.875 | 81% | 0.807 | S | S | * | * | cis | 167.8 | 83.5 | -30 | 178.6 | -165.1 | -169.7 | -166 | 5.3 | 106.4 | ||||
| 16 | S | 34.3 | Very low | 34.8 | Very low | 123 Ų | 123 | 147.4 Ų | 147.4 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | trans | -166.8 | 109.6 | 160.2 | 45.4 | 0 | 0 | 0 | 0 | 113 | ||||
| 17 | S | 34.2 | Very low | 34.2 | Very low | 128 Ų | 128 | 146.7 Ų | 146.7 | 90% | 0.895 | 80% | 0.802 | S | S | * | * | trans | -89.6 | 161.7 | 161.7 | -49.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 18 | G | 31 | Very low | 33.9 | Very low | 65 Ų | 65 | 150.3 Ų | 150.3 | 67% | 0.67 | 81% | 0.806 | S | S | * | * | cis | 169.6 | -153.5 | 1.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 19 | L | 31 | Very low | 33.2 | Very low | 171 Ų | 171 | 155.8 Ų | 155.8 | 90% | 0.895 | 81% | 0.812 | S | S | * | * | trans | 68.6 | 100.7 | 176 | -74.5 | 80.7 | 0 | 0 | 0 | 118 | ||||
| 20 | S | 33.9 | Very low | 33.1 | Very low | 104 Ų | 104 | 155 Ų | 155 | 73% | 0.727 | 82% | 0.816 | S | S | * | * | trans | -88 | 151.3 | 139.7 | 51.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 21 | H | 32.7 | Very low | 33.5 | Very low | 165 Ų | 165 | 154.7 Ų | 154.7 | 76% | 0.764 | 82% | 0.817 | S | S | * | * | trans | -177.2 | 145.7 | 150.5 | -101.6 | -62.2 | 0 | 0 | 0 | 115.6 | ||||
| 22 | H | 29.6 | Very low | 33.9 | Very low | 175 Ų | 175 | 154.7 Ų | 154.7 | 81% | 0.81 | 81% | 0.814 | S | S | * | * | trans | 74.3 | 170.8 | 150.3 | -81.9 | -69.5 | 0 | 0 | 0 | 123.7 | ||||
| 23 | R | 27.6 | Very low | 34 | Very low | 224 Ų | 224 | 155.8 Ų | 155.8 | 85% | 0.845 | 81% | 0.805 | S | S | * | * | trans | -160.6 | 138.7 | -148.3 | 170 | -171.5 | 178.7 | -164.7 | 1 | 111.2 | ||||
| 24 | S | 34.8 | Very low | 33.8 | Very low | 109 Ų | 109 | 156.2 Ų | 156.2 | 76% | 0.762 | 81% | 0.807 | S | S | * | * | trans | 67.9 | 167 | 172.2 | 88.9 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 25 | P | 44.5 | Very low | 33.5 | Very low | 119 Ų | 119 | 151.7 Ų | 151.7 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | cis | -119.1 | -164.3 | 23.8 | 43.7 | -31.1 | 0 | 0 | 0 | 116.2 | ||||
| 26 | Q | 33.6 | Very low | 33.6 | Very low | 178 Ų | 178 | 148 Ų | 148 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | trans | -82.7 | -178.7 | 175.6 | -53.3 | 152.3 | -72 | 0 | 0 | 110.2 | ||||
| 27 | E | 29.6 | Very low | 34.1 | Very low | 146 Ų | 146 | 149.8 Ų | 149.8 | 68% | 0.682 | 80% | 0.8 | S | S | * | * | cis | -142.6 | 174.4 | 11.1 | -58.2 | 179.1 | 104.1 | 0 | 0 | 110.6 | ||||
| 28 | Y | 32.5 | Very low | 34.2 | Very low | 235 Ų | 235 | 150.9 Ų | 150.9 | 92% | 0.922 | 80% | 0.796 | S | S | * | * | -176.6 | 164.1 | 122.5 | -83.7 | -51.5 | 0 | 0 | 0 | 110.1 | |||||
| 29 | R | 33.1 | Very low | 34.8 | Very low | 223 Ų | 223 | 155.5 Ų | 155.5 | 84% | 0.842 | 80% | 0.804 | S | S | * | * | trans | -133.9 | 145.2 | -155.9 | 160.4 | -168.1 | -80.5 | 147.2 | -6.9 | 112.4 | ||||
| 30 | L | 32 | Very low | 35.4 | Very low | 166 Ų | 166 | 153 Ų | 153 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | trans | -176.4 | 161.5 | 133 | -98.6 | 166.1 | 0 | 0 | 0 | 113 | ||||
| 31 | L | 36.3 | Very low | 36 | Very low | 144 Ų | 144 | 151.4 Ų | 151.4 | 75% | 0.754 | 80% | 0.798 | S | S | * | * | trans | -122.8 | 154.8 | -176.1 | -113.3 | 166.6 | 0 | 0 | 0 | 109 | ||||
| 32 | P | 42.8 | Very low | 36.7 | Very low | 118 Ų | 118 | 149.9 Ų | 149.9 | 77% | 0.766 | 80% | 0.796 | S | S | * | * | -149.1 | -169.9 | 80.9 | 38.2 | -19.1 | 0 | 0 | 0 | 114.4 | |||||
| 33 | T | 32 | Very low | 37.4 | Very low | 102 Ų | 102 | 148.8 Ų | 148.8 | 63% | 0.626 | 80% | 0.795 | S | S | * | * | cis | -176 | 151.1 | -45.6 | -67.9 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 34 | M | 31.1 | Very low | 38.4 | Very low | 183 Ų | 183 | 146.4 Ų | 146.4 | 90% | 0.901 | 79% | 0.793 | S | S | * | * | trans | 91.8 | 132.3 | 172.7 | -56.4 | -54.9 | -170.4 | 0 | 0 | 118.6 | ||||
| 35 | G | 30.9 | Very low | 38.9 | Very low | 75 Ų | 75 | 145 Ų | 145 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | trans | 136.9 | 79.7 | 167.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 36 | D | 38.2 | Very low | 39.1 | Very low | 154 Ų | 154 | 144.6 Ų | 144.6 | 82% | 0.824 | 78% | 0.775 | S | S | * | * | trans | -85 | -179.6 | 171.4 | -73.8 | -91.4 | 0 | 0 | 0 | 112 | ||||
| 37 | D | 44.7 | Very low | 39.9 | Very low | 162 Ų | 162 | 140 Ų | 140 | 87% | 0.866 | 76% | 0.762 | S | S | * | * | trans | 67.8 | 83.8 | 177.1 | -64.6 | -57.7 | 0 | 0 | 0 | 117.6 | ||||
| 38 | D | 36.1 | Very low | 40.7 | Very low | 151 Ų | 151 | 142.3 Ų | 142.3 | 81% | 0.807 | 76% | 0.764 | S | S | * | * | -167.3 | 136 | 106.6 | -156 | -75.9 | 0 | 0 | 0 | 110 | |||||
| 39 | L | 44.2 | Very low | 41.5 | Very low | 162 Ų | 162 | 136.4 Ų | 136.4 | 85% | 0.848 | 75% | 0.748 | S | S | * | * | trans | -138.6 | 122.1 | -177.4 | -147.6 | 87.1 | 0 | 0 | 0 | 111.6 | G41 | L39-G41 PolarHBondContact O-N 3.08Š| ||
| 40 | P | 43.3 | Very low | 42.3 | Very low | 117 Ų | 117 | 131.3 Ų | 131.3 | 76% | 0.76 | 74% | 0.742 | S | S | * | * | trans | -78.5 | 90.8 | -165 | 29.6 | -36.7 | 0 | 0 | 0 | 114.8 | D42 | P40-D42 VanDerWaalsContact C-N 3.31Å; P40-D42 PolarHBondContact O-N 3.45Å | ||
| 41 | G | 45.7 | Very low | 42.9 | Very low | 71 Ų | 71 | 128 Ų | 128 | 73% | 0.732 | 73% | 0.733 | S | S | * | * | S | Bend | 63.1 | -27.9 | 126.7 | 0 | 0 | 0 | 0 | 0 | 122.8 | L39 L43 | L39-G41 PolarHBondContact O-N 3.08Å; G41-L43 PolarHBondContact O-N 3.37Å | |
| 42 | D | 47.7 | Very low | 43.6 | Very low | 133 Ų | 133 | 126.3 Ų | 126.3 | 71% | 0.711 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.5 | 29.8 | -158.2 | -158.3 | 26.3 | 0 | 0 | 0 | 115.6 | P40 | P40-D42 VanDerWaalsContact C-N 3.31Å; P40-D42 PolarHBondContact O-N 3.45Å |
| 43 | L | 45.9 | Very low | 43.8 | Very low | 153 Ų | 153 | 125.1 Ų | 125.1 | 80% | 0.801 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.3 | -2.9 | 175.8 | -72.9 | 177.6 | 0 | 0 | 0 | 115.1 | G41 S45 | G41-L43 PolarHBondContact O-N 3.37Å; L43-S45 VanDerWaalsContact C-N 3.34Å |
| 44 | Q | 48.5 | Very low | 45 | Very low | 173 Ų | 173 | 124.7 Ų | 124.7 | 81% | 0.808 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -76.3 | -21.1 | 174.9 | -72.2 | -173.5 | -14.2 | 0 | 0 | 113.4 | L46 S47 | Q44-L46 PolarHBondContact O-N 3.29Å; Q44-S47 PolarHBondContact O-N 3.21Å |
| 45 | S | 44.2 | Very low | 45.9 | Very low | 81 Ų | 81 | 120.6 Ų | 120.6 | 57% | 0.566 | 70% | 0.699 | S | S | * | * | G | 310 helix | trans | -66.7 | -1.8 | -175.2 | -55.3 | 0 | 0 | 0 | 0 | 115.9 | L43 W48 | L43-S45 VanDerWaalsContact C-N 3.34Å; S45-W48 VanDerWaalsContact O-CD1 3.3Å; S45-W48 PolarHBondContact O-NE1 3.27Å |
| 46 | L | 48.9 | Very low | 46.7 | Very low | 110 Ų | 110 | 125.2 Ų | 125.2 | 58% | 0.576 | 69% | 0.693 | S | S | * | * | G | 310 helix | trans | -105.9 | -2.1 | 179.3 | -64.8 | 177.2 | 0 | 0 | 0 | 114.4 | Q44 W48 L49 | Q44-L46 PolarHBondContact O-N 3.29Å; L46-W48 PolarHBondContact O-N 3.48Å; L46-W48 VanDerWaalsContact O-N 3.13Å; L46-L49 PolarHBondContact O-N 3.38Å; L46-L49 VanDerWaalsContact O-N 3.16Å |
| 47 | S | 51.3 | Low | 47.4 | Very low | 80 Ų | 80 | 123.2 Ų | 123.2 | 56% | 0.559 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -58.2 | -29.1 | -176 | -166.8 | 0 | 0 | 0 | 0 | 114.2 | Q44 L49 S51 | Q44-S47 PolarHBondContact O-N 3.21Å; S47-L49 PolarHBondContact O-N 3.06Å; S47-L49 VanDerWaalsContact O-N 3.16Å; S47-S51 PolarHBondContact O-OG 2.97Å |
| 48 | W | 46.3 | Very low | 47.7 | Very low | 195 Ų | 195 | 122.1 Ų | 122.1 | 74% | 0.739 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -67.8 | -12.2 | -179.7 | 66.5 | -89.6 | 0 | 0 | 0 | 114.9 | S45 L46 | S45-W48 VanDerWaalsContact O-CD1 3.3Å; S45-W48 PolarHBondContact O-NE1 3.27Å; L46-W48 PolarHBondContact O-N 3.48Å; L46-W48 VanDerWaalsContact O-N 3.13Å |
| 49 | L | 47.5 | Very low | 48.5 | Very low | 111 Ų | 111 | 122.5 Ų | 122.5 | 58% | 0.581 | 67% | 0.669 | S | S | * | * | G | 310 helix | trans | -98.4 | -1.5 | -171.9 | -121.6 | 161.5 | 0 | 0 | 0 | 114.3 | L46 S47 | L46-L49 PolarHBondContact O-N 3.38Å; L46-L49 VanDerWaalsContact O-N 3.16Å; S47-L49 PolarHBondContact O-N 3.06Å; S47-L49 VanDerWaalsContact O-N 3.16Å |
| 50 | T | 50.6 | Low | 48.8 | Very low | 117 Ų | 117 | 121.3 Ų | 121.3 | 72% | 0.718 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.8 | -1.9 | -179.3 | 58.9 | 0 | 0 | 0 | 0 | 115.3 | V52 | T50-V52 VanDerWaalsContact C-N 3.31Å; T50-V52 PolarHBondContact O-N 3.39Å |
| 51 | S | 45.8 | Very low | 49.1 | Very low | 96 Ų | 96 | 119.8 Ų | 119.8 | 67% | 0.671 | 66% | 0.658 | S | S | * | * | trans | -75.6 | 75.9 | 178.9 | -63.8 | 0 | 0 | 0 | 0 | 112.9 | S47 D53 | S47-S51 PolarHBondContact O-OG 2.97Å; S51-D53 PolarHBondContact O-N 2.95Å | ||
| 52 | V | 50.9 | Low | 49.3 | Very low | 109 Ų | 109 | 121.5 Ų | 121.5 | 66% | 0.661 | 66% | 0.659 | S | S | * | * | trans | -73.8 | 117.5 | 161.7 | 178.9 | 0 | 0 | 0 | 0 | 108.3 | T50 V54 | T50-V52 VanDerWaalsContact C-N 3.31Å; T50-V52 PolarHBondContact O-N 3.39Å; V52-V54 VanDerWaalsContact C-N 3.33Å; V52-V54 PolarHBondContact O-N 2.76Å | ||
| 53 | D | 45.3 | Very low | 49.1 | Very low | 93 Ų | 93 | 118.4 Ų | 118.4 | 50% | 0.497 | 66% | 0.658 | S | S | . | * | trans | -76 | 78.4 | -177.3 | -173.5 | 12.8 | 0 | 0 | 0 | 111.4 | S51 P55 R56 L57 | S51-D53 PolarHBondContact O-N 2.95Å; D53-P55 VanDerWaalsContact C-CD 3.49Å; D53-R56 HydrophobicContact CB-CB 4.3Å; D53-R56 PolarHBondContact O-N 2.92Å; D53-R56 VanDerWaalsContact O-N 3.09Å; D53-R56 WeakPolarHBondContact OD2-CB 3.3Å; D53-R56 WeakPolarHBondContact OD2-CD 3.26Å; D53-L57 PolarHBondContact O-N 3.25Å | ||
| 54 | V | 57.2 | Low | 48.7 | Very low | 93 Ų | 93 | 122.1 Ų | 122.1 | 56% | 0.564 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -52.9 | -44.4 | -173 | -179 | 0 | 0 | 0 | 0 | 113.8 | V52 R56 L57 Q58 | V52-V54 VanDerWaalsContact C-N 3.33Å; V52-V54 PolarHBondContact O-N 2.76Å; V54-R56 VanDerWaalsContact C-N 3.26Å; V54-R56 PolarHBondContact O-N 3.27Å; V54-L57 PolarHBondContact O-N 3.21Å; V54-Q58 PolarHBondContact O-N 3.49Å |
| 55 | P | 51.3 | Low | 48.3 | Very low | 96 Ų | 96 | 121.5 Ų | 121.5 | 62% | 0.623 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -56.9 | -38.1 | 177.2 | -26.1 | 35.8 | 0 | 0 | 0 | 113.5 | D53 Q58 Q59 | D53-P55 VanDerWaalsContact C-CD 3.49Å; P55-Q58 PolarHBondContact O-N 3.2Å; P55-Q59 PolarHBondContact O-N 2.96Å |
| 56 | R | 47.1 | Very low | 47.7 | Very low | 172 Ų | 172 | 125.1 Ų | 125.1 | 65% | 0.649 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -73 | -30.4 | -177.8 | -167.7 | 173.4 | -176 | 173.3 | 1.6 | 112.9 | D53 V54 | D53-R56 HydrophobicContact CB-CB 4.3Å; D53-R56 PolarHBondContact O-N 2.92Å; D53-R56 VanDerWaalsContact O-N 3.09Å; D53-R56 WeakPolarHBondContact OD2-CB 3.3Å; D53-R56 WeakPolarHBondContact OD2-CD 3.26Å; V54-R56 VanDerWaalsContact C-N 3.26Å; V54-R56 PolarHBondContact O-N 3.27Å |
| 57 | L | 52.4 | Low | 47.1 | Very low | 112 Ų | 112 | 127.8 Ų | 127.8 | 59% | 0.586 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -71.5 | -38.7 | 173 | -174.2 | 59.8 | 0 | 0 | 0 | 111.5 | D53 V54 Q59 M60 | D53-L57 PolarHBondContact O-N 3.25Å; V54-L57 PolarHBondContact O-N 3.21Å; L57-Q59 VanDerWaalsContact C-N 3.29Å; L57-Q59 PolarHBondContact O-N 2.84Å; L57-M60 HydrophobicContact CD1-CE 4.2Å; L57-M60 PolarHBondContact O-N 3.32Å |
| 58 | Q | 50.8 | Low | 46.2 | Very low | 139 Ų | 139 | 127.8 Ų | 127.8 | 65% | 0.65 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -66.3 | -31.8 | 178.7 | -166.5 | 154.7 | 17.1 | 0 | 0 | 112.5 | V54 P55 M60 A61 | V54-Q58 PolarHBondContact O-N 3.49Å; P55-Q58 PolarHBondContact O-N 3.2Å; Q58-M60 VanDerWaalsContact C-N 3.26Å; Q58-M60 PolarHBondContact O-N 3.09Å; Q58-A61 PolarHBondContact O-N 3.03Å |
| 59 | Q | 54.6 | Low | 45.6 | Very low | 159 Ų | 159 | 124.4 Ų | 124.4 | 74% | 0.743 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -65.2 | -24.6 | 175.1 | -163.9 | 172.8 | 15.9 | 0 | 0 | 113.8 | P55 L57 | P55-Q59 PolarHBondContact O-N 2.96Å; L57-Q59 VanDerWaalsContact C-N 3.29Å; L57-Q59 PolarHBondContact O-N 2.84Å |
| 60 | M | 49.8 | Very low | 45.5 | Very low | 137 Ų | 137 | 124.8 Ų | 124.8 | 68% | 0.675 | 72% | 0.717 | S | S | * | * | H | α-helix | trans | -84.3 | -15.8 | 175.2 | -70.7 | -177 | -78.1 | 0 | 0 | 113.5 | L57 Q58 | L57-M60 HydrophobicContact CD1-CE 4.2Å; L57-M60 PolarHBondContact O-N 3.32Å; Q58-M60 VanDerWaalsContact C-N 3.26Å; Q58-M60 PolarHBondContact O-N 3.09Å |
| 61 | A | 48.3 | Very low | 44.5 | Very low | 86 Ų | 86 | 125.2 Ų | 125.2 | 71% | 0.711 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -82.1 | -21 | -177 | 0 | 0 | 0 | 0 | 0 | 114.2 | Q58 | Q58-A61 PolarHBondContact O-N 3.03Å |
| 62 | S | 50.3 | Low | 43.9 | Very low | 107 Ų | 107 | 129 Ų | 129 | 75% | 0.748 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.3 | 9.2 | -178 | -59.8 | 0 | 0 | 0 | 0 | 114.5 | R64 | S62-R64 PolarHBondContact O-N 3.03Š|
| 63 | G | 44.6 | Very low | 43.8 | Very low | 68 Ų | 68 | 128.8 Ų | 128.8 | 70% | 0.701 | 74% | 0.735 | S | S | * | * | trans | -91.3 | 50.7 | -170.4 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 64 | R | 36.9 | Very low | 43 | Very low | 230 Ų | 230 | 132 Ų | 132 | 87% | 0.868 | 75% | 0.746 | S | S | * | * | trans | -155 | 140.9 | 169.7 | -139 | 176.4 | -173.3 | -178 | 2 | 114 | S62 | S62-R64 PolarHBondContact O-N 3.03Š| ||
| 65 | I | 40.1 | Very low | 42.6 | Very low | 161 Ų | 161 | 133.3 Ų | 133.3 | 83% | 0.826 | 76% | 0.757 | S | S | * | * | trans | 56.4 | 115.4 | -177.9 | 65 | 167.6 | 0 | 0 | 0 | 114.4 | ||||
| 66 | D | 32.7 | Very low | 41.6 | Very low | 157 Ų | 157 | 136.5 Ų | 136.5 | 84% | 0.84 | 76% | 0.764 | S | S | * | * | -150.3 | 173.4 | 78.2 | -142.5 | -30.9 | 0 | 0 | 0 | 114.4 | |||||
| 67 | L | 35.8 | Very low | 41.6 | Very low | 166 Ų | 166 | 134 Ų | 134 | 87% | 0.869 | 77% | 0.769 | S | S | * | * | trans | -118.4 | 121.8 | 170.5 | -81.4 | 83 | 0 | 0 | 0 | 110.6 | ||||
| 68 | G | 31.4 | Very low | 40.5 | Very low | 79 Ų | 79 | 132.4 Ų | 132.4 | 81% | 0.814 | 78% | 0.78 | S | S | * | * | trans | -172.3 | 128.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 69 | S | 33.5 | Very low | 39.5 | Very low | 124 Ų | 124 | 131 Ų | 131 | 87% | 0.867 | 79% | 0.785 | S | S | * | * | trans | -79.6 | 159.3 | 173.7 | -69.2 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 70 | P | 45.8 | Very low | 38.5 | Very low | 120 Ų | 120 | 131.1 Ų | 131.1 | 78% | 0.779 | 79% | 0.79 | S | S | * | * | trans | -94.1 | 162.8 | -163.6 | 36.7 | -37.6 | 0 | 0 | 0 | 115.4 | ||||
| 71 | S | 29.2 | Very low | 37.6 | Very low | 126 Ų | 126 | 129.5 Ų | 129.5 | 88% | 0.881 | 80% | 0.799 | S | S | * | * | trans | 141.6 | 159.4 | 144.5 | 62.5 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 72 | M | 33.8 | Very low | 36.7 | Very low | 174 Ų | 174 | 128.9 Ų | 128.9 | 86% | 0.857 | 80% | 0.801 | S | S | * | * | trans | -114.3 | 172.9 | -167.2 | -80.3 | -89.4 | -168.1 | 0 | 0 | 111 | ||||
| 73 | P | 48.2 | Very low | 35.7 | Very low | 106 Ų | 106 | 128.8 Ų | 128.8 | 69% | 0.688 | 81% | 0.806 | S | S | * | * | cis | -133.8 | -168.8 | -16.4 | 29.4 | -5.5 | 0 | 0 | 0 | 114.6 | ||||
| 74 | H | 30.1 | Very low | 35.2 | Very low | 159 Ų | 159 | 129.7 Ų | 129.7 | 74% | 0.736 | 81% | 0.808 | S | S | * | * | trans | -24.8 | 160.4 | 161.9 | -66.1 | -66.2 | 0 | 0 | 0 | 119.7 | ||||
| 75 | P | 47.1 | Very low | 34.9 | Very low | 122 Ų | 122 | 125.4 Ų | 125.4 | 79% | 0.792 | 80% | 0.802 | S | S | * | * | cis | -145.6 | -172.1 | 33 | 43 | -21.7 | 0 | 0 | 0 | 119.9 | ||||
| 76 | H | 31.5 | Very low | 34.8 | Very low | 163 Ų | 163 | 124.7 Ų | 124.7 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | trans | -62.6 | -176.8 | 174.9 | -64.4 | -88.2 | 0 | 0 | 0 | 116.6 | ||||
| 77 | P | 47.3 | Very low | 34.8 | Very low | 118 Ų | 118 | 124 Ų | 124 | 77% | 0.766 | 80% | 0.796 | S | S | * | * | cis | -141.3 | 162.4 | -42.9 | 36.9 | -20 | 0 | 0 | 0 | 116.2 | ||||
| 78 | G | 29 | Very low | 34.7 | Very low | 79 Ų | 79 | 122.4 Ų | 122.4 | 81% | 0.814 | 79% | 0.792 | S | S | * | * | trans | 73.2 | 177.6 | 156.8 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 79 | S | 30.5 | Very low | 34.6 | Very low | 109 Ų | 109 | 121.8 Ų | 121.8 | 76% | 0.762 | 79% | 0.786 | S | S | * | * | cis | -164.3 | 153 | -15.8 | -166.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 80 | L | 32.5 | Very low | 34.5 | Very low | 162 Ų | 162 | 120.3 Ų | 120.3 | 85% | 0.848 | 78% | 0.781 | S | S | * | * | trans | 66.8 | 141.9 | 161.7 | -76.5 | 162.1 | 0 | 0 | 0 | 121.9 | ||||
| 81 | A | 30.8 | Very low | 33.8 | Very low | 103 Ų | 103 | 120.6 Ų | 120.6 | 85% | 0.851 | 78% | 0.781 | S | S | * | * | trans | 64 | 141.1 | 159 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 82 | G | 29.7 | Very low | 33.9 | Very low | 73 Ų | 73 | 120 Ų | 120 | 75% | 0.753 | 78% | 0.777 | S | S | * | * | cis | 164.7 | 171.4 | -12.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 83 | A | 30 | Very low | 33.9 | Very low | 105 Ų | 105 | 120.5 Ų | 120.5 | 87% | 0.868 | 78% | 0.776 | S | S | * | * | trans | 77.6 | 157.8 | 160.5 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 84 | A | 33.9 | Very low | 34.4 | Very low | 88 Ų | 88 | 120.6 Ų | 120.6 | 73% | 0.727 | 78% | 0.777 | S | S | * | * | trans | 66.8 | 140.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 85 | D | 30.7 | Very low | 34.6 | Very low | 140 Ų | 140 | 119.9 Ų | 119.9 | 75% | 0.749 | 78% | 0.778 | S | S | * | * | cis | -158.8 | 163.2 | -22.4 | -119.4 | -42 | 0 | 0 | 0 | 114.1 | ||||
| 86 | L | 37.3 | Very low | 34.1 | Very low | 146 Ų | 146 | 121.6 Ų | 121.6 | 76% | 0.764 | 78% | 0.78 | S | S | * | * | trans | 16.9 | 110.2 | 156.7 | -65.9 | 164.3 | 0 | 0 | 0 | 122.8 | ||||
| 87 | N | 32.1 | Very low | 34.1 | Very low | 143 Ų | 143 | 125.2 Ų | 125.2 | 77% | 0.765 | 79% | 0.787 | S | S | * | * | 63.7 | 156 | 112 | -159.3 | 26.3 | 0 | 0 | 0 | 123.1 | |||||
| 88 | V | 34.1 | Very low | 33.2 | Very low | 131 Ų | 131 | 122.6 Ų | 122.6 | 79% | 0.794 | 78% | 0.781 | S | S | * | * | trans | 74.3 | 135.1 | 170.6 | -165.3 | 0 | 0 | 0 | 0 | 116 | ||||
| 89 | G | 29.3 | Very low | 33.4 | Very low | 66 Ų | 66 | 128.3 Ų | 128.3 | 68% | 0.68 | 79% | 0.787 | S | S | * | * | cis | 163.2 | 155.5 | -10.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 90 | A | 31.3 | Very low | 33.4 | Very low | 93 Ų | 93 | 127.2 Ų | 127.2 | 77% | 0.769 | 78% | 0.784 | S | S | * | * | trans | 63 | 103.4 | 157.4 | 0 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 91 | T | 31.4 | Very low | 33.4 | Very low | 126 Ų | 126 | 124.1 Ų | 124.1 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | 56.3 | 130.2 | 126 | 62.1 | 0 | 0 | 0 | 0 | 125.3 | |||||
| 92 | S | 31 | Very low | 33.6 | Very low | 114 Ų | 114 | 128.1 Ų | 128.1 | 80% | 0.797 | 79% | 0.785 | S | S | * | * | trans | 81.7 | 149 | 136.9 | 55.6 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 93 | H | 33.8 | Very low | 34.1 | Very low | 184 Ų | 184 | 128.7 Ų | 128.7 | 85% | 0.852 | 78% | 0.783 | S | S | * | * | trans | -79.6 | -168 | 174.9 | -42.3 | -110.2 | 0 | 0 | 0 | 112.3 | ||||
| 94 | P | 59.9 | Low | 35.2 | Very low | 109 Ų | 109 | 129.1 Ų | 129.1 | 71% | 0.708 | 78% | 0.777 | S | S | * | * | cis | -139.9 | -159.8 | -8.5 | 32.7 | -7.3 | 0 | 0 | 0 | 115.1 | ||||
| 95 | L | 33.9 | Very low | 35.4 | Very low | 144 Ų | 144 | 135.8 Ų | 135.8 | 75% | 0.754 | 78% | 0.783 | S | S | * | * | trans | 85.5 | 108.4 | 150.2 | -72.2 | 164.9 | 0 | 0 | 0 | 123.5 | ||||
| 96 | L | 36.4 | Very low | 35.6 | Very low | 157 Ų | 157 | 132.5 Ų | 132.5 | 82% | 0.822 | 78% | 0.782 | S | S | * | * | 57.8 | 129 | 119.8 | -113.9 | 165.7 | 0 | 0 | 0 | 123.5 | |||||
| 97 | R | 30.2 | Very low | 35.5 | Very low | 239 Ų | 239 | 131.8 Ų | 131.8 | 90% | 0.902 | 78% | 0.776 | S | S | * | * | trans | 109 | 124.6 | 131.9 | -161 | -179 | -168.1 | 170.6 | 4.3 | 120 | ||||
| 98 | G | 29.2 | Very low | 35.6 | Very low | 63 Ų | 63 | 132.8 Ų | 132.8 | 65% | 0.649 | 78% | 0.781 | S | S | * | * | trans | 141.4 | 124.2 | 133.7 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 99 | Q | 32.5 | Very low | 35.5 | Very low | 200 Ų | 200 | 129.6 Ų | 129.6 | 94% | 0.935 | 77% | 0.774 | S | S | * | * | trans | 65.7 | 158.6 | 141.4 | -67.5 | -179.3 | -0.9 | 0 | 0 | 119.7 | ||||
| 100 | A | 31.7 | Very low | 35.8 | Very low | 86 Ų | 86 | 135.4 Ų | 135.4 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | cis | -168.7 | 178.5 | -22.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 101 | A | 32.4 | Very low | 35.6 | Very low | 97 Ų | 97 | 134.2 Ų | 134.2 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | trans | 69.1 | 157.5 | 164.2 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 102 | M | 34.8 | Very low | 36.7 | Very low | 186 Ų | 186 | 133.9 Ų | 133.9 | 92% | 0.916 | 79% | 0.786 | S | S | * | * | cis | -159.8 | 160.6 | -19.2 | -105.9 | -72 | -164.7 | 0 | 0 | 108 | ||||
| 103 | A | 40.1 | Very low | 36.7 | Very low | 86 Ų | 86 | 139.9 Ų | 139.9 | 71% | 0.711 | 79% | 0.791 | S | S | * | * | trans | -131.6 | 162.1 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 104 | P | 54.2 | Low | 36.5 | Very low | 114 Ų | 114 | 135.9 Ų | 135.9 | 74% | 0.74 | 79% | 0.79 | S | S | * | * | -157.2 | 145.2 | 118 | 35.6 | -16.3 | 0 | 0 | 0 | 118.9 | |||||
| 105 | R | 37.8 | Very low | 35.1 | Very low | 228 Ų | 228 | 136.6 Ų | 136.6 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | trans | 60.2 | 150.1 | 139.7 | -58.7 | 168.2 | 101.1 | 135.3 | 2 | 119.5 | ||||
| 106 | G | 33.9 | Very low | 34.9 | Very low | 70 Ų | 70 | 134.1 Ų | 134.1 | 72% | 0.722 | 80% | 0.798 | S | S | * | * | cis | -178.8 | -173.2 | -1.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 107 | M | 34.9 | Very low | 34.5 | Very low | 131 Ų | 131 | 135.3 Ų | 135.3 | 65% | 0.645 | 80% | 0.799 | S | S | * | * | cis | -156.8 | 145.8 | 11.8 | -85 | -89.1 | 61.2 | 0 | 0 | 111.7 | ||||
| 108 | L | 35.8 | Very low | 34.5 | Very low | 165 Ų | 165 | 132.6 Ų | 132.6 | 86% | 0.864 | 80% | 0.797 | S | S | * | * | trans | 55.6 | 144.7 | 150.2 | -55.9 | 173.1 | 0 | 0 | 0 | 121 | ||||
| 109 | G | 30.4 | Very low | 34.5 | Very low | 63 Ų | 63 | 137.6 Ų | 137.6 | 65% | 0.649 | 81% | 0.805 | S | S | * | * | cis | 165.9 | 177.7 | -6.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 110 | L | 35.6 | Very low | 34.3 | Very low | 188 Ų | 188 | 134.6 Ų | 134.6 | 98% | 0.984 | 80% | 0.795 | S | S | * | * | trans | 80 | 152.7 | 171 | -52.6 | 176.6 | 0 | 0 | 0 | 120 | ||||
| 111 | G | 27.7 | Very low | 34.1 | Very low | 68 Ų | 68 | 134 Ų | 134 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | -157.9 | -152.7 | 168.8 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 112 | P | 54.5 | Low | 34 | Very low | 119 Ų | 119 | 138.7 Ų | 138.7 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | cis | -137.2 | -168.3 | -11.2 | 39.5 | -19.3 | 0 | 0 | 0 | 114.3 | ||||
| 113 | R | 30.8 | Very low | 34.1 | Very low | 241 Ų | 241 | 136 Ų | 136 | 91% | 0.909 | 79% | 0.785 | S | S | * | * | trans | 73.3 | 155.9 | 174.2 | -50.5 | 170.4 | 79 | 171.6 | 3.5 | 114 | ||||
| 114 | A | 30.8 | Very low | 33.6 | Very low | 100 Ų | 100 | 140.2 Ų | 140.2 | 83% | 0.826 | 79% | 0.794 | S | S | * | * | cis | -147.3 | -172.6 | 15 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 115 | S | 28.9 | Very low | 32.4 | Very low | 124 Ų | 124 | 138.7 Ų | 138.7 | 87% | 0.867 | 80% | 0.798 | S | S | * | * | trans | -104.3 | 144 | -173.7 | -43.9 | 0 | 0 | 0 | 0 | 115 | ||||
| 116 | A | 29.8 | Very low | 31.9 | Very low | 92 Ų | 92 | 131.1 Ų | 131.1 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | trans | -169.8 | 125.8 | 147.2 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 117 | E | 28.4 | Very low | 31.6 | Very low | 181 Ų | 181 | 136.7 Ų | 136.7 | 85% | 0.846 | 80% | 0.799 | S | S | * | * | cis | 82.4 | 134.1 | 48.6 | -71.7 | -151.3 | 91.6 | 0 | 0 | 116.1 | ||||
| 118 | Q | 31.1 | Very low | 31.3 | Very low | 183 Ų | 183 | 135.7 Ų | 135.7 | 86% | 0.855 | 81% | 0.805 | S | S | * | * | trans | 60 | 121.2 | 175.5 | -78.9 | 169.2 | -18.6 | 0 | 0 | 118.6 | ||||
| 119 | M | 28 | Very low | 31.2 | Very low | 168 Ų | 168 | 132.2 Ų | 132.2 | 83% | 0.828 | 80% | 0.8 | S | S | * | * | cis | 96.6 | 145.6 | 27.7 | -170 | 70 | 157.1 | 0 | 0 | 113.5 | ||||
| 120 | N | 29.4 | Very low | 31.5 | Very low | 137 Ų | 137 | 135 Ų | 135 | 73% | 0.733 | 81% | 0.81 | S | S | * | * | trans | 71.4 | 152.4 | 176 | -77.3 | -0.8 | 0 | 0 | 0 | 118.3 | ||||
| 121 | S | 26.6 | Very low | 32.3 | Very low | 72 Ų | 72 | 131.3 Ų | 131.3 | 50% | 0.503 | 80% | 0.797 | S | S | . | * | cis | -176.4 | 148.6 | -24.9 | 52.6 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 122 | F | 30.8 | Very low | 32.7 | Very low | 196 Ų | 196 | 133.8 Ų | 133.8 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | 65.7 | 144.1 | 167.8 | -48.7 | -72.6 | 0 | 0 | 0 | 119.2 | ||||
| 123 | P | 36.6 | Very low | 31.6 | Very low | 131 Ų | 131 | 131.2 Ų | 131.2 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | trans | -111.1 | 159.7 | 145.5 | 36.6 | -29.3 | 0 | 0 | 0 | 111.9 | ||||
| 124 | I | 30.4 | Very low | 31.9 | Very low | 174 Ų | 174 | 127.6 Ų | 127.6 | 89% | 0.892 | 80% | 0.796 | S | S | * | * | trans | -143 | 140 | 178.8 | -164.2 | 170.1 | 0 | 0 | 0 | 110.8 | ||||
| 125 | G | 28.4 | Very low | 31.9 | Very low | 81 Ų | 81 | 130.5 Ų | 130.5 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | trans | 72 | 169.3 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 126 | G | 26.9 | Very low | 32 | Very low | 70 Ų | 70 | 130.9 Ų | 130.9 | 72% | 0.722 | 78% | 0.781 | S | S | * | * | cis | 161.4 | 142.7 | -9.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 127 | Q | 28.9 | Very low | 31.9 | Very low | 187 Ų | 187 | 132.7 Ų | 132.7 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | trans | 74.9 | 101.3 | 163.6 | -49 | -163 | 118.2 | 0 | 0 | 120 | ||||
| 128 | S | 28.8 | Very low | 32.9 | Very low | 109 Ų | 109 | 130.2 Ų | 130.2 | 76% | 0.762 | 78% | 0.782 | S | S | * | * | 31.4 | 104.1 | 127.9 | 57.7 | 0 | 0 | 0 | 0 | 122.1 | |||||
| 129 | A | 31.9 | Very low | 32.9 | Very low | 93 Ų | 93 | 129.7 Ų | 129.7 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | 47.4 | 137 | 112.3 | 0 | 0 | 0 | 0 | 0 | 123.7 | |||||
| 130 | S | 37.8 | Very low | 32.9 | Very low | 122 Ų | 122 | 128.8 Ų | 128.8 | 85% | 0.853 | 78% | 0.777 | S | S | * | * | trans | 74.7 | 160.4 | 154.3 | -70.4 | 0 | 0 | 0 | 0 | 117 | ||||
| 131 | P | 52.8 | Low | 32.8 | Very low | 109 Ų | 109 | 132.4 Ų | 132.4 | 71% | 0.708 | 78% | 0.782 | S | S | * | * | cis | -145.6 | -174.3 | 29.3 | 45 | -25.1 | 0 | 0 | 0 | 119.5 | ||||
| 132 | S | 34.8 | Very low | 32.8 | Very low | 121 Ų | 121 | 134 Ų | 134 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | trans | 74.7 | 149.2 | 154.5 | -57.8 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 133 | G | 32.6 | Very low | 33.6 | Very low | 65 Ų | 65 | 130.9 Ų | 130.9 | 67% | 0.67 | 79% | 0.793 | S | S | * | * | cis | 157.9 | 153.4 | -15 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 134 | L | 36.1 | Very low | 33.6 | Very low | 165 Ų | 165 | 129 Ų | 129 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | trans | 68.2 | 164.1 | 163.7 | -47 | -179.1 | 0 | 0 | 0 | 116.3 | ||||
| 135 | Q | 31.6 | Very low | 33.7 | Very low | 160 Ų | 160 | 127.6 Ų | 127.6 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | cis | -146.7 | 176.7 | 22.7 | -86.8 | -164.1 | -69.6 | 0 | 0 | 110.5 | ||||
| 136 | E | 30.5 | Very low | 34.9 | Very low | 133 Ų | 133 | 129.4 Ų | 129.4 | 62% | 0.621 | 78% | 0.784 | S | S | * | * | cis | -178.4 | 121.5 | -24.2 | -169.3 | 155.3 | 121.8 | 0 | 0 | 106.9 | ||||
| 137 | V | 28.7 | Very low | 35.1 | Very low | 130 Ų | 130 | 133.6 Ų | 133.6 | 79% | 0.788 | 79% | 0.79 | S | S | * | * | 65.1 | 137.1 | 105.4 | 174 | 0 | 0 | 0 | 0 | 114 | |||||
| 138 | P | 48.3 | Very low | 35 | Very low | 129 Ų | 129 | 133 Ų | 133 | 84% | 0.838 | 79% | 0.787 | S | S | * | * | -144.2 | 173 | 64.6 | 39.9 | -18.3 | 0 | 0 | 0 | 120.3 | |||||
| 139 | Q | 31.8 | Very low | 35.3 | Very low | 172 Ų | 172 | 137.9 Ų | 137.9 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | trans | -132 | 156.7 | -176.1 | -100.1 | -78.8 | -9.5 | 0 | 0 | 109.6 | ||||
| 140 | L | 26.4 | Very low | 35.9 | Very low | 149 Ų | 149 | 139.4 Ų | 139.4 | 78% | 0.78 | 79% | 0.792 | S | S | * | * | trans | -146.9 | 113.8 | 167 | -86.2 | 179.1 | 0 | 0 | 0 | 113.9 | ||||
| 141 | Y | 27.3 | Very low | 36 | Very low | 213 Ų | 213 | 140.4 Ų | 140.4 | 84% | 0.835 | 79% | 0.787 | S | S | * | * | trans | 78.7 | 155.8 | 145.5 | -92.3 | -110.6 | 0 | 0 | 0 | 123.4 | ||||
| 142 | S | 28.6 | Very low | 35.6 | Very low | 104 Ų | 104 | 140.8 Ų | 140.8 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | trans | -143.1 | 178.2 | -178.3 | -75.9 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 143 | P | 47.5 | Very low | 36.3 | Very low | 132 Ų | 132 | 141 Ų | 141 | 86% | 0.857 | 79% | 0.788 | S | S | * | * | cis | -135.8 | -155.3 | 16.3 | 42.9 | -21.9 | 0 | 0 | 0 | 114 | ||||
| 144 | A | 35.3 | Very low | 36.4 | Very low | 90 Ų | 90 | 141.1 Ų | 141.1 | 74% | 0.744 | 79% | 0.789 | S | S | * | * | trans | -140.5 | 149.9 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 145 | T | 33.4 | Very low | 37 | Very low | 145 Ų | 145 | 139.7 Ų | 139.7 | 89% | 0.89 | 79% | 0.79 | S | S | * | * | trans | -176.9 | 172.9 | 155.9 | 16.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 146 | P | 52.5 | Low | 37.3 | Very low | 119 Ų | 119 | 140.2 Ų | 140.2 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | -121.9 | 168.1 | -101.8 | 32.1 | -10.2 | 0 | 0 | 0 | 116 | |||||
| 147 | L | 31.8 | Very low | 37.6 | Very low | 159 Ų | 159 | 143 Ų | 143 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | trans | -153.8 | 176.1 | 166.9 | -114.3 | 174.6 | 0 | 0 | 0 | 114.7 | ||||
| 148 | Q | 27.1 | Very low | 38.1 | Very low | 175 Ų | 175 | 142.1 Ų | 142.1 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -89.2 | 170 | -149.5 | -70.6 | 154 | -7.6 | 0 | 0 | 118.3 | ||||
| 149 | Y | 34.1 | Very low | 38.2 | Very low | 211 Ų | 211 | 141.9 Ų | 141.9 | 83% | 0.827 | 80% | 0.802 | S | S | * | * | trans | -63.4 | 165 | 166.2 | -74.7 | -95.4 | 0 | 0 | 0 | 113.8 | ||||
| 150 | P | 46.1 | Very low | 39.1 | Very low | 124 Ų | 124 | 139.8 Ų | 139.8 | 81% | 0.805 | 80% | 0.803 | S | S | * | * | -137.2 | 167.7 | 103.8 | 26 | -7.6 | 0 | 0 | 0 | 115.8 | |||||
| 151 | L | 38.7 | Very low | 39.5 | Very low | 144 Ų | 144 | 138 Ų | 138 | 75% | 0.754 | 81% | 0.81 | S | S | * | * | trans | -84.9 | 167.2 | 177.3 | -96.6 | 74.5 | 0 | 0 | 0 | 113.5 | ||||
| 152 | P | 44.8 | Very low | 39.9 | Very low | 117 Ų | 117 | 131.4 Ų | 131.4 | 76% | 0.76 | 81% | 0.807 | S | S | * | * | -115.5 | 154.7 | 126.8 | 35.5 | -32.4 | 0 | 0 | 0 | 112.6 | |||||
| 153 | P | 49.6 | Very low | 40.3 | Very low | 126 Ų | 126 | 135.1 Ų | 135.1 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | trans | -94 | 149.2 | -169.9 | 35.9 | -35.5 | 0 | 0 | 0 | 115 | ||||
| 154 | G | 34.6 | Very low | 40 | Very low | 66 Ų | 66 | 140.1 Ų | 140.1 | 68% | 0.68 | 82% | 0.821 | S | S | * | * | trans | -112 | 145 | 159.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 155 | P | 48.5 | Very low | 39.9 | Very low | 136 Ų | 136 | 139.5 Ų | 139.5 | 88% | 0.883 | 82% | 0.823 | S | S | * | * | trans | -78.1 | 149 | -174.1 | 31.2 | -35.3 | 0 | 0 | 0 | 113.5 | ||||
| 156 | Q | 38.1 | Very low | 40.3 | Very low | 170 Ų | 170 | 138.2 Ų | 138.2 | 79% | 0.794 | 82% | 0.82 | S | S | * | * | trans | -83.6 | 159.4 | 173.2 | -60.2 | -175 | 45.9 | 0 | 0 | 112.5 | ||||
| 157 | Q | 36.3 | Very low | 40.5 | Very low | 191 Ų | 191 | 137.1 Ų | 137.1 | 89% | 0.893 | 81% | 0.813 | S | S | * | * | -163.7 | 131.6 | 125.4 | -108 | 148 | 103.7 | 0 | 0 | 112.7 | |||||
| 158 | C | 38.7 | Very low | 40.8 | Very low | 112 Ų | 112 | 139.1 Ų | 139.1 | 76% | 0.757 | 82% | 0.815 | S | S | * | * | trans | -120.3 | 143.2 | 165.1 | -65.3 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 159 | P | 50.5 | Low | 41.3 | Very low | 124 Ų | 124 | 135 Ų | 135 | 81% | 0.805 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 151.5 | 169.1 | 32.3 | -33.5 | 0 | 0 | 0 | 111.3 | ||
| 160 | P | 50.5 | Low | 41.5 | Very low | 129 Ų | 129 | 129.8 Ų | 129.8 | 84% | 0.838 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -85.7 | 157.7 | -172.3 | 34.4 | -36.5 | 0 | 0 | 0 | 113.9 | ||
| 161 | A | 34.9 | Very low | 41.4 | Very low | 110 Ų | 110 | 134.4 Ų | 134.4 | 91% | 0.909 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 148.8 | 166.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 162 | G | 37.3 | Very low | 41.8 | Very low | 75 Ų | 75 | 133.6 Ų | 133.6 | 77% | 0.773 | 82% | 0.816 | S | S | * | * | trans | -160.4 | 96 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 163 | L | 35.9 | Very low | 41.6 | Very low | 183 Ų | 183 | 131.8 Ų | 131.8 | 96% | 0.958 | 81% | 0.807 | S | S | * | * | trans | -148.7 | 134.3 | 164.6 | -102.2 | 173 | 0 | 0 | 0 | 109 | ||||
| 164 | Y | 40.9 | Very low | 41.3 | Very low | 237 Ų | 237 | 137 Ų | 137 | 93% | 0.929 | 81% | 0.811 | S | S | * | * | trans | -120.9 | 140 | -176.5 | -160.6 | -86.6 | 0 | 0 | 0 | 107.8 | ||||
| 165 | G | 34 | Very low | 42.1 | Very low | 76 Ų | 76 | 139.4 Ų | 139.4 | 78% | 0.784 | 82% | 0.815 | S | S | * | * | trans | 116.2 | 109.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 166 | S | 40.9 | Very low | 41.5 | Very low | 118 Ų | 118 | 141.5 Ų | 141.5 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | trans | -121.1 | 165.3 | 153.1 | -165.5 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 167 | P | 57.9 | Low | 41.8 | Very low | 97 Ų | 97 | 137.3 Ų | 137.3 | 63% | 0.63 | 81% | 0.808 | S | S | * | * | cis | -132.4 | -178.2 | 7 | 43.3 | -28.2 | 0 | 0 | 0 | 114.5 | ||||
| 168 | F | 37.7 | Very low | 42.2 | Very low | 200 Ų | 200 | 136.3 Ų | 136.3 | 88% | 0.877 | 80% | 0.803 | S | S | * | * | -170.3 | 134.8 | 121.8 | -109 | -70.4 | 0 | 0 | 0 | 113.6 | |||||
| 169 | A | 38 | Very low | 42.5 | Very low | 90 Ų | 90 | 138.7 Ų | 138.7 | 74% | 0.744 | 81% | 0.805 | S | S | * | * | trans | 56.6 | 140.1 | 151.8 | 0 | 0 | 0 | 0 | 0 | 124 | ||||
| 170 | A | 38.4 | Very low | 42 | Very low | 100 Ų | 100 | 136.6 Ų | 136.6 | 83% | 0.826 | 80% | 0.798 | S | S | * | * | trans | 70.3 | 102 | 144.1 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 171 | R | 42.2 | Very low | 41.6 | Very low | 222 Ų | 222 | 137.1 Ų | 137.1 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | trans | -73.8 | 165.6 | 134.1 | -112.6 | -173.8 | 163.3 | -175.5 | -4.4 | 108.9 | ||||
| 172 | P | 48.3 | Very low | 41.9 | Very low | 126 Ų | 126 | 143.1 Ų | 143.1 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | cis | -127.8 | 170.9 | 32 | 41 | -26.4 | 0 | 0 | 0 | 116.3 | ||||
| 173 | S | 41.1 | Very low | 41.9 | Very low | 80 Ų | 80 | 143.3 Ų | 143.3 | 56% | 0.559 | 79% | 0.787 | S | S | * | * | trans | -116.7 | 113.9 | -179.2 | 54.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 174 | Y | 41.8 | Very low | 42.6 | Very low | 234 Ų | 234 | 140.4 Ų | 140.4 | 92% | 0.918 | 78% | 0.779 | S | S | * | * | trans | -156.7 | 165 | 168.9 | -105.9 | -57.8 | 0 | 0 | 0 | 109.6 | ||||
| 175 | P | 52.8 | Low | 42.6 | Very low | 117 Ų | 117 | 137.6 Ų | 137.6 | 76% | 0.76 | 78% | 0.775 | S | S | * | * | -106.6 | 161.5 | -105.8 | 39.2 | -32.5 | 0 | 0 | 0 | 113.9 | |||||
| 176 | Q | 36 | Very low | 43 | Very low | 180 Ų | 180 | 140.3 Ų | 140.3 | 84% | 0.841 | 77% | 0.771 | S | S | * | * | trans | -137.4 | 120.3 | 164.5 | -170.8 | 167.4 | -19.2 | 0 | 0 | 111.2 | ||||
| 177 | A | 44.7 | Very low | 43.3 | Very low | 82 Ų | 82 | 142.1 Ų | 142.1 | 68% | 0.678 | 77% | 0.771 | S | S | * | * | trans | -79.3 | 117 | 171.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | M179 | A177-M179 PolarHBondContact O-N 3.13Š| ||
| 178 | H | 43.4 | Very low | 42.6 | Very low | 171 Ų | 171 | 144.7 Ų | 144.7 | 79% | 0.792 | 77% | 0.774 | S | S | * | * | trans | -84.7 | 99.8 | 176.6 | -151.7 | -71 | 0 | 0 | 0 | 110.1 | A180 | H178-A180 PolarHBondContact O-N 2.84Š| ||
| 179 | M | 45.4 | Very low | 43.4 | Very low | 161 Ų | 161 | 140.1 Ų | 140.1 | 79% | 0.793 | 76% | 0.764 | S | S | * | * | trans | -67 | 98 | 176.5 | -68.5 | -64.6 | -176 | 0 | 0 | 110.3 | A177 V181 | A177-M179 PolarHBondContact O-N 3.13Å; M179-V181 PolarHBondContact O-N 2.74Å | ||
| 180 | A | 39 | Very low | 44.6 | Very low | 80 Ų | 80 | 143 Ų | 143 | 66% | 0.661 | 76% | 0.76 | S | S | * | * | trans | -78.8 | 98 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | H178 R182 | H178-A180 PolarHBondContact O-N 2.84Å; A180-R182 PolarHBondContact O-N 3.45Å | ||
| 181 | V | 43.3 | Very low | 46.6 | Very low | 141 Ų | 141 | 145.7 Ų | 145.7 | 86% | 0.855 | 76% | 0.755 | S | S | * | * | trans | -58.2 | 110.5 | 169.2 | 176.9 | 0 | 0 | 0 | 0 | 108.5 | M179 S183 | M179-V181 PolarHBondContact O-N 2.74Å; V181-S183 PolarHBondContact O-N 2.88Å | ||
| 182 | R | 40.7 | Very low | 48.8 | Very low | 235 Ų | 235 | 137.6 Ų | 137.6 | 89% | 0.887 | 73% | 0.725 | S | S | * | * | trans | -85.4 | 103.5 | 175.3 | -71.7 | -171.6 | 173.2 | -168.3 | -2.8 | 109.5 | A180 | A180-R182 PolarHBondContact O-N 3.45Š| ||
| 183 | S | 38.3 | Very low | 50.9 | Low | 79 Ų | 79 | 134 Ų | 134 | 55% | 0.552 | 70% | 0.702 | S | S | * | * | trans | -60.9 | 151.7 | 164 | 46.1 | 0 | 0 | 0 | 0 | 110.8 | V181 Q185 | V181-S183 PolarHBondContact O-N 2.88Å; S183-Q185 PolarHBondContact O-N 3.06Å | ||
| 184 | P | 49.2 | Very low | 53.4 | Low | 122 Ų | 122 | 136.3 Ų | 136.3 | 79% | 0.792 | 70% | 0.702 | S | S | * | * | trans | -63.3 | 130.9 | 175.3 | 26.9 | -33.8 | 0 | 0 | 0 | 110.1 | ||||
| 185 | Q | 41.3 | Very low | 55.9 | Low | 179 Ų | 179 | 125.6 Ų | 125.6 | 84% | 0.836 | 66% | 0.661 | S | S | * | * | trans | -102.2 | 106.5 | 177.8 | -75.2 | -86.4 | -40.3 | 0 | 0 | 108.7 | S183 | S183-Q185 PolarHBondContact O-N 3.06Š| ||
| 186 | D | 43.4 | Very low | 57.8 | Low | 132 Ų | 132 | 122.3 Ų | 122.3 | 71% | 0.706 | 64% | 0.636 | S | S | * | * | trans | -76.5 | 147 | -178.8 | -98.8 | -58.2 | 0 | 0 | 0 | 113.7 | H188 | D186-H188 PolarHBondContact O-N 2.91Å; D186-H188 VanDerWaalsContact O-N 3.08Å | ||
| 187 | L | 45.5 | Very low | 60.7 | Low | 157 Ų | 157 | 114.1 Ų | 114.1 | 82% | 0.822 | 60% | 0.598 | S | S | * | * | trans | 50.9 | 38.2 | 142 | -57.8 | 173 | 0 | 0 | 0 | 120.3 | ||||
| 188 | H | 45.1 | Very low | 63.1 | Low | 151 Ų | 151 | 112.7 Ų | 112.7 | 70% | 0.699 | 58% | 0.583 | S | S | * | * | trans | -82.7 | 126.7 | 139.1 | -177.8 | -98 | 0 | 0 | 0 | 108.9 | D186 K190 | D186-H188 PolarHBondContact O-N 2.91Å; D186-H188 VanDerWaalsContact O-N 3.08Å; H188-K190 PolarHBondContact O-N 3.33Å | ||
| 189 | P | 54.4 | Low | 65.7 | Low | 104 Ų | 104 | 107 Ų | 107 | 68% | 0.675 | 56% | 0.555 | S | S | * | * | trans | -61.5 | 97.7 | 170.2 | -21 | 33.4 | 0 | 0 | 0 | 109.8 | H191 | P189-H191 PolarHBondContact O-N 2.82Š| ||
| 190 | K | 62.3 | Low | 68.1 | Low | 151 Ų | 151 | 100 Ų | 100 | 66% | 0.657 | 52% | 0.521 | S | S | * | . | trans | -54.4 | 109.3 | 172.2 | -70.6 | 177.6 | -177.3 | 173.1 | 0 | 107.3 | H188 Y192 | H188-K190 PolarHBondContact O-N 3.33Å; K190-Y192 HydrophobicContact CB-CD2 4.13Å; K190-Y192 HydrophobicContact CB-CE2 3.63Å; K190-Y192 WeakPolarHBondContact O-CD2 3.49Å; K190-Y192 WeakPolarHBondContact O-CE2 3.49Å; K190-Y192 PolarHBondContact O-N 3.49Å | ||
| 191 | H | 80.3 | Confident | 70.8 | Confident | 156 Ų | 156 | 96.2 Ų | 96.2 | 72% | 0.722 | 49% | 0.49 | S | S | * | . | trans | -77.6 | 81.7 | -177.6 | -175.4 | -74.1 | 0 | 0 | 0 | 109 | P189 | P189-H191 PolarHBondContact O-N 2.82Š| ||
| 192 | Y | 88.1 | Confident | 73.3 | Confident | 51 Ų | 51 | 89.6 Ų | 89.6 | 20% | 0.2 | 45% | 0.45 | C | S | . | . | P | Polyproline II helix | trans | -57.3 | 122.2 | -179.9 | -69.9 | -86.3 | 0 | 0 | 0 | 109.8 | K190 P229 R296 M298 | K190-Y192 HydrophobicContact CB-CD2 4.13Å; K190-Y192 HydrophobicContact CB-CE2 3.63Å; K190-Y192 WeakPolarHBondContact O-CD2 3.49Å; K190-Y192 WeakPolarHBondContact O-CE2 3.49Å; K190-Y192 PolarHBondContact O-N 3.49Å; Y192-P229 HydrophobicContact CD1-CG 4.4Å; Y192-P229 HydrophobicContact CD2-CB 3.53Å; Y192-P229 HydrophobicContact CD2-CG 3.82Å; Y192-P229 HydrophobicContact CE1-CG 4.37Å; Y192-P229 HydrophobicContact CE2-CB 3.83Å; Y192-P229 HydrophobicContact CE2-CG 3.77Å; Y192-P229 HydrophobicContact CG-CB 4.06Å; Y192-P229 HydrophobicContact CG-CG 4.13Å; Y192-R296 WeakPolarHBondContact CD1-O 3.41Å; Y192-M298 WeakPolarHBondContact CE1-O 3.49Å |
| 193 | P | 92.9 | Very high | 76 | Confident | 51 Ų | 51 | 78.4 Ų | 78.4 | 33% | 0.331 | 41% | 0.408 | S | S | . | . | P | Polyproline II helix | trans | -63.8 | 154 | 176 | 28.6 | -35.3 | 0 | 0 | 0 | 110.4 | R296 S297 | P193-R296 VanDerWaalsContact CD-O 3.31Å; P193-R296 WeakPolarHBondContact CD-O 3.41Å; P193-R296 HydrophobicContact CG-CB 4.12Å; P193-S297 WeakPolarHBondContact O-CB 3.41Å |
| 194 | K | 93.3 | Very high | 78.8 | Confident | 129 Ų | 129 | 74.6 Ų | 74.6 | 56% | 0.561 | 38% | 0.381 | S | S | * | . | P | Polyproline II helix | trans | -53 | 128.5 | 171.8 | -178.5 | 176.7 | 176.2 | -176.9 | 0 | 109.8 | Y230 | K194-Y230 HydrophobicContact CB-CD1 4.24Å; K194-Y230 HydrophobicContact CB-CD2 4.23Å; K194-Y230 HydrophobicContact CB-CE1 3.9Å; K194-Y230 HydrophobicContact CB-CE2 3.89Å; K194-Y230 HydrophobicContact CB-CG 4.4Å; K194-Y230 HydrophobicContact CD-CE1 4.26Å; K194-Y230 HydrophobicContact CG-CD1 4.23Å; K194-Y230 HydrophobicContact CG-CE1 3.7Å |
| 195 | P | 94 | Very high | 81 | Confident | 8 Ų | 8 | 68.8 Ų | 68.8 | 5% | 0.052 | 34% | 0.344 | C | S | . | . | P | Polyproline II helix | trans | -58.8 | 141.8 | 177.7 | -24.9 | 34.8 | 0 | 0 | 0 | 111.9 | Y197 L202 F228 F231 | P195-Y197 PolarHBondContact O-N 3.03Å; P195-L202 HydrophobicContact CB-CD2 4.35Å; P195-F228 HydrophobicContact CB-CD1 3.84Å; P195-F228 HydrophobicContact CB-CE1 4.18Å; P195-F228 HydrophobicContact CB-CG 4.49Å; P195-F228 HydrophobicContact CG-CB 3.72Å; P195-F228 HydrophobicContact CG-CD1 3.44Å; P195-F228 VanDerWaalsContact CG-CD1 3.44Å; P195-F228 HydrophobicContact CG-CE1 4.26Å; P195-F228 HydrophobicContact CG-CG 3.77Å; P195-F231 HydrophobicContact CG-CE2 3.94Å; P195-F231 HydrophobicContact CG-CZ 4.35Å |
| 196 | I | 94.2 | Very high | 83.5 | Confident | 48 Ų | 48 | 60.3 Ų | 60.3 | 25% | 0.246 | 30% | 0.304 | C | S | . | . | S | Bend | trans | -74.2 | -16.7 | 176.1 | 71.4 | 178.9 | 0 | 0 | 0 | 112.5 | W286 D290 A293 I294 | I196-W286 HydrophobicContact CB-CE3 4.06Å; I196-W286 HydrophobicContact CB-CZ3 3.96Å; I196-W286 HydrophobicContact CD1-CE3 3.61Å; I196-W286 HydrophobicContact CD1-CZ3 4.09Å; I196-W286 HydrophobicContact CG1-CD2 4.47Å; I196-W286 HydrophobicContact CG1-CE3 3.73Å; I196-W286 HydrophobicContact CG1-CZ3 4.15Å; I196-D290 HydrophobicContact CD1-CB 3.9Å; I196-D290 WeakPolarHBondContact CD1-O 3.4Å; I196-A293 HydrophobicContact CD1-CB 4.24Å; I196-A293 HydrophobicContact CG2-CB 3.84Å; I196-I294 HydrophobicContact CD1-CD1 4.04Å; I196-I294 HydrophobicContact CD1-CG1 3.62Å; I196-I294 HydrophobicContact CG1-CD1 4.39Å; I196-I294 HydrophobicContact CG1-CG1 3.71Å |
| 197 | Y | 95.1 | Very high | 86 | Confident | 8 Ų | 8 | 54.1 Ų | 54.1 | 3% | 0.031 | 27% | 0.271 | C | S | . | . | S | Bend | trans | -64.8 | 138.1 | 174.3 | -79.2 | -59.8 | 0 | 0 | 0 | 111.9 | P195 C201 M205 F228 M283 W286 I294 L304 I308 | P195-Y197 PolarHBondContact O-N 3.03Å; Y197-C201 HydrophobicContact CD1-CB 3.58Å; Y197-C201 HydrophobicContact CE1-CB 4.43Å; Y197-C201 HydrophobicContact CG-CB 4.11Å; Y197-M205 HydrophobicContact CD1-CE 4.45Å; Y197-M205 HydrophobicContact CD2-CE 3.67Å; Y197-M205 HydrophobicContact CE2-CE 3.94Å; Y197-M205 HydrophobicContact CE2-SD 4.31Å; Y197-M205 HydrophobicContact CG-CE 3.96Å; Y197-F228 HydrophobicContact CD2-CE1 4.39Å; Y197-F228 HydrophobicContact CD2-CZ 4.33Å; Y197-M283 HydrophobicContact CE1-CB 4.48Å; Y197-M283 PolarHBondContact OH-O 3.4Å; Y197-W286 HydrophobicContact CD1-CB 3.84Å; Y197-W286 HydrophobicContact CD1-CG 4.17Å; Y197-W286 HydrophobicContact CE1-CB 3.47Å; Y197-W286 VanDerWaalsContact CE1-CB 3.47Å; Y197-W286 HydrophobicContact CE1-CG 4.26Å; Y197-I294 HydrophobicContact CD2-CG1 4.31Å; Y197-I294 HydrophobicContact CD2-CG2 4.33Å; Y197-I294 HydrophobicContact CE2-CB 4.39Å; Y197-I294 HydrophobicContact CE2-CD1 3.76Å; Y197-I294 HydrophobicContact CE2-CG1 3.81Å; Y197-I294 HydrophobicContact CE2-CG2 3.63Å; Y197-I294 WeakPolarHBondContact OH-CD1 3.48Å; Y197-L304 HydrophobicContact CE2-CD1 4.12Å; Y197-I308 WeakPolarHBondContact OH-CD1 3.48Å |
| 198 | S | 95.9 | Very high | 88.2 | Confident | 53 Ų | 53 | 47.2 Ų | 47.2 | 37% | 0.371 | 23% | 0.234 | S | C | . | . | trans | -66 | 156.9 | 170.4 | 72.8 | 0 | 0 | 0 | 0 | 111.1 | S200 C201 L202 | S198-S200 PolarHBondContact O-N 2.86Å; S198-S200 VanDerWaalsContact O-N 3.16Å; S198-C201 WeakPolarHBondContact O-CB 3.26Å; S198-C201 PolarHBondContact O-N 3.29Å; S198-C201 PolarHBondContact OG-N 2.84Å; S198-C201 PolarHBondContact OG-SG 2.97Å; S198-C201 VanDerWaalsContact OG-SG 3.34Å; S198-L202 WeakPolarHBondContact O-CG 3.13Å; S198-L202 PolarHBondContact O-N 3.27Å | ||
| 199 | Y | 97.1 | Very high | 90.4 | Very high | 51 Ų | 51 | 42.7 Ų | 42.7 | 20% | 0.2 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -53.2 | -36.5 | 173.7 | -71 | -64.8 | 0 | 0 | 0 | 112.5 | L202 I203 M224 F231 W238 V242 | Y199-L202 HydrophobicContact CD1-CD1 4.39Å; Y199-L202 PolarHBondContact O-N 3.16Å; Y199-I203 WeakPolarHBondContact O-CB 3.36Å; Y199-I203 WeakPolarHBondContact O-CD1 3.41Å; Y199-I203 WeakPolarHBondContact O-CG1 3.44Å; Y199-I203 PolarHBondContact O-N 2.93Å; Y199-M224 HydrophobicContact CD1-CE 4.05Å; Y199-M224 HydrophobicContact CE1-CE 4.18Å; Y199-F231 HydrophobicContact CE1-CE1 4Å; Y199-F231 HydrophobicContact CE1-CZ 4.32Å; Y199-W238 HydrophobicContact CE1-CB 4.35Å; Y199-V242 HydrophobicContact CD1-CG2 3.93Å; Y199-V242 HydrophobicContact CE1-CG2 4.34Å |
| 200 | S | 96.6 | Very high | 92.2 | Very high | 13 Ų | 13 | 38.4 Ų | 38.4 | 9% | 0.091 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62.7 | -42 | 173.6 | -70.7 | 0 | 0 | 0 | 0 | 112.9 | S198 A204 N245 N249 F252 | S198-S200 PolarHBondContact O-N 2.86Å; S198-S200 VanDerWaalsContact O-N 3.16Å; S200-A204 WeakPolarHBondContact O-CB 3.43Å; S200-A204 PolarHBondContact O-N 3.49Å; S200-N245 PolarHBondContact N-OD1 3.34Å; S200-N245 PolarHBondContact OG-OD1 3.27Å; S200-N249 PolarHBondContact OG-ND2 3.08Å; S200-F252 WeakPolarHBondContact O-CZ 3.47Å |
| 201 | C | 96.1 | Very high | 93.4 | Very high | 1 Ų | 1 | 41.4 Ų | 41.4 | 1% | 0.007 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -66.2 | -38.3 | 174.5 | -62.2 | 0 | 0 | 0 | 0 | 112 | Y197 S198 A204 M205 M283 | Y197-C201 HydrophobicContact CD1-CB 3.58Å; Y197-C201 HydrophobicContact CE1-CB 4.43Å; Y197-C201 HydrophobicContact CG-CB 4.11Å; S198-C201 WeakPolarHBondContact O-CB 3.26Å; S198-C201 PolarHBondContact O-N 3.29Å; S198-C201 PolarHBondContact OG-N 2.84Å; S198-C201 PolarHBondContact OG-SG 2.97Å; S198-C201 VanDerWaalsContact OG-SG 3.34Å; C201-A204 PolarHBondContact O-N 2.81Å; C201-M205 WeakPolarHBondContact O-CE 3.32Å; C201-M205 PolarHBondContact O-N 3.31Å; C201-M283 HydrophobicContact CB-CG 4.07Å |
| 202 | L | 96.4 | Very high | 93.7 | Very high | 2 Ų | 2 | 38.8 Ų | 38.8 | 1% | 0.01 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -65.6 | -42.6 | 178 | -65.4 | 167.7 | 0 | 0 | 0 | 112 | P195 S198 Y199 M205 A206 M224 F228 F231 | P195-L202 HydrophobicContact CB-CD2 4.35Å; S198-L202 WeakPolarHBondContact O-CG 3.13Å; S198-L202 PolarHBondContact O-N 3.27Å; Y199-L202 HydrophobicContact CD1-CD1 4.39Å; Y199-L202 PolarHBondContact O-N 3.16Å; L202-M205 HydrophobicContact CD2-CE 3.91Å; L202-A206 PolarHBondContact O-N 2.93Å; L202-M224 HydrophobicContact CB-CG 4.45Å; L202-M224 HydrophobicContact CB-SD 4.49Å; L202-M224 HydrophobicContact CD1-CE 4.2Å; L202-F228 HydrophobicContact CD2-CD1 4.38Å; L202-F228 HydrophobicContact CD2-CD2 3.66Å; L202-F228 HydrophobicContact CD2-CE1 4.15Å; L202-F228 HydrophobicContact CD2-CE2 3.42Å; L202-F228 VanDerWaalsContact CD2-CE2 3.42Å; L202-F228 HydrophobicContact CD2-CG 4.15Å; L202-F228 HydrophobicContact CD2-CZ 3.68Å; L202-F231 HydrophobicContact CD1-CE2 3.86Å; L202-F231 HydrophobicContact CD1-CZ 3.68Å |
| 203 | I | 97 | Very high | 93.7 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.4 | -43.1 | 172.8 | -67.9 | 160.3 | 0 | 0 | 0 | 110.5 | Y199 M205 A206 L207 I220 V242 N245 L246 F252 | Y199-I203 WeakPolarHBondContact O-CB 3.36Å; Y199-I203 WeakPolarHBondContact O-CD1 3.41Å; Y199-I203 WeakPolarHBondContact O-CG1 3.44Å; Y199-I203 PolarHBondContact O-N 2.93Å; I203-M205 PolarHBondContact O-N 2.95Å; I203-A206 WeakPolarHBondContact O-CB 3.22Å; I203-A206 PolarHBondContact O-N 2.77Å; I203-L207 HydrophobicContact CG2-CD1 3.81Å; I203-L207 HydrophobicContact CG2-CG 4.31Å; I203-L207 WeakPolarHBondContact O-CG 2.83Å; I203-L207 PolarHBondContact O-N 3.16Å; I203-I220 HydrophobicContact CG1-CG2 4.03Å; I203-I220 HydrophobicContact CG2-CD1 4.41Å; I203-V242 HydrophobicContact CD1-CG1 4.22Å; I203-V242 HydrophobicContact CG1-CG1 4.28Å; I203-N245 HydrophobicContact CD1-CB 3.67Å; I203-L246 HydrophobicContact CD1-CD2 4.21Å; I203-L246 HydrophobicContact CD1-CG 4.13Å; I203-L246 HydrophobicContact CG2-CD2 3.66Å; I203-F252 HydrophobicContact CB-CE1 4.13Å; I203-F252 HydrophobicContact CB-CE2 4.31Å; I203-F252 HydrophobicContact CB-CZ 3.81Å; I203-F252 HydrophobicContact CD1-CE2 4.21Å; I203-F252 HydrophobicContact CG2-CD1 3.84Å; I203-F252 HydrophobicContact CG2-CD2 4.38Å; I203-F252 HydrophobicContact CG2-CE1 3.46Å; I203-F252 VanDerWaalsContact CG2-CE1 3.46Å; I203-F252 HydrophobicContact CG2-CE2 4.05Å; I203-F252 HydrophobicContact CG2-CG 4.3Å; I203-F252 HydrophobicContact CG2-CZ 3.58Å |
| 204 | A | 95.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -63 | -41.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | S200 C201 A206 L207 K208 F252 L271 M279 M283 | S200-A204 WeakPolarHBondContact O-CB 3.43Å; S200-A204 PolarHBondContact O-N 3.49Å; C201-A204 PolarHBondContact O-N 2.81Å; A204-A206 VanDerWaalsContact C-N 3.35Å; A204-A206 PolarHBondContact O-N 3.32Å; A204-L207 PolarHBondContact O-N 2.88Å; A204-K208 WeakPolarHBondContact O-CB 3.29Å; A204-K208 WeakPolarHBondContact O-CG 3.1Å; A204-K208 PolarHBondContact O-N 3.37Å; A204-F252 HydrophobicContact CB-CE1 4.46Å; A204-L271 HydrophobicContact CB-CD1 4.23Å; A204-M279 HydrophobicContact CB-CE 4.5Å; A204-M279 HydrophobicContact CB-CG 3.26Å; A204-M279 HydrophobicContact CB-SD 3.8Å; A204-M283 HydrophobicContact CB-SD 3.92Å |
| 205 | M | 95.3 | Very high | 93.8 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -60.6 | -42.2 | 173.1 | -74.5 | -178.2 | -71.5 | 0 | 0 | 112 | Y197 C201 L202 I203 L207 K208 S209 F223 F228 M283 | Y197-M205 HydrophobicContact CD1-CE 4.45Å; Y197-M205 HydrophobicContact CD2-CE 3.67Å; Y197-M205 HydrophobicContact CE2-CE 3.94Å; Y197-M205 HydrophobicContact CE2-SD 4.31Å; Y197-M205 HydrophobicContact CG-CE 3.96Å; C201-M205 WeakPolarHBondContact O-CE 3.32Å; C201-M205 PolarHBondContact O-N 3.31Å; L202-M205 HydrophobicContact CD2-CE 3.91Å; I203-M205 PolarHBondContact O-N 2.95Å; M205-L207 PolarHBondContact O-N 3.11Å; M205-K208 PolarHBondContact O-N 3.33Å; M205-S209 PolarHBondContact O-N 2.96Å; M205-S209 PolarHBondContact O-OG 2.95Å; M205-F223 HydrophobicContact CB-CE1 3.95Å; M205-F223 HydrophobicContact CB-CZ 3.88Å; M205-F228 HydrophobicContact CE-CE2 4.07Å; M205-F228 HydrophobicContact CE-CZ 3.77Å; M205-F228 HydrophobicContact SD-CZ 4.45Å; M205-M283 HydrophobicContact CG-CE 3.4Å; M205-M283 HydrophobicContact CG-SD 4.09Å; M205-M283 HydrophobicContact SD-CE 4.29Å |
| 206 | A | 95.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.9 | -42.3 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | L202 I203 A204 S209 S210 L215 F223 | L202-A206 PolarHBondContact O-N 2.93Å; I203-A206 WeakPolarHBondContact O-CB 3.22Å; I203-A206 PolarHBondContact O-N 2.77Å; A204-A206 VanDerWaalsContact C-N 3.35Å; A204-A206 PolarHBondContact O-N 3.32Å; A206-S209 PolarHBondContact O-OG 3.35Å; A206-S210 PolarHBondContact O-N 2.87Å; A206-L215 HydrophobicContact CB-CD1 4.15Å; A206-L215 WeakPolarHBondContact O-CD1 3.38Å; A206-F223 HydrophobicContact CB-CB 3.95Å; A206-F223 HydrophobicContact CB-CD1 3.39Å; A206-F223 HydrophobicContact CB-CD2 4.17Å; A206-F223 HydrophobicContact CB-CE1 3.89Å; A206-F223 HydrophobicContact CB-CG 3.56Å; A206-F223 HydrophobicContact CB-CZ 4.48Å |
| 207 | L | 94.6 | Very high | 93.9 | Very high | 2 Ų | 2 | 30.8 Ų | 30.8 | 1% | 0.01 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -70.9 | -35.7 | 178.7 | -67.8 | 173.6 | 0 | 0 | 0 | 112 | I203 A204 M205 S210 L215 F252 W269 L271 | I203-L207 HydrophobicContact CG2-CD1 3.81Å; I203-L207 HydrophobicContact CG2-CG 4.31Å; I203-L207 WeakPolarHBondContact O-CG 2.83Å; I203-L207 PolarHBondContact O-N 3.16Å; A204-L207 PolarHBondContact O-N 2.88Å; M205-L207 PolarHBondContact O-N 3.11Å; L207-S210 WeakPolarHBondContact O-CB 3.13Å; L207-S210 PolarHBondContact O-N 3.48Å; L207-L215 HydrophobicContact CD2-CB 4.05Å; L207-L215 HydrophobicContact CD2-CG 4.34Å; L207-F252 HydrophobicContact CD1-CD1 3.65Å; L207-F252 HydrophobicContact CD1-CE1 3.97Å; L207-W269 WeakPolarHBondContact CD2-O 3.43Å; L207-L271 HydrophobicContact CB-CB 4.47Å; L207-L271 HydrophobicContact CD1-CB 4.33Å |
| 208 | K | 91.4 | Very high | 93.9 | Very high | 12 Ų | 12 | 33.2 Ų | 33.2 | 5% | 0.052 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -67.4 | -38.4 | 173.7 | -79.7 | -168.9 | 53.4 | 151.2 | 0 | 113 | A204 M205 S210 L271 E280 M283 I308 D310 P312 | A204-K208 WeakPolarHBondContact O-CB 3.29Å; A204-K208 WeakPolarHBondContact O-CG 3.1Å; A204-K208 PolarHBondContact O-N 3.37Å; M205-K208 PolarHBondContact O-N 3.33Å; K208-S210 PolarHBondContact O-N 2.99Å; K208-L271 HydrophobicContact CG-CD2 4.46Å; K208-E280 HydrophobicContact CD-CG 4.45Å; K208-E280 IonicContact NZ-OE1 2.69Å; K208-E280 PolarHBondContact NZ-OE1 3.37Å; K208-M283 HydrophobicContact CD-CE 4.33Å; K208-I308 PolarHBondContact NZ-O 3.16Å; K208-D310 WeakPolarHBondContact CE-O 3.2Å; K208-D310 PolarHBondContact NZ-O 3.46Å; K208-P312 HydrophobicContact CG-CG 4.23Å |
| 209 | S | 91.4 | Very high | 93.9 | Very high | 56 Ų | 56 | 34.6 Ų | 34.6 | 39% | 0.392 | 19% | 0.189 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | -11.5 | 176.3 | 64.7 | 0 | 0 | 0 | 0 | 113.7 | M205 A206 K211 F223 | M205-S209 PolarHBondContact O-N 2.96Å; M205-S209 PolarHBondContact O-OG 2.95Å; A206-S209 PolarHBondContact O-OG 3.35Å; S209-K211 PolarHBondContact O-N 3.3Å; S209-F223 WeakPolarHBondContact OG-CD2 3.47Å; S209-F223 WeakPolarHBondContact OG-CE2 3.21Å |
| 210 | S | 91.8 | Very high | 93.8 | Very high | 14 Ų | 14 | 32.2 Ų | 32.2 | 10% | 0.098 | 18% | 0.18 | C | C | . | . | trans | -76 | 122.2 | 175.5 | -177.8 | 0 | 0 | 0 | 0 | 111.1 | A206 L207 K208 T212 G213 S214 | A206-S210 PolarHBondContact O-N 2.87Å; L207-S210 WeakPolarHBondContact O-CB 3.13Å; L207-S210 PolarHBondContact O-N 3.48Å; K208-S210 PolarHBondContact O-N 2.99Å; S210-T212 PolarHBondContact O-N 3.1Å; S210-T212 PolarHBondContact OG-N 2.97Å; S210-G213 PolarHBondContact O-N 3.15Å; S210-S214 PolarHBondContact OG-O 3.32Å | ||
| 211 | K | 87.6 | Confident | 93.8 | Very high | 214 Ų | 214 | 33.7 Ų | 33.7 | 93% | 0.93 | 18% | 0.184 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | -14.3 | 172.1 | -59.7 | -177.9 | -178.3 | -179 | 0 | 113.9 | S209 | S209-K211 PolarHBondContact O-N 3.3Š|
| 212 | T | 87.3 | Confident | 93.8 | Very high | 102 Ų | 102 | 35.7 Ų | 35.7 | 63% | 0.626 | 20% | 0.198 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -107.2 | 1.2 | 179.8 | -39.7 | 0 | 0 | 0 | 0 | 112.2 | S210 S214 | S210-T212 PolarHBondContact O-N 3.1Å; S210-T212 PolarHBondContact OG-N 2.97Å; T212-S214 PolarHBondContact O-N 3.31Å; T212-S214 PolarHBondContact O-OG 3.12Å |
| 213 | G | 88.3 | Confident | 93.8 | Very high | 8 Ų | 8 | 36.2 Ų | 36.2 | 8% | 0.082 | 20% | 0.2 | C | C | . | . | S | Bend | trans | 61.4 | 8.6 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115 | S210 S314 | S210-G213 PolarHBondContact O-N 3.15Å; G213-S314 WeakPolarHBondContact CA-OG 3.2Å |
| 214 | S | 92.9 | Very high | 93.8 | Very high | 17 Ų | 17 | 36.2 Ų | 36.2 | 12% | 0.119 | 20% | 0.2 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -148.8 | 151.3 | -175.2 | 54.7 | 0 | 0 | 0 | 0 | 111.2 | S210 T212 W269 | S210-S214 PolarHBondContact OG-O 3.32Å; T212-S214 PolarHBondContact O-N 3.31Å; T212-S214 PolarHBondContact O-OG 3.12Å; S214-W269 CarbonylContact C-O 3.51Å; S214-W269 WeakPolarHBondContact CA-O 3.26Å; S214-W269 VanDerWaalsContact CB-O 3.29Å; S214-W269 WeakPolarHBondContact CB-O 3.29Å |
| 215 | L | 94.8 | Very high | 93.7 | Very high | 26 Ų | 26 | 40 Ų | 40 | 14% | 0.136 | 22% | 0.217 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -147.3 | 149.3 | -179.6 | -70.2 | 178.8 | 0 | 0 | 0 | 111.6 | A206 L207 E219 I220 W269 | A206-L215 HydrophobicContact CB-CD1 4.15Å; A206-L215 WeakPolarHBondContact O-CD1 3.38Å; L207-L215 HydrophobicContact CD2-CB 4.05Å; L207-L215 HydrophobicContact CD2-CG 4.34Å; L215-E219 HydrophobicContact CB-CB 4.3Å; L215-E219 HydrophobicContact CD1-CB 4.13Å; L215-E219 HydrophobicContact CD2-CB 3.91Å; L215-E219 HydrophobicContact CD2-CG 4.32Å; L215-E219 HydrophobicContact CG-CB 4.35Å; L215-I220 HydrophobicContact CB-CG1 4.15Å; L215-I220 HydrophobicContact CD1-CG1 4.3Å; L215-W269 PolarHBondContact N-O 3.01Å; L215-W269 PolarHBondContact O-N 2.73Å |
| 216 | P | 95.1 | Very high | 93.7 | Very high | 37 Ų | 37 | 45.6 Ų | 45.6 | 24% | 0.24 | 24% | 0.243 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -73.2 | 160 | 162.2 | 34.3 | -34.4 | 0 | 0 | 0 | 110.3 | S218 E219 I220 L268 | P216-S218 PolarHBondContact O-N 2.62Å; P216-S218 VanDerWaalsContact O-N 3.1Å; P216-E219 HydrophobicContact CG-CB 4.48Å; P216-E219 HydrophobicContact CG-CG 3.92Å; P216-E219 PolarHBondContact O-N 3.27Å; P216-E219 VanDerWaalsContact O-N 3.09Å; P216-I220 PolarHBondContact O-N 2.69Å; P216-L268 HydrophobicContact CB-CD2 4.06Å; P216-L268 HydrophobicContact CG-CD2 4.31Å |
| 217 | V | 95.2 | Very high | 93.6 | Very high | 30 Ų | 30 | 46.6 Ų | 46.6 | 18% | 0.182 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -59.9 | -26.3 | -176.7 | -165.8 | 0 | 0 | 0 | 0 | 112.9 | I220 Y221 R243 L246 | V217-I220 PolarHBondContact O-N 2.94Å; V217-Y221 HydrophobicContact CG1-CE1 3.85Å; V217-Y221 HydrophobicContact CG1-CE2 4.01Å; V217-Y221 WeakPolarHBondContact O-CD2 3.33Å; V217-Y221 PolarHBondContact O-N 3.18Å; V217-Y221 VanDerWaalsContact O-N 3.17Å; V217-R243 HydrophobicContact CG1-CG 4.33Å; V217-L246 HydrophobicContact CG1-CD1 4.11Å; V217-L246 HydrophobicContact CG2-CD1 4.06Å |
| 218 | S | 95.3 | Very high | 93.7 | Very high | 60 Ų | 60 | 46.5 Ų | 46.5 | 42% | 0.42 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -59.7 | -45 | 174.6 | 56.3 | 0 | 0 | 0 | 0 | 112.8 | P216 I220 Y221 S222 | P216-S218 PolarHBondContact O-N 2.62Å; P216-S218 VanDerWaalsContact O-N 3.1Å; S218-I220 VanDerWaalsContact C-N 3.35Å; S218-Y221 WeakPolarHBondContact O-CB 3.16Å; S218-Y221 PolarHBondContact O-N 2.92Å; S218-S222 PolarHBondContact O-N 3.21Å; S218-S222 PolarHBondContact O-OG 3.1Å |
| 219 | E | 95.7 | Very high | 93.8 | Very high | 82 Ų | 82 | 46.6 Ų | 46.6 | 38% | 0.383 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -74.1 | -29.7 | -177.5 | -61.5 | -26.2 | 110.4 | 0 | 0 | 111.9 | L215 P216 Y221 S222 F223 | L215-E219 HydrophobicContact CB-CB 4.3Å; L215-E219 HydrophobicContact CD1-CB 4.13Å; L215-E219 HydrophobicContact CD2-CB 3.91Å; L215-E219 HydrophobicContact CD2-CG 4.32Å; L215-E219 HydrophobicContact CG-CB 4.35Å; P216-E219 HydrophobicContact CG-CB 4.48Å; P216-E219 HydrophobicContact CG-CG 3.92Å; P216-E219 PolarHBondContact O-N 3.27Å; P216-E219 VanDerWaalsContact O-N 3.09Å; E219-Y221 VanDerWaalsContact C-N 3.31Å; E219-Y221 PolarHBondContact O-N 3.18Å; E219-S222 PolarHBondContact O-N 3.17Å; E219-F223 VanDerWaalsContact O-CB 3.32Å; E219-F223 WeakPolarHBondContact O-CB 3.44Å; E219-F223 PolarHBondContact O-N 3.44Å |
| 220 | I | 96.5 | Very high | 93.9 | Very high | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62 | -42.5 | 170.7 | -58.5 | 173.9 | 0 | 0 | 0 | 109.9 | I203 L215 P216 V217 S218 M224 V242 L246 | I203-I220 HydrophobicContact CG1-CG2 4.03Å; I203-I220 HydrophobicContact CG2-CD1 4.41Å; L215-I220 HydrophobicContact CB-CG1 4.15Å; L215-I220 HydrophobicContact CD1-CG1 4.3Å; P216-I220 PolarHBondContact O-N 2.69Å; V217-I220 PolarHBondContact O-N 2.94Å; S218-I220 VanDerWaalsContact C-N 3.35Å; I220-M224 HydrophobicContact CG2-SD 4.18Å; I220-M224 WeakPolarHBondContact O-CB 3.32Å; I220-M224 VanDerWaalsContact O-CG 3.28Å; I220-M224 WeakPolarHBondContact O-CG 3.42Å; I220-M224 PolarHBondContact O-N 2.9Å; I220-M224 VanDerWaalsContact O-N 3.09Å; I220-V242 HydrophobicContact CG2-CG1 3.96Å; I220-L246 HydrophobicContact CD1-CD1 4.09Å; I220-L246 HydrophobicContact CD1-CD2 4.12Å |
| 221 | Y | 96.1 | Very high | 94 | Very high | 44 Ų | 44 | 46.1 Ų | 46.1 | 17% | 0.173 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.8 | -38.2 | 173.1 | -56.6 | -35.7 | 0 | 0 | 0 | 112.5 | V217 S218 E219 K225 W238 K239 V242 R243 | V217-Y221 HydrophobicContact CG1-CE1 3.85Å; V217-Y221 HydrophobicContact CG1-CE2 4.01Å; V217-Y221 WeakPolarHBondContact O-CD2 3.33Å; V217-Y221 PolarHBondContact O-N 3.18Å; V217-Y221 VanDerWaalsContact O-N 3.17Å; S218-Y221 WeakPolarHBondContact O-CB 3.16Å; S218-Y221 PolarHBondContact O-N 2.92Å; E219-Y221 VanDerWaalsContact C-N 3.31Å; E219-Y221 PolarHBondContact O-N 3.18Å; Y221-K225 WeakPolarHBondContact O-CE 3.16Å; Y221-K225 WeakPolarHBondContact O-CG 3.38Å; Y221-K225 PolarHBondContact O-N 2.99Å; Y221-W238 AromaticContact CD1-CH2 4Å; Y221-W238 HydrophobicContact CD1-CH2 4Å; Y221-W238 AromaticContact CD1-CZ3 3.71Å; Y221-W238 HydrophobicContact CD1-CZ3 3.71Å; Y221-W238 HydrophobicContact CE1-CZ3 4.47Å; Y221-W238 HydrophobicContact CG-CH2 4.27Å; Y221-W238 HydrophobicContact CG-CZ3 4.43Å; Y221-K239 HydrophobicContact CD1-CG 4.35Å; Y221-K239 HydrophobicContact CE1-CB 3.89Å; Y221-K239 HydrophobicContact CE1-CG 4.12Å; Y221-V242 HydrophobicContact CD1-CG1 4.34Å; Y221-V242 HydrophobicContact CE1-CB 4.2Å; Y221-V242 HydrophobicContact CE1-CG1 4.01Å; Y221-R243 WeakPolarHBondContact OH-CG 3.42Å; Y221-R243 PolarHBondContact OH-NH1 3.25Å; Y221-R243 VanDerWaalsContact OH-NH1 3.09Å |
| 222 | S | 96.5 | Very high | 94.3 | Very high | 44 Ų | 44 | 42.4 Ų | 42.4 | 31% | 0.308 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -63.5 | -55.7 | 176.4 | -64.2 | 0 | 0 | 0 | 0 | 111.4 | S218 E219 M224 K225 E226 | S218-S222 PolarHBondContact O-N 3.21Å; S218-S222 PolarHBondContact O-OG 3.1Å; E219-S222 PolarHBondContact O-N 3.17Å; S222-M224 VanDerWaalsContact C-N 3.32Å; S222-M224 PolarHBondContact O-N 3.48Å; S222-K225 PolarHBondContact O-N 3.09Å; S222-K225 VanDerWaalsContact O-N 3.11Å; S222-E226 WeakPolarHBondContact O-CB 3.3Å; S222-E226 PolarHBondContact O-N 2.89Å |
| 223 | F | 96.3 | Very high | 94.5 | Very high | 12 Ų | 12 | 42.9 Ų | 42.9 | 5% | 0.053 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -52.4 | -47.1 | 178.1 | 176.6 | -86 | 0 | 0 | 0 | 112.1 | M205 A206 S209 E219 K225 E226 H227 L307 | M205-F223 HydrophobicContact CB-CE1 3.95Å; M205-F223 HydrophobicContact CB-CZ 3.88Å; A206-F223 HydrophobicContact CB-CB 3.95Å; A206-F223 HydrophobicContact CB-CD1 3.39Å; A206-F223 HydrophobicContact CB-CD2 4.17Å; A206-F223 HydrophobicContact CB-CE1 3.89Å; A206-F223 HydrophobicContact CB-CG 3.56Å; A206-F223 HydrophobicContact CB-CZ 4.48Å; S209-F223 WeakPolarHBondContact OG-CD2 3.47Å; S209-F223 WeakPolarHBondContact OG-CE2 3.21Å; E219-F223 VanDerWaalsContact O-CB 3.32Å; E219-F223 WeakPolarHBondContact O-CB 3.44Å; E219-F223 PolarHBondContact O-N 3.44Å; F223-K225 PolarHBondContact O-N 3.48Å; F223-E226 PolarHBondContact O-N 3.19Å; F223-H227 AromaticContact CD2-CE1 3.29Å; F223-H227 WeakPolarHBondContact CD2-CE1 3.42Å; F223-H227 AromaticContact CD2-ND1 3.33Å; F223-H227 VanDerWaalsContact CD2-ND1 3.33Å; F223-H227 WeakPolarHBondContact CD2-ND1 2.89Å; F223-H227 AromaticContact CE2-CE1 3.26Å; F223-H227 WeakPolarHBondContact CE2-CE1 3.24Å; F223-H227 AromaticContact CE2-CG 3.89Å; F223-H227 AromaticContact CE2-ND1 3.38Å; F223-H227 WeakPolarHBondContact CE2-ND1 3.38Å; F223-H227 AromaticContact CE2-NE2 3.66Å; F223-H227 AromaticContact CG-ND1 3.69Å; F223-H227 AromaticContact CZ-CG 3.91Å; F223-H227 AromaticContact CZ-ND1 3.79Å; F223-H227 PolarHBondContact O-N 3.03Å; F223-H227 PolarHBondContact O-ND1 3.46Å; F223-L307 HydrophobicContact CE2-CD2 3.81Å; F223-L307 HydrophobicContact CZ-CD1 4.12Å; F223-L307 HydrophobicContact CZ-CD2 3.88Å |
| 224 | M | 95.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -61.8 | -44.1 | 179.3 | -75.9 | 177.3 | 61.6 | 0 | 0 | 112.1 | Y199 L202 I220 S222 E226 F228 F231 W238 V242 | Y199-M224 HydrophobicContact CD1-CE 4.05Å; Y199-M224 HydrophobicContact CE1-CE 4.18Å; L202-M224 HydrophobicContact CB-CG 4.45Å; L202-M224 HydrophobicContact CB-SD 4.49Å; L202-M224 HydrophobicContact CD1-CE 4.2Å; I220-M224 HydrophobicContact CG2-SD 4.18Å; I220-M224 WeakPolarHBondContact O-CB 3.32Å; I220-M224 VanDerWaalsContact O-CG 3.28Å; I220-M224 WeakPolarHBondContact O-CG 3.42Å; I220-M224 PolarHBondContact O-N 2.9Å; I220-M224 VanDerWaalsContact O-N 3.09Å; S222-M224 VanDerWaalsContact C-N 3.32Å; S222-M224 PolarHBondContact O-N 3.48Å; M224-E226 VanDerWaalsContact C-N 3.34Å; M224-F228 CarbonylContact O-C 3.58Å; M224-F228 WeakPolarHBondContact O-CA 3.42Å; M224-F228 WeakPolarHBondContact O-CB 3.4Å; M224-F228 PolarHBondContact O-N 2.86Å; M224-F228 VanDerWaalsContact O-O 3.05Å; M224-F231 HydrophobicContact CB-CD2 3.97Å; M224-F231 HydrophobicContact CB-CE2 4.49Å; M224-F231 HydrophobicContact CB-CG 4.43Å; M224-F231 HydrophobicContact CE-CD1 3.99Å; M224-F231 HydrophobicContact CE-CD2 3.9Å; M224-F231 HydrophobicContact CE-CE1 3.75Å; M224-F231 HydrophobicContact CE-CE2 3.64Å; M224-F231 HydrophobicContact CE-CG 4.08Å; M224-F231 HydrophobicContact CE-CZ 3.57Å; M224-W238 HydrophobicContact CB-CZ3 4.41Å; M224-W238 HydrophobicContact CE-CE3 3.79Å; M224-W238 HydrophobicContact CE-CZ3 3.78Å; M224-W238 HydrophobicContact SD-CZ3 4.03Å; M224-V242 HydrophobicContact CE-CG2 3.75Å; M224-V242 HydrophobicContact SD-CG2 3.6Å |
| 225 | K | 95.1 | Very high | 94.5 | Very high | 80 Ų | 80 | 47.5 Ų | 47.5 | 35% | 0.348 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -65.9 | -36.5 | 176.3 | -73.5 | 175.5 | -70.3 | 157.9 | 0 | 112.5 | Y221 S222 F223 F231 K232 W238 | Y221-K225 WeakPolarHBondContact O-CE 3.16Å; Y221-K225 WeakPolarHBondContact O-CG 3.38Å; Y221-K225 PolarHBondContact O-N 2.99Å; S222-K225 PolarHBondContact O-N 3.09Å; S222-K225 VanDerWaalsContact O-N 3.11Å; F223-K225 PolarHBondContact O-N 3.48Å; K225-F231 HydrophobicContact CG-CB 4.21Å; K225-K232 HydrophobicContact CB-CG 4.03Å; K225-K232 HydrophobicContact CG-CG 4.36Å; K225-K232 WeakPolarHBondContact O-CE 3.44Å; K225-W238 HydrophobicContact CG-CH2 4.31Å; K225-W238 HydrophobicContact CG-CZ2 4.18Å |
| 226 | E | 95.1 | Very high | 94.2 | Very high | 118 Ų | 118 | 51.4 Ų | 51.4 | 55% | 0.551 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -68.2 | -59.2 | -178.3 | 179.9 | 169.2 | -135.5 | 0 | 0 | 111.1 | S222 F223 M224 A299 | S222-E226 WeakPolarHBondContact O-CB 3.3Å; S222-E226 PolarHBondContact O-N 2.89Å; F223-E226 PolarHBondContact O-N 3.19Å; M224-E226 VanDerWaalsContact C-N 3.34Å; E226-A299 WeakPolarHBondContact O-CB 3.28Å |
| 227 | H | 93.8 | Very high | 94.1 | Very high | 21 Ų | 21 | 51.9 Ų | 51.9 | 10% | 0.097 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -77.5 | -29.5 | -173.6 | -62.2 | 78.3 | 0 | 0 | 0 | 112.9 | F223 M298 A299 | F223-H227 AromaticContact CD2-CE1 3.29Å; F223-H227 WeakPolarHBondContact CD2-CE1 3.42Å; F223-H227 AromaticContact CD2-ND1 3.33Å; F223-H227 VanDerWaalsContact CD2-ND1 3.33Å; F223-H227 WeakPolarHBondContact CD2-ND1 2.89Å; F223-H227 AromaticContact CE2-CE1 3.26Å; F223-H227 WeakPolarHBondContact CE2-CE1 3.24Å; F223-H227 AromaticContact CE2-CG 3.89Å; F223-H227 AromaticContact CE2-ND1 3.38Å; F223-H227 WeakPolarHBondContact CE2-ND1 3.38Å; F223-H227 AromaticContact CE2-NE2 3.66Å; F223-H227 AromaticContact CG-ND1 3.69Å; F223-H227 AromaticContact CZ-CG 3.91Å; F223-H227 AromaticContact CZ-ND1 3.79Å; F223-H227 PolarHBondContact O-N 3.03Å; F223-H227 PolarHBondContact O-ND1 3.46Å; H227-M298 CarbonylContact O-C 3.45Å; H227-M298 WeakPolarHBondContact O-CA 3.34Å; H227-A299 PolarHBondContact O-N 2.87Å |
| 228 | F | 95.1 | Very high | 94.1 | Very high | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 28% | 0.279 | C | S | . | . | trans | -127.5 | 83.3 | -178.7 | -57.3 | -86.2 | 0 | 0 | 0 | 110.4 | P195 Y197 L202 M205 M224 Y230 F231 M298 | P195-F228 HydrophobicContact CB-CD1 3.84Å; P195-F228 HydrophobicContact CB-CE1 4.18Å; P195-F228 HydrophobicContact CB-CG 4.49Å; P195-F228 HydrophobicContact CG-CB 3.72Å; P195-F228 HydrophobicContact CG-CD1 3.44Å; P195-F228 VanDerWaalsContact CG-CD1 3.44Å; P195-F228 HydrophobicContact CG-CE1 4.26Å; P195-F228 HydrophobicContact CG-CG 3.77Å; Y197-F228 HydrophobicContact CD2-CE1 4.39Å; Y197-F228 HydrophobicContact CD2-CZ 4.33Å; L202-F228 HydrophobicContact CD2-CD1 4.38Å; L202-F228 HydrophobicContact CD2-CD2 3.66Å; L202-F228 HydrophobicContact CD2-CE1 4.15Å; L202-F228 HydrophobicContact CD2-CE2 3.42Å; L202-F228 VanDerWaalsContact CD2-CE2 3.42Å; L202-F228 HydrophobicContact CD2-CG 4.15Å; L202-F228 HydrophobicContact CD2-CZ 3.68Å; M205-F228 HydrophobicContact CE-CE2 4.07Å; M205-F228 HydrophobicContact CE-CZ 3.77Å; M205-F228 HydrophobicContact SD-CZ 4.45Å; M224-F228 CarbonylContact O-C 3.58Å; M224-F228 WeakPolarHBondContact O-CA 3.42Å; M224-F228 WeakPolarHBondContact O-CB 3.4Å; M224-F228 PolarHBondContact O-N 2.86Å; M224-F228 VanDerWaalsContact O-O 3.05Å; F228-Y230 PolarHBondContact O-N 2.83Å; F228-F231 HydrophobicContact CB-CD2 3.85Å; F228-F231 HydrophobicContact CB-CE2 3.93Å; F228-F231 WeakPolarHBondContact O-CD2 3.37Å; F228-F231 PolarHBondContact O-N 3.03Å; F228-M298 HydrophobicContact CD1-CG 3.64Å; F228-M298 HydrophobicContact CE1-CG 3.27Å; F228-M298 HydrophobicContact CE1-SD 3.99Å; F228-M298 HydrophobicContact CZ-CE 4.5Å; F228-M298 HydrophobicContact CZ-CG 3.95Å; F228-M298 HydrophobicContact CZ-SD 4.21Å | ||
| 229 | P | 94.1 | Very high | 94.2 | Very high | 13 Ų | 13 | 51.3 Ų | 51.3 | 8% | 0.084 | 27% | 0.273 | C | S | . | . | G | 310 helix | trans | -62.7 | -11.9 | -167 | -24.5 | 34.7 | 0 | 0 | 0 | 115.8 | Y192 F231 K232 A299 | Y192-P229 HydrophobicContact CD1-CG 4.4Å; Y192-P229 HydrophobicContact CD2-CB 3.53Å; Y192-P229 HydrophobicContact CD2-CG 3.82Å; Y192-P229 HydrophobicContact CE1-CG 4.37Å; Y192-P229 HydrophobicContact CE2-CB 3.83Å; Y192-P229 HydrophobicContact CE2-CG 3.77Å; Y192-P229 HydrophobicContact CG-CB 4.06Å; Y192-P229 HydrophobicContact CG-CG 4.13Å; P229-F231 PolarHBondContact O-N 3.09Å; P229-K232 HydrophobicContact CB-CD 4.16Å; P229-K232 VanDerWaalsContact O-CB 3.24Å; P229-K232 WeakPolarHBondContact O-CB 3.42Å; P229-K232 WeakPolarHBondContact O-CG 3.41Å; P229-K232 PolarHBondContact O-N 2.83Å; P229-A299 HydrophobicContact CG-CB 3.79Å |
| 230 | Y | 93.9 | Very high | 94.2 | Very high | 53 Ų | 53 | 51.9 Ų | 51.9 | 21% | 0.208 | 28% | 0.278 | C | S | . | . | G | 310 helix | trans | -45.2 | -40.3 | 164.7 | 173.5 | -102.3 | 0 | 0 | 0 | 112.7 | K194 F228 K232 T233 A234 | K194-Y230 HydrophobicContact CB-CD1 4.24Å; K194-Y230 HydrophobicContact CB-CD2 4.23Å; K194-Y230 HydrophobicContact CB-CE1 3.9Å; K194-Y230 HydrophobicContact CB-CE2 3.89Å; K194-Y230 HydrophobicContact CB-CG 4.4Å; K194-Y230 HydrophobicContact CD-CE1 4.26Å; K194-Y230 HydrophobicContact CG-CD1 4.23Å; K194-Y230 HydrophobicContact CG-CE1 3.7Å; F228-Y230 PolarHBondContact O-N 2.83Å; Y230-K232 PolarHBondContact O-N 3.39Å; Y230-T233 PolarHBondContact O-N 3.21Å; Y230-T233 VanDerWaalsContact O-N 3.15Å; Y230-T233 PolarHBondContact O-OG1 2.96Å; Y230-A234 HydrophobicContact CD1-CB 4.16Å; Y230-A234 HydrophobicContact CE1-CB 3.75Å; Y230-A234 WeakPolarHBondContact O-CB 2.95Å; Y230-A234 PolarHBondContact O-N 3.3Å |
| 231 | F | 94.3 | Very high | 94.2 | Very high | 7 Ų | 7 | 53.8 Ų | 53.8 | 3% | 0.031 | 29% | 0.292 | C | S | . | . | G | 310 helix | trans | -73.2 | -4.4 | 179.6 | -60.9 | -67.9 | 0 | 0 | 0 | 114.5 | P195 Y199 L202 M224 K225 F228 P229 A234 W238 | P195-F231 HydrophobicContact CG-CE2 3.94Å; P195-F231 HydrophobicContact CG-CZ 4.35Å; Y199-F231 HydrophobicContact CE1-CE1 4Å; Y199-F231 HydrophobicContact CE1-CZ 4.32Å; L202-F231 HydrophobicContact CD1-CE2 3.86Å; L202-F231 HydrophobicContact CD1-CZ 3.68Å; M224-F231 HydrophobicContact CB-CD2 3.97Å; M224-F231 HydrophobicContact CB-CE2 4.49Å; M224-F231 HydrophobicContact CB-CG 4.43Å; M224-F231 HydrophobicContact CE-CD1 3.99Å; M224-F231 HydrophobicContact CE-CD2 3.9Å; M224-F231 HydrophobicContact CE-CE1 3.75Å; M224-F231 HydrophobicContact CE-CE2 3.64Å; M224-F231 HydrophobicContact CE-CG 4.08Å; M224-F231 HydrophobicContact CE-CZ 3.57Å; K225-F231 HydrophobicContact CG-CB 4.21Å; F228-F231 HydrophobicContact CB-CD2 3.85Å; F228-F231 HydrophobicContact CB-CE2 3.93Å; F228-F231 WeakPolarHBondContact O-CD2 3.37Å; F228-F231 PolarHBondContact O-N 3.03Å; P229-F231 PolarHBondContact O-N 3.09Å; F231-A234 HydrophobicContact CD1-CB 4.42Å; F231-W238 HydrophobicContact CB-CD2 4.45Å; F231-W238 HydrophobicContact CB-CH2 4.28Å; F231-W238 HydrophobicContact CB-CZ2 3.97Å; F231-W238 HydrophobicContact CD1-CB 4.27Å; F231-W238 AromaticContact CD1-CD2 3.79Å; F231-W238 HydrophobicContact CD1-CD2 3.79Å; F231-W238 HydrophobicContact CD1-CE3 4.03Å; F231-W238 AromaticContact CD1-CG 3.9Å; F231-W238 HydrophobicContact CD1-CG 3.9Å; F231-W238 HydrophobicContact CE1-CB 4.38Å; F231-W238 HydrophobicContact CE1-CG 4.48Å; F231-W238 HydrophobicContact CG-CD2 4.46Å; F231-W238 PolarHBondContact O-NE1 2.74Å |
| 232 | K | 92.9 | Very high | 94.3 | Very high | 137 Ų | 137 | 51.7 Ų | 51.7 | 60% | 0.596 | 28% | 0.284 | S | S | * | . | G | 310 helix | trans | -77.2 | -26.5 | 169.4 | -57 | -177.7 | -169.7 | -176.3 | 0 | 112.2 | K225 P229 Y230 | K225-K232 HydrophobicContact CB-CG 4.03Å; K225-K232 HydrophobicContact CG-CG 4.36Å; K225-K232 WeakPolarHBondContact O-CE 3.44Å; P229-K232 HydrophobicContact CB-CD 4.16Å; P229-K232 VanDerWaalsContact O-CB 3.24Å; P229-K232 WeakPolarHBondContact O-CB 3.42Å; P229-K232 WeakPolarHBondContact O-CG 3.41Å; P229-K232 PolarHBondContact O-N 2.83Å; Y230-K232 PolarHBondContact O-N 3.39Å |
| 233 | T | 91.2 | Very high | 94.3 | Very high | 111 Ų | 111 | 55 Ų | 55 | 68% | 0.681 | 29% | 0.289 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -117.9 | -8.2 | -177.8 | 54.3 | 0 | 0 | 0 | 0 | 113.9 | Y230 | Y230-T233 PolarHBondContact O-N 3.21Å; Y230-T233 VanDerWaalsContact O-N 3.15Å; Y230-T233 PolarHBondContact O-OG1 2.96Å |
| 234 | A | 90.7 | Very high | 94.3 | Very high | 14 Ų | 14 | 59.3 Ų | 59.3 | 12% | 0.116 | 31% | 0.309 | C | S | . | . | S | Bend | trans | -69.3 | 143.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y230 F231 | Y230-A234 HydrophobicContact CD1-CB 4.16Å; Y230-A234 HydrophobicContact CE1-CB 3.75Å; Y230-A234 WeakPolarHBondContact O-CB 2.95Å; Y230-A234 PolarHBondContact O-N 3.3Å; F231-A234 HydrophobicContact CD1-CB 4.42Å |
| 235 | P | 90.9 | Very high | 94.3 | Very high | 108 Ų | 108 | 60.7 Ų | 60.7 | 70% | 0.701 | 32% | 0.317 | S | S | * | . | trans | -58.7 | 144 | 178.5 | -24.9 | 34 | 0 | 0 | 0 | 114.1 | G237 W238 | P235-G237 PolarHBondContact O-N 3.48Å; P235-W238 PolarHBondContact O-N 3.21Å | ||
| 236 | D | 88.5 | Confident | 94.4 | Very high | 108 Ų | 108 | 57 Ų | 57 | 58% | 0.578 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59 | -14.9 | -165.6 | -104 | -13.6 | 0 | 0 | 0 | 116.7 | W238 K239 | D236-W238 PolarHBondContact O-N 3.49Å; D236-W238 VanDerWaalsContact O-N 3.12Å; D236-K239 WeakPolarHBondContact O-CB 3.28Å; D236-K239 PolarHBondContact O-N 3.49Å; D236-K239 VanDerWaalsContact O-N 3.12Å; D236-K239 WeakPolarHBondContact OD1-CD 2.97Å; D236-K239 WeakPolarHBondContact OD1-CE 3.43Å; D236-K239 IonicContact OD1-NZ 2.67Å; D236-K239 PolarHBondContact OD1-NZ 3.25Å; D236-K239 IonicContact OD2-NZ 2.62Å |
| 237 | G | 93.6 | Very high | 94.4 | Very high | 47 Ų | 47 | 55.5 Ų | 55.5 | 49% | 0.485 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -53.6 | -27.2 | 171.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | P235 K239 N240 S241 | P235-G237 PolarHBondContact O-N 3.48Å; G237-K239 VanDerWaalsContact C-N 3.25Å; G237-K239 PolarHBondContact O-N 3.46Å; G237-N240 WeakPolarHBondContact O-CA 3.44Å; G237-N240 WeakPolarHBondContact O-CB 3.44Å; G237-N240 PolarHBondContact O-N 3.1Å; G237-S241 PolarHBondContact O-N 2.95Å; G237-S241 VanDerWaalsContact O-N 3.09Å; G237-S241 PolarHBondContact O-OG 3.33Å |
| 238 | W | 95.6 | Very high | 94.4 | Very high | 11 Ų | 11 | 59.9 Ų | 59.9 | 4% | 0.042 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -60 | -34.7 | 177.4 | 75.3 | -103.5 | 0 | 0 | 0 | 112.7 | Y199 Y221 M224 K225 F231 P235 D236 N240 S241 V242 | Y199-W238 HydrophobicContact CE1-CB 4.35Å; Y221-W238 AromaticContact CD1-CH2 4Å; Y221-W238 HydrophobicContact CD1-CH2 4Å; Y221-W238 AromaticContact CD1-CZ3 3.71Å; Y221-W238 HydrophobicContact CD1-CZ3 3.71Å; Y221-W238 HydrophobicContact CE1-CZ3 4.47Å; Y221-W238 HydrophobicContact CG-CH2 4.27Å; Y221-W238 HydrophobicContact CG-CZ3 4.43Å; M224-W238 HydrophobicContact CB-CZ3 4.41Å; M224-W238 HydrophobicContact CE-CE3 3.79Å; M224-W238 HydrophobicContact CE-CZ3 3.78Å; M224-W238 HydrophobicContact SD-CZ3 4.03Å; K225-W238 HydrophobicContact CG-CH2 4.31Å; K225-W238 HydrophobicContact CG-CZ2 4.18Å; F231-W238 HydrophobicContact CB-CD2 4.45Å; F231-W238 HydrophobicContact CB-CH2 4.28Å; F231-W238 HydrophobicContact CB-CZ2 3.97Å; F231-W238 HydrophobicContact CD1-CB 4.27Å; F231-W238 AromaticContact CD1-CD2 3.79Å; F231-W238 HydrophobicContact CD1-CD2 3.79Å; F231-W238 HydrophobicContact CD1-CE3 4.03Å; F231-W238 AromaticContact CD1-CG 3.9Å; F231-W238 HydrophobicContact CD1-CG 3.9Å; F231-W238 HydrophobicContact CE1-CB 4.38Å; F231-W238 HydrophobicContact CE1-CG 4.48Å; F231-W238 HydrophobicContact CG-CD2 4.46Å; F231-W238 PolarHBondContact O-NE1 2.74Å; P235-W238 PolarHBondContact O-N 3.21Å; D236-W238 PolarHBondContact O-N 3.49Å; D236-W238 VanDerWaalsContact O-N 3.12Å; W238-N240 PolarHBondContact O-N 3.26Å; W238-S241 WeakPolarHBondContact O-CB 3.2Å; W238-S241 PolarHBondContact O-N 3.01Å; W238-V242 HydrophobicContact CE3-CG2 4Å; W238-V242 HydrophobicContact CZ3-CG2 4.25Å; W238-V242 WeakPolarHBondContact O-CG2 3.5Å; W238-V242 PolarHBondContact O-N 3Å |
| 239 | K | 95.6 | Very high | 94.4 | Very high | 68 Ų | 68 | 61.7 Ų | 61.7 | 30% | 0.296 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -63.2 | -32.8 | 175.4 | -62.5 | 170.7 | -178.9 | 163.4 | 0 | 111.2 | Y221 D236 G237 R243 | Y221-K239 HydrophobicContact CD1-CG 4.35Å; Y221-K239 HydrophobicContact CE1-CB 3.89Å; Y221-K239 HydrophobicContact CE1-CG 4.12Å; D236-K239 WeakPolarHBondContact O-CB 3.28Å; D236-K239 PolarHBondContact O-N 3.49Å; D236-K239 VanDerWaalsContact O-N 3.12Å; D236-K239 WeakPolarHBondContact OD1-CD 2.97Å; D236-K239 WeakPolarHBondContact OD1-CE 3.43Å; D236-K239 IonicContact OD1-NZ 2.67Å; D236-K239 PolarHBondContact OD1-NZ 3.25Å; D236-K239 IonicContact OD2-NZ 2.62Å; G237-K239 VanDerWaalsContact C-N 3.25Å; G237-K239 PolarHBondContact O-N 3.46Å; K239-R243 WeakPolarHBondContact O-CG 3.44Å; K239-R243 PolarHBondContact O-N 2.91Å; K239-R243 PolarHBondContact O-NH1 3.39Å |
| 240 | N | 96.6 | Very high | 94.4 | Very high | 93 Ų | 93 | 69.2 Ų | 69.2 | 50% | 0.497 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -73 | -41.7 | 175 | -157.7 | 43.4 | 0 | 0 | 0 | 111.6 | G237 W238 V242 R243 H244 | G237-N240 WeakPolarHBondContact O-CA 3.44Å; G237-N240 WeakPolarHBondContact O-CB 3.44Å; G237-N240 PolarHBondContact O-N 3.1Å; W238-N240 PolarHBondContact O-N 3.26Å; N240-V242 VanDerWaalsContact C-N 3.27Å; N240-V242 PolarHBondContact O-N 3.39Å; N240-R243 PolarHBondContact O-N 3.14Å; N240-R243 PolarHBondContact OD1-NH2 3.11Å; N240-H244 WeakPolarHBondContact O-CB 3.43Å; N240-H244 PolarHBondContact O-N 2.92Å |
| 241 | S | 96.9 | Very high | 94.4 | Very high | 41 Ų | 41 | 67.2 Ų | 67.2 | 29% | 0.287 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -58.4 | -37.9 | 174.4 | -51 | 0 | 0 | 0 | 0 | 112.6 | G237 W238 N245 | G237-S241 PolarHBondContact O-N 2.95Å; G237-S241 VanDerWaalsContact O-N 3.09Å; G237-S241 PolarHBondContact O-OG 3.33Å; W238-S241 WeakPolarHBondContact O-CB 3.2Å; W238-S241 PolarHBondContact O-N 3.01Å; S241-N245 WeakPolarHBondContact O-CB 3.33Å; S241-N245 PolarHBondContact O-N 3.16Å; S241-N245 PolarHBondContact O-ND2 3.31Å |
| 242 | V | 97 | Very high | 94.5 | Very high | 0 Ų | 0 | 67.5 Ų | 67.5 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -64.2 | -51.3 | 174.6 | 169.8 | 0 | 0 | 0 | 0 | 111.5 | Y199 I203 I220 Y221 M224 W238 N240 H244 N245 L246 | Y199-V242 HydrophobicContact CD1-CG2 3.93Å; Y199-V242 HydrophobicContact CE1-CG2 4.34Å; I203-V242 HydrophobicContact CD1-CG1 4.22Å; I203-V242 HydrophobicContact CG1-CG1 4.28Å; I220-V242 HydrophobicContact CG2-CG1 3.96Å; Y221-V242 HydrophobicContact CD1-CG1 4.34Å; Y221-V242 HydrophobicContact CE1-CB 4.2Å; Y221-V242 HydrophobicContact CE1-CG1 4.01Å; M224-V242 HydrophobicContact CE-CG2 3.75Å; M224-V242 HydrophobicContact SD-CG2 3.6Å; W238-V242 HydrophobicContact CE3-CG2 4Å; W238-V242 HydrophobicContact CZ3-CG2 4.25Å; W238-V242 WeakPolarHBondContact O-CG2 3.5Å; W238-V242 PolarHBondContact O-N 3Å; N240-V242 VanDerWaalsContact C-N 3.27Å; N240-V242 PolarHBondContact O-N 3.39Å; V242-H244 VanDerWaalsContact C-N 3.32Å; V242-H244 PolarHBondContact O-N 2.86Å; V242-N245 PolarHBondContact O-N 3.29Å; V242-L246 HydrophobicContact CG1-CD1 4.31Å; V242-L246 WeakPolarHBondContact O-CG 3.36Å; V242-L246 PolarHBondContact O-N 2.93Å |
| 243 | R | 96.4 | Very high | 94.6 | Very high | 113 Ų | 113 | 64.3 Ų | 64.3 | 43% | 0.426 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -57.5 | -44.7 | 176.7 | -69.2 | -174.5 | -57.9 | -97.5 | 12.2 | 112.2 | V217 Y221 K239 N240 L246 S247 | V217-R243 HydrophobicContact CG1-CG 4.33Å; Y221-R243 WeakPolarHBondContact OH-CG 3.42Å; Y221-R243 PolarHBondContact OH-NH1 3.25Å; Y221-R243 VanDerWaalsContact OH-NH1 3.09Å; K239-R243 WeakPolarHBondContact O-CG 3.44Å; K239-R243 PolarHBondContact O-N 2.91Å; K239-R243 PolarHBondContact O-NH1 3.39Å; N240-R243 PolarHBondContact O-N 3.14Å; N240-R243 PolarHBondContact OD1-NH2 3.11Å; R243-L246 WeakPolarHBondContact O-CB 3.38Å; R243-L246 PolarHBondContact O-N 3.03Å; R243-S247 PolarHBondContact O-N 2.89Å; R243-S247 VanDerWaalsContact O-N 3.14Å; R243-S247 PolarHBondContact O-OG 3.18Å |
| 244 | H | 97 | Very high | 94.7 | Very high | 102 Ų | 102 | 64.3 Ų | 64.3 | 47% | 0.472 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.7 | -42.4 | 177 | 174.9 | 71.1 | 0 | 0 | 0 | 112.2 | N240 V242 L246 S247 L248 | N240-H244 WeakPolarHBondContact O-CB 3.43Å; N240-H244 PolarHBondContact O-N 2.92Å; V242-H244 VanDerWaalsContact C-N 3.32Å; V242-H244 PolarHBondContact O-N 2.86Å; H244-L246 PolarHBondContact O-N 3.47Å; H244-S247 WeakPolarHBondContact CA-OG 3.25Å; H244-S247 PolarHBondContact O-N 2.88Å; H244-S247 PolarHBondContact O-OG 3.48Å; H244-L248 WeakPolarHBondContact O-CB 3.43Å; H244-L248 PolarHBondContact O-N 3.09Å |
| 245 | N | 97.1 | Very high | 94.7 | Very high | 29 Ų | 29 | 66 Ų | 66 | 16% | 0.155 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -62.2 | -41.3 | 175.8 | -92 | -110.1 | 0 | 0 | 0 | 112.2 | S200 I203 S241 V242 L248 N249 | S200-N245 PolarHBondContact N-OD1 3.34Å; S200-N245 PolarHBondContact OG-OD1 3.27Å; I203-N245 HydrophobicContact CD1-CB 3.67Å; S241-N245 WeakPolarHBondContact O-CB 3.33Å; S241-N245 PolarHBondContact O-N 3.16Å; S241-N245 PolarHBondContact O-ND2 3.31Å; V242-N245 PolarHBondContact O-N 3.29Å; N245-L248 PolarHBondContact O-N 3.42Å; N245-N249 WeakPolarHBondContact O-CB 3.46Å; N245-N249 PolarHBondContact O-N 2.83Å |
| 246 | L | 96 | Very high | 94.3 | Very high | 3 Ų | 3 | 67.3 Ų | 67.3 | 2% | 0.016 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -60 | -44.1 | 176 | -70.6 | 168.5 | 0 | 0 | 0 | 111.7 | I203 V217 I220 V242 R243 H244 F252 W269 | I203-L246 HydrophobicContact CD1-CD2 4.21Å; I203-L246 HydrophobicContact CD1-CG 4.13Å; I203-L246 HydrophobicContact CG2-CD2 3.66Å; V217-L246 HydrophobicContact CG1-CD1 4.11Å; V217-L246 HydrophobicContact CG2-CD1 4.06Å; I220-L246 HydrophobicContact CD1-CD1 4.09Å; I220-L246 HydrophobicContact CD1-CD2 4.12Å; V242-L246 HydrophobicContact CG1-CD1 4.31Å; V242-L246 WeakPolarHBondContact O-CG 3.36Å; V242-L246 PolarHBondContact O-N 2.93Å; R243-L246 WeakPolarHBondContact O-CB 3.38Å; R243-L246 PolarHBondContact O-N 3.03Å; H244-L246 PolarHBondContact O-N 3.47Å; L246-F252 HydrophobicContact CD2-CB 4.22Å; L246-F252 HydrophobicContact CD2-CD2 4.26Å; L246-F252 HydrophobicContact CD2-CG 4.12Å; L246-W269 HydrophobicContact CB-CD2 3.98Å; L246-W269 HydrophobicContact CB-CE3 3.96Å; L246-W269 HydrophobicContact CB-CH2 3.98Å; L246-W269 HydrophobicContact CB-CZ2 4.01Å; L246-W269 HydrophobicContact CB-CZ3 3.96Å; L246-W269 HydrophobicContact CD1-CD2 4.25Å; L246-W269 HydrophobicContact CD1-CG 4.19Å; L246-W269 HydrophobicContact CD2-CB 4.06Å; L246-W269 HydrophobicContact CD2-CD2 3.91Å; L246-W269 HydrophobicContact CD2-CE3 4.06Å; L246-W269 HydrophobicContact CD2-CG 3.91Å; L246-W269 HydrophobicContact CG-CD2 4.27Å; L246-W269 HydrophobicContact CG-CG 4.5Å; L246-W269 WeakPolarHBondContact O-CZ3 3.39Å |
| 247 | S | 94.9 | Very high | 93.5 | Very high | 87 Ų | 87 | 65.4 Ų | 65.4 | 61% | 0.608 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -76 | -31 | 178.4 | 51.4 | 0 | 0 | 0 | 0 | 115 | R243 H244 | R243-S247 PolarHBondContact O-N 2.89Å; R243-S247 VanDerWaalsContact O-N 3.14Å; R243-S247 PolarHBondContact O-OG 3.18Å; H244-S247 WeakPolarHBondContact CA-OG 3.25Å; H244-S247 PolarHBondContact O-N 2.88Å; H244-S247 PolarHBondContact O-OG 3.48Å |
| 248 | L | 94.8 | Very high | 92.1 | Very high | 113 Ų | 113 | 73.6 Ų | 73.6 | 59% | 0.592 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -87.4 | -38.6 | -173.7 | 179.3 | 148.3 | 0 | 0 | 0 | 112.6 | H244 N245 K250 | H244-L248 WeakPolarHBondContact O-CB 3.43Å; H244-L248 PolarHBondContact O-N 3.09Å; N245-L248 PolarHBondContact O-N 3.42Å; L248-K250 PolarHBondContact O-N 3.24Å |
| 249 | N | 94 | Very high | 90.3 | Very high | 38 Ų | 38 | 78 Ų | 78 | 20% | 0.203 | 39% | 0.393 | C | S | . | . | trans | -90.5 | 113.9 | -169.5 | -171.4 | -7.4 | 0 | 0 | 0 | 111.6 | S200 N245 C251 F252 | S200-N249 PolarHBondContact OG-ND2 3.08Å; N245-N249 WeakPolarHBondContact O-CB 3.46Å; N245-N249 PolarHBondContact O-N 2.83Å; N249-C251 PolarHBondContact O-N 3.23Å; N249-C251 WeakPolarHBondContact OD1-CB 3.48Å; N249-C251 PolarHBondContact OD1-N 2.61Å; N249-C251 PolarHBondContact OD1-SG 2.96Å; N249-F252 HydrophobicContact CB-CD2 3.95Å; N249-F252 HydrophobicContact CB-CE2 4Å; N249-F252 PolarHBondContact O-N 3.36Å | ||
| 250 | K | 94.3 | Very high | 88.2 | Confident | 171 Ų | 171 | 78 Ų | 78 | 74% | 0.743 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59 | 1.9 | 174.7 | -57 | -173.6 | -179.2 | -175.3 | 0 | 115.1 | L248 F252 | L248-K250 PolarHBondContact O-N 3.24Å; K250-F252 VanDerWaalsContact C-N 3.35Å |
| 251 | C | 93.9 | Very high | 86.3 | Confident | 10 Ų | 10 | 78.3 Ų | 78.3 | 7% | 0.068 | 43% | 0.427 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.2 | -13.6 | 167.2 | -54.9 | 0 | 0 | 0 | 0 | 112.9 | N249 N272 R275 M279 | N249-C251 PolarHBondContact O-N 3.23Å; N249-C251 WeakPolarHBondContact OD1-CB 3.48Å; N249-C251 PolarHBondContact OD1-N 2.61Å; N249-C251 PolarHBondContact OD1-SG 2.96Å; C251-N272 PolarHBondContact O-N 3.27Å; C251-R275 HydrophobicContact CB-CB 4.05Å; C251-M279 HydrophobicContact CB-CE 3.46Å; C251-M279 VanDerWaalsContact CB-CE 3.46Å |
| 252 | F | 95.7 | Very high | 84.2 | Confident | 13 Ų | 13 | 79.4 Ų | 79.4 | 6% | 0.057 | 43% | 0.434 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116 | 145.7 | 176.9 | -48.8 | -58 | 0 | 0 | 0 | 110.7 | S200 I203 A204 L207 L246 N249 K250 W269 A270 L271 M279 | S200-F252 WeakPolarHBondContact O-CZ 3.47Å; I203-F252 HydrophobicContact CB-CE1 4.13Å; I203-F252 HydrophobicContact CB-CE2 4.31Å; I203-F252 HydrophobicContact CB-CZ 3.81Å; I203-F252 HydrophobicContact CD1-CE2 4.21Å; I203-F252 HydrophobicContact CG2-CD1 3.84Å; I203-F252 HydrophobicContact CG2-CD2 4.38Å; I203-F252 HydrophobicContact CG2-CE1 3.46Å; I203-F252 VanDerWaalsContact CG2-CE1 3.46Å; I203-F252 HydrophobicContact CG2-CE2 4.05Å; I203-F252 HydrophobicContact CG2-CG 4.3Å; I203-F252 HydrophobicContact CG2-CZ 3.58Å; A204-F252 HydrophobicContact CB-CE1 4.46Å; L207-F252 HydrophobicContact CD1-CD1 3.65Å; L207-F252 HydrophobicContact CD1-CE1 3.97Å; L246-F252 HydrophobicContact CD2-CB 4.22Å; L246-F252 HydrophobicContact CD2-CD2 4.26Å; L246-F252 HydrophobicContact CD2-CG 4.12Å; N249-F252 HydrophobicContact CB-CD2 3.95Å; N249-F252 HydrophobicContact CB-CE2 4Å; N249-F252 PolarHBondContact O-N 3.36Å; K250-F252 VanDerWaalsContact C-N 3.35Å; F252-W269 HydrophobicContact CB-CE3 4.18Å; F252-A270 WeakPolarHBondContact CA-O 3.04Å; F252-L271 HydrophobicContact CD1-CD1 3.94Å; F252-L271 HydrophobicContact CE1-CD1 3.65Å; F252-M279 HydrophobicContact CE1-CE 4.29Å; F252-M279 HydrophobicContact CZ-CE 3.86Å |
| 253 | E | 95 | Very high | 82.3 | Confident | 70 Ų | 70 | 85.6 Ų | 85.6 | 33% | 0.327 | 48% | 0.478 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.8 | 140.8 | 178.5 | 58.9 | -170.5 | -136.9 | 0 | 0 | 111.2 | V255 W269 A270 N272 | E253-V255 HydrophobicContact CG-CG2 4.34Å; E253-V255 PolarHBondContact O-N 3.09Å; E253-W269 CarbonylContact O-C 3.58Å; E253-W269 WeakPolarHBondContact O-CA 3.37Å; E253-A270 HydrophobicContact CG-CB 4.17Å; E253-A270 PolarHBondContact N-O 2.93Å; E253-A270 PolarHBondContact O-N 3.15Å; E253-N272 WeakPolarHBondContact OE2-CA 3.33Å; E253-N272 WeakPolarHBondContact OE2-CB 3.41Å; E253-N272 PolarHBondContact OE2-ND2 3.49Å |
| 254 | K | 94.6 | Very high | 80.6 | Confident | 111 Ų | 111 | 91.6 Ų | 91.6 | 48% | 0.483 | 50% | 0.501 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.4 | 110 | 176 | 180 | -150.2 | 174.1 | -153.5 | 0 | 108.4 | E256 C267 L268 W269 | K254-E256 IonicContact NZ-OE1 2.91Å; K254-E256 PolarHBondContact NZ-OE1 2.67Å; K254-C267 HydrophobicContact CD-CB 4.38Å; K254-C267 HydrophobicContact CG-CB 3.79Å; K254-L268 CarbonylContact C-O 3.5Å; K254-L268 WeakPolarHBondContact CA-O 3.38Å; K254-W269 HydrophobicContact CB-CE3 4.39Å; K254-W269 HydrophobicContact CB-CH2 4.21Å; K254-W269 HydrophobicContact CB-CZ2 4.46Å; K254-W269 HydrophobicContact CB-CZ3 4.16Å |
| 255 | V | 90.6 | Very high | 79.3 | Confident | 49 Ų | 49 | 95.2 Ų | 95.2 | 30% | 0.297 | 52% | 0.515 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.3 | 126.5 | 178.5 | 179.4 | 0 | 0 | 0 | 0 | 110.2 | E253 L268 A270 | E253-V255 HydrophobicContact CG-CG2 4.34Å; E253-V255 PolarHBondContact O-N 3.09Å; V255-L268 HydrophobicContact CB-CB 4.33Å; V255-L268 PolarHBondContact N-O 3.34Å; V255-L268 PolarHBondContact O-N 2.98Å; V255-A270 HydrophobicContact CG2-CB 3.49Å; V255-A270 VanDerWaalsContact CG2-CB 3.49Å |
| 256 | E | 82.4 | Confident | 78.2 | Confident | 136 Ų | 136 | 96.6 Ų | 96.6 | 64% | 0.636 | 54% | 0.536 | S | S | * | . | trans | -86 | 128.8 | 179.4 | -53.6 | -152.1 | 139.3 | 0 | 0 | 111.1 | K254 K258 | K254-E256 IonicContact NZ-OE1 2.91Å; K254-E256 PolarHBondContact NZ-OE1 2.67Å; E256-K258 PolarHBondContact O-N 2.89Å; E256-K258 VanDerWaalsContact O-N 3.16Å | ||
| 257 | T | 71.8 | Confident | 77.9 | Confident | 68 Ų | 68 | 98.9 Ų | 98.9 | 42% | 0.417 | 55% | 0.551 | S | S | . | * | trans | -79.6 | 101.8 | -176.5 | -64.1 | 0 | 0 | 0 | 0 | 109.8 | S259 L268 | T257-S259 VanDerWaalsContact CG2-OG 3.3Å; T257-S259 WeakPolarHBondContact CG2-OG 3.48Å; T257-S259 PolarHBondContact O-N 2.91Å; T257-L268 WeakPolarHBondContact OG1-CD1 3.32Å | ||
| 258 | K | 63.8 | Low | 77.9 | Confident | 220 Ų | 220 | 96.8 Ų | 96.8 | 96% | 0.957 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | -1 | -177.9 | -59.3 | -174.4 | 179.2 | -177.4 | 0 | 115.8 | E256 | E256-K258 PolarHBondContact O-N 2.89Å; E256-K258 VanDerWaalsContact O-N 3.16Å |
| 259 | S | 58 | Low | 77.9 | Confident | 103 Ų | 103 | 93.1 Ų | 93.1 | 72% | 0.72 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -121.5 | 17.9 | -165.3 | 57.4 | 0 | 0 | 0 | 0 | 115.4 | T257 | T257-S259 VanDerWaalsContact CG2-OG 3.3Å; T257-S259 WeakPolarHBondContact CG2-OG 3.48Å; T257-S259 PolarHBondContact O-N 2.91Å |
| 260 | S | 51.6 | Low | 78 | Confident | 69 Ų | 69 | 91.9 Ų | 91.9 | 48% | 0.483 | 51% | 0.507 | S | S | . | . | trans | -153.8 | 119.1 | 170.1 | -148.8 | 0 | 0 | 0 | 0 | 115.5 | S262 | S260-S262 PolarHBondContact O-N 3.31Å; S260-S262 WeakPolarHBondContact OG-CB 3.36Å; S260-S262 PolarHBondContact OG-N 2.91Å | ||
| 261 | G | 56.4 | Low | 78 | Confident | 99 Ų | 99 | 84.1 Ų | 84.1 | 100% | 1.021 | 47% | 0.473 | S | S | * | . | trans | -72.6 | 25.9 | 161.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 262 | S | 53.6 | Low | 78 | Confident | 63 Ų | 63 | 85.7 Ų | 85.7 | 44% | 0.441 | 48% | 0.481 | S | S | . | . | trans | -111.6 | 95.8 | 179 | -172.1 | 0 | 0 | 0 | 0 | 109.7 | S260 R264 K265 | S260-S262 PolarHBondContact O-N 3.31Å; S260-S262 WeakPolarHBondContact OG-CB 3.36Å; S260-S262 PolarHBondContact OG-N 2.91Å; S262-R264 PolarHBondContact O-N 2.71Å; S262-K265 PolarHBondContact O-N 3.43Å | ||
| 263 | S | 56.2 | Low | 77.8 | Confident | 131 Ų | 131 | 89.7 Ų | 89.7 | 92% | 0.916 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.9 | 1.3 | -174.5 | -155.5 | 0 | 0 | 0 | 0 | 115.3 | ||
| 264 | R | 61.1 | Low | 77.7 | Confident | 239 Ų | 239 | 90.2 Ų | 90.2 | 90% | 0.902 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.6 | -3.7 | -179.9 | -66.9 | -160.8 | -71.8 | 172.7 | -5.3 | 115.1 | S262 | S262-R264 PolarHBondContact O-N 2.71Š|
| 265 | K | 68.8 | Low | 77.5 | Confident | 178 Ų | 178 | 90.5 Ų | 90.5 | 77% | 0.774 | 52% | 0.517 | S | S | * | . | S | Bend | trans | -89.2 | 119.6 | 167.7 | -102.3 | -180 | 174.6 | 178.4 | 0 | 109.8 | S262 | S262-K265 PolarHBondContact O-N 3.43Š|
| 266 | G | 75.3 | Confident | 77.6 | Confident | 58 Ų | 58 | 88.7 Ų | 88.7 | 60% | 0.598 | 51% | 0.505 | S | S | * | . | P | Polyproline II helix | trans | -61.9 | 156.1 | -179 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 267 | C | 89.1 | Confident | 78 | Confident | 50 Ų | 50 | 87.5 Ų | 87.5 | 34% | 0.338 | 50% | 0.504 | S | S | . | . | P | Polyproline II helix | trans | -63.4 | 146.8 | -178.6 | 56.8 | 0 | 0 | 0 | 0 | 112.8 | K254 | K254-C267 HydrophobicContact CD-CB 4.38Å; K254-C267 HydrophobicContact CG-CB 3.79Å |
| 268 | L | 93.9 | Very high | 79 | Confident | 43 Ų | 43 | 90.2 Ų | 90.2 | 23% | 0.225 | 51% | 0.509 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.1 | 151.9 | 168.5 | -58.9 | 179.2 | 0 | 0 | 0 | 109.4 | P216 K254 V255 T257 | P216-L268 HydrophobicContact CB-CD2 4.06Å; P216-L268 HydrophobicContact CG-CD2 4.31Å; K254-L268 CarbonylContact C-O 3.5Å; K254-L268 WeakPolarHBondContact CA-O 3.38Å; V255-L268 HydrophobicContact CB-CB 4.33Å; V255-L268 PolarHBondContact N-O 3.34Å; V255-L268 PolarHBondContact O-N 2.98Å; T257-L268 WeakPolarHBondContact OG1-CD1 3.32Å |
| 269 | W | 95.7 | Very high | 80.3 | Confident | 37 Ų | 37 | 80.2 Ų | 80.2 | 14% | 0.14 | 47% | 0.466 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 141.5 | 170.1 | -68.2 | 85.6 | 0 | 0 | 0 | 108.9 | L207 S214 L215 L246 F252 E253 K254 | L207-W269 WeakPolarHBondContact CD2-O 3.43Å; S214-W269 CarbonylContact C-O 3.51Å; S214-W269 WeakPolarHBondContact CA-O 3.26Å; S214-W269 VanDerWaalsContact CB-O 3.29Å; S214-W269 WeakPolarHBondContact CB-O 3.29Å; L215-W269 PolarHBondContact N-O 3.01Å; L215-W269 PolarHBondContact O-N 2.73Å; L246-W269 HydrophobicContact CB-CD2 3.98Å; L246-W269 HydrophobicContact CB-CE3 3.96Å; L246-W269 HydrophobicContact CB-CH2 3.98Å; L246-W269 HydrophobicContact CB-CZ2 4.01Å; L246-W269 HydrophobicContact CB-CZ3 3.96Å; L246-W269 HydrophobicContact CD1-CD2 4.25Å; L246-W269 HydrophobicContact CD1-CG 4.19Å; L246-W269 HydrophobicContact CD2-CB 4.06Å; L246-W269 HydrophobicContact CD2-CD2 3.91Å; L246-W269 HydrophobicContact CD2-CE3 4.06Å; L246-W269 HydrophobicContact CD2-CG 3.91Å; L246-W269 HydrophobicContact CG-CD2 4.27Å; L246-W269 HydrophobicContact CG-CG 4.5Å; L246-W269 WeakPolarHBondContact O-CZ3 3.39Å; F252-W269 HydrophobicContact CB-CE3 4.18Å; E253-W269 CarbonylContact O-C 3.58Å; E253-W269 WeakPolarHBondContact O-CA 3.37Å; K254-W269 HydrophobicContact CB-CE3 4.39Å; K254-W269 HydrophobicContact CB-CH2 4.21Å; K254-W269 HydrophobicContact CB-CZ2 4.46Å; K254-W269 HydrophobicContact CB-CZ3 4.16Å |
| 270 | A | 95.3 | Very high | 82 | Confident | 12 Ų | 12 | 77.1 Ų | 77.1 | 10% | 0.099 | 44% | 0.441 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.6 | 165.9 | 175 | 0 | 0 | 0 | 0 | 0 | 111 | F252 E253 V255 | F252-A270 WeakPolarHBondContact CA-O 3.04Å; E253-A270 HydrophobicContact CG-CB 4.17Å; E253-A270 PolarHBondContact N-O 2.93Å; E253-A270 PolarHBondContact O-N 3.15Å; V255-A270 HydrophobicContact CG2-CB 3.49Å; V255-A270 VanDerWaalsContact CG2-CB 3.49Å |
| 271 | L | 94.9 | Very high | 84 | Confident | 7 Ų | 7 | 79.6 Ų | 79.6 | 4% | 0.037 | 44% | 0.444 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.1 | 121.3 | 174.5 | -166.9 | 72.3 | 0 | 0 | 0 | 109.1 | A204 L207 K208 F252 L273 I276 M279 | A204-L271 HydrophobicContact CB-CD1 4.23Å; L207-L271 HydrophobicContact CB-CB 4.47Å; L207-L271 HydrophobicContact CD1-CB 4.33Å; K208-L271 HydrophobicContact CG-CD2 4.46Å; F252-L271 HydrophobicContact CD1-CD1 3.94Å; F252-L271 HydrophobicContact CE1-CD1 3.65Å; L271-L273 PolarHBondContact O-N 3.41Å; L271-I276 HydrophobicContact CD2-CB 4.23Å; L271-I276 HydrophobicContact CD2-CD1 4.27Å; L271-I276 HydrophobicContact CD2-CG1 3.77Å; L271-I276 HydrophobicContact CD2-CG2 4Å; L271-I276 HydrophobicContact CG-CG1 4.03Å; L271-M279 HydrophobicContact CD1-CG 4.41Å |
| 272 | N | 94 | Very high | 85.8 | Confident | 43 Ų | 43 | 77.7 Ų | 77.7 | 23% | 0.23 | 41% | 0.409 | C | S | . | . | trans | -63.7 | 124 | -177.3 | 176.2 | -88.6 | 0 | 0 | 0 | 111 | C251 E253 A274 R275 I276 | C251-N272 PolarHBondContact O-N 3.27Å; E253-N272 WeakPolarHBondContact OE2-CA 3.33Å; E253-N272 WeakPolarHBondContact OE2-CB 3.41Å; E253-N272 PolarHBondContact OE2-ND2 3.49Å; N272-A274 PolarHBondContact O-N 3.1Å; N272-A274 VanDerWaalsContact O-N 3.11Å; N272-A274 WeakPolarHBondContact OD1-CB 3.44Å; N272-A274 PolarHBondContact OD1-N 2.78Å; N272-A274 VanDerWaalsContact OD1-N 3.1Å; N272-R275 HydrophobicContact CB-CB 4.44Å; N272-R275 HydrophobicContact CB-CG 4.48Å; N272-R275 PolarHBondContact O-N 3.1Å; N272-I276 WeakPolarHBondContact O-CG1 3.39Å; N272-I276 PolarHBondContact O-N 3.26Å | ||
| 273 | L | 91.2 | Very high | 87.7 | Confident | 97 Ų | 97 | 74.7 Ų | 74.7 | 51% | 0.508 | 39% | 0.388 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.7 | -25.5 | -171.2 | -78.3 | 81.1 | 0 | 0 | 0 | 114.1 | L271 R275 I276 | L271-L273 PolarHBondContact O-N 3.41Å; L273-R275 VanDerWaalsContact C-N 3.28Å; L273-R275 PolarHBondContact O-N 3.08Å; L273-I276 HydrophobicContact CG-CD1 4.29Å |
| 274 | A | 92.6 | Very high | 89.5 | Confident | 82 Ų | 82 | 72.2 Ų | 72.2 | 68% | 0.678 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.9 | 2.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | N272 | N272-A274 PolarHBondContact O-N 3.1Å; N272-A274 VanDerWaalsContact O-N 3.11Å; N272-A274 WeakPolarHBondContact OD1-CB 3.44Å; N272-A274 PolarHBondContact OD1-N 2.78Å; N272-A274 VanDerWaalsContact OD1-N 3.1Å |
| 275 | R | 91.5 | Very high | 91 | Very high | 116 Ų | 116 | 65.6 Ų | 65.6 | 44% | 0.438 | 34% | 0.34 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -127.3 | -1.6 | -178.1 | -62.7 | -60.5 | -176 | -169 | 0.7 | 114.6 | C251 N272 L273 K278 M279 | C251-R275 HydrophobicContact CB-CB 4.05Å; N272-R275 HydrophobicContact CB-CB 4.44Å; N272-R275 HydrophobicContact CB-CG 4.48Å; N272-R275 PolarHBondContact O-N 3.1Å; L273-R275 VanDerWaalsContact C-N 3.28Å; L273-R275 PolarHBondContact O-N 3.08Å; R275-K278 PolarHBondContact O-N 3.37Å; R275-M279 PolarHBondContact O-N 3.27Å |
| 276 | I | 91.3 | Very high | 92.1 | Very high | 11 Ų | 11 | 60.2 Ų | 60.2 | 6% | 0.056 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -57.4 | -54.3 | -178.4 | -56.1 | -172.8 | 0 | 0 | 0 | 110.9 | L271 N272 L273 K278 M279 E280 C315 | L271-I276 HydrophobicContact CD2-CB 4.23Å; L271-I276 HydrophobicContact CD2-CD1 4.27Å; L271-I276 HydrophobicContact CD2-CG1 3.77Å; L271-I276 HydrophobicContact CD2-CG2 4Å; L271-I276 HydrophobicContact CG-CG1 4.03Å; N272-I276 WeakPolarHBondContact O-CG1 3.39Å; N272-I276 PolarHBondContact O-N 3.26Å; L273-I276 HydrophobicContact CG-CD1 4.29Å; I276-K278 VanDerWaalsContact C-N 3.26Å; I276-K278 PolarHBondContact O-N 2.96Å; I276-M279 WeakPolarHBondContact O-CA 3.38Å; I276-M279 WeakPolarHBondContact O-CB 3.45Å; I276-M279 PolarHBondContact O-N 3.41Å; I276-E280 HydrophobicContact CG2-CG 4.12Å; I276-E280 PolarHBondContact O-N 3.36Å; I276-C315 HydrophobicContact CD1-CB 3.54Å; I276-C315 VanDerWaalsContact CD1-SG 3.53Å |
| 277 | D | 91.6 | Very high | 92.9 | Very high | 112 Ų | 112 | 59.5 Ų | 59.5 | 60% | 0.599 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -56.3 | -39.6 | -175.3 | -47.7 | -31.7 | 0 | 0 | 0 | 112.1 | E280 E281 | D277-E280 PolarHBondContact O-N 3.13Å; D277-E281 WeakPolarHBondContact O-CB 3.46Å; D277-E281 PolarHBondContact O-N 3.21Å |
| 278 | K | 92.1 | Very high | 93.1 | Very high | 124 Ų | 124 | 66.3 Ų | 66.3 | 54% | 0.539 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -65.9 | -37.1 | 175.2 | -179.6 | 178.5 | 178.2 | 179.9 | 0 | 112.5 | R275 I276 E282 | R275-K278 PolarHBondContact O-N 3.37Å; I276-K278 VanDerWaalsContact C-N 3.26Å; I276-K278 PolarHBondContact O-N 2.96Å; K278-E282 PolarHBondContact O-N 3.41Å; K278-E282 VanDerWaalsContact O-N 3.13Å |
| 279 | M | 93.1 | Very high | 93.1 | Very high | 10 Ų | 10 | 71.4 Ų | 71.4 | 5% | 0.049 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -72.3 | -40.6 | 178.6 | -170.1 | 63.4 | 70.4 | 0 | 0 | 111.2 | A204 C251 F252 L271 R275 I276 E281 E282 M283 | A204-M279 HydrophobicContact CB-CE 4.5Å; A204-M279 HydrophobicContact CB-CG 3.26Å; A204-M279 HydrophobicContact CB-SD 3.8Å; C251-M279 HydrophobicContact CB-CE 3.46Å; C251-M279 VanDerWaalsContact CB-CE 3.46Å; F252-M279 HydrophobicContact CE1-CE 4.29Å; F252-M279 HydrophobicContact CZ-CE 3.86Å; L271-M279 HydrophobicContact CD1-CG 4.41Å; R275-M279 PolarHBondContact O-N 3.27Å; I276-M279 WeakPolarHBondContact O-CA 3.38Å; I276-M279 WeakPolarHBondContact O-CB 3.45Å; I276-M279 PolarHBondContact O-N 3.41Å; M279-E281 VanDerWaalsContact C-N 3.34Å; M279-E282 PolarHBondContact O-N 3.11Å; M279-M283 HydrophobicContact CG-SD 4.26Å; M279-M283 WeakPolarHBondContact O-CG 3.13Å; M279-M283 PolarHBondContact O-N 3.46Å |
| 280 | E | 92.6 | Very high | 92.9 | Very high | 39 Ų | 39 | 72.6 Ų | 72.6 | 18% | 0.182 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -63.8 | -38.8 | 173.5 | -66.5 | -173.4 | 163.2 | 0 | 0 | 111.3 | K208 I276 D277 M283 H284 | K208-E280 HydrophobicContact CD-CG 4.45Å; K208-E280 IonicContact NZ-OE1 2.69Å; K208-E280 PolarHBondContact NZ-OE1 3.37Å; I276-E280 HydrophobicContact CG2-CG 4.12Å; I276-E280 PolarHBondContact O-N 3.36Å; D277-E280 PolarHBondContact O-N 3.13Å; E280-M283 PolarHBondContact O-N 2.93Å; E280-H284 WeakPolarHBondContact O-CB 3.31Å; E280-H284 PolarHBondContact O-CD2 3.17Å; E280-H284 VanDerWaalsContact O-CD2 3.23Å; E280-H284 PolarHBondContact O-N 2.77Å |
| 281 | E | 94 | Very high | 92.8 | Very high | 120 Ų | 120 | 75.4 Ų | 75.4 | 56% | 0.561 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -61 | -47.9 | 172.6 | -176.2 | 176.6 | -153.8 | 0 | 0 | 112.5 | D277 M279 M283 H284 K285 | D277-E281 WeakPolarHBondContact O-CB 3.46Å; D277-E281 PolarHBondContact O-N 3.21Å; M279-E281 VanDerWaalsContact C-N 3.34Å; E281-M283 VanDerWaalsContact C-N 3.3Å; E281-M283 PolarHBondContact O-N 2.78Å; E281-H284 PolarHBondContact O-N 2.81Å; E281-K285 WeakPolarHBondContact O-CB 3.34Å; E281-K285 PolarHBondContact O-N 2.96Å |
| 282 | E | 93.6 | Very high | 92.7 | Very high | 59 Ų | 59 | 77.9 Ų | 77.9 | 28% | 0.276 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.5 | -38.5 | 175.1 | -77.4 | -64.3 | 133 | 0 | 0 | 111.6 | K278 M279 K285 W286 | K278-E282 PolarHBondContact O-N 3.41Å; K278-E282 VanDerWaalsContact O-N 3.13Å; M279-E282 PolarHBondContact O-N 3.11Å; E282-K285 PolarHBondContact O-N 3.08Å; E282-K285 WeakPolarHBondContact OE1-CD 3.17Å; E282-K285 IonicContact OE1-NZ 2.61Å; E282-K285 PolarHBondContact OE1-NZ 3.35Å; E282-K285 IonicContact OE2-NZ 2.6Å; E282-K285 PolarHBondContact OE2-NZ 3.39Å; E282-W286 VanDerWaalsContact O-CD1 3.29Å; E282-W286 PolarHBondContact O-N 3Å; E282-W286 VanDerWaalsContact O-N 3.08Å |
| 283 | M | 93.8 | Very high | 92.6 | Very high | 0 Ų | 0 | 76.3 Ų | 76.3 | 0% | 0 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -63.5 | -43.5 | 175 | -74.1 | 166.5 | 49.7 | 0 | 0 | 112 | Y197 C201 A204 M205 K208 M279 E280 E281 K287 I308 | Y197-M283 HydrophobicContact CE1-CB 4.48Å; Y197-M283 PolarHBondContact OH-O 3.4Å; C201-M283 HydrophobicContact CB-CG 4.07Å; A204-M283 HydrophobicContact CB-SD 3.92Å; M205-M283 HydrophobicContact CG-CE 3.4Å; M205-M283 HydrophobicContact CG-SD 4.09Å; M205-M283 HydrophobicContact SD-CE 4.29Å; K208-M283 HydrophobicContact CD-CE 4.33Å; M279-M283 HydrophobicContact CG-SD 4.26Å; M279-M283 WeakPolarHBondContact O-CG 3.13Å; M279-M283 PolarHBondContact O-N 3.46Å; E280-M283 PolarHBondContact O-N 2.93Å; E281-M283 VanDerWaalsContact C-N 3.3Å; E281-M283 PolarHBondContact O-N 2.78Å; M283-K287 WeakPolarHBondContact O-CB 3.5Å; M283-K287 PolarHBondContact O-N 2.92Å; M283-I308 HydrophobicContact CE-CB 4.39Å; M283-I308 HydrophobicContact CE-CG1 3.81Å |
| 284 | H | 93.3 | Very high | 92.7 | Very high | 80 Ų | 80 | 71.7 Ų | 71.7 | 37% | 0.37 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -68.1 | -33.9 | 175.4 | -82.3 | -142.8 | 0 | 0 | 0 | 113 | E280 E281 R288 I308 | E280-H284 WeakPolarHBondContact O-CB 3.31Å; E280-H284 PolarHBondContact O-CD2 3.17Å; E280-H284 VanDerWaalsContact O-CD2 3.23Å; E280-H284 PolarHBondContact O-N 2.77Å; E281-H284 PolarHBondContact O-N 2.81Å; H284-R288 WeakPolarHBondContact O-CB 3.37Å; H284-R288 WeakPolarHBondContact O-CG 3.45Å; H284-R288 PolarHBondContact O-N 3.27Å; H284-R288 PolarHBondContact O-NE 2.86Å; H284-I308 WeakPolarHBondContact CD2-CG2 3.48Å; H284-I308 WeakPolarHBondContact NE2-CG2 3.43Å |
| 285 | K | 94.1 | Very high | 92.7 | Very high | 100 Ų | 100 | 71 Ų | 71 | 44% | 0.435 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -65.6 | -46.3 | 176.7 | 172.3 | -172.5 | 173.7 | -162.9 | 0 | 111 | E281 E282 R288 K289 | E281-K285 WeakPolarHBondContact O-CB 3.34Å; E281-K285 PolarHBondContact O-N 2.96Å; E282-K285 PolarHBondContact O-N 3.08Å; E282-K285 WeakPolarHBondContact OE1-CD 3.17Å; E282-K285 IonicContact OE1-NZ 2.61Å; E282-K285 PolarHBondContact OE1-NZ 3.35Å; E282-K285 IonicContact OE2-NZ 2.6Å; E282-K285 PolarHBondContact OE2-NZ 3.39Å; K285-R288 PolarHBondContact O-N 3.12Å; K285-K289 VanDerWaalsContact O-CB 3.31Å; K285-K289 WeakPolarHBondContact O-CB 3.43Å; K285-K289 PolarHBondContact O-N 3.39Å |
| 286 | W | 92 | Very high | 92.8 | Very high | 65 Ų | 65 | 72.7 Ų | 72.7 | 25% | 0.246 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -66.8 | -41 | 173.1 | -79.1 | 106.3 | 0 | 0 | 0 | 112.6 | I196 Y197 E282 R288 K289 D290 | I196-W286 HydrophobicContact CB-CE3 4.06Å; I196-W286 HydrophobicContact CB-CZ3 3.96Å; I196-W286 HydrophobicContact CD1-CE3 3.61Å; I196-W286 HydrophobicContact CD1-CZ3 4.09Å; I196-W286 HydrophobicContact CG1-CD2 4.47Å; I196-W286 HydrophobicContact CG1-CE3 3.73Å; I196-W286 HydrophobicContact CG1-CZ3 4.15Å; Y197-W286 HydrophobicContact CD1-CB 3.84Å; Y197-W286 HydrophobicContact CD1-CG 4.17Å; Y197-W286 HydrophobicContact CE1-CB 3.47Å; Y197-W286 VanDerWaalsContact CE1-CB 3.47Å; Y197-W286 HydrophobicContact CE1-CG 4.26Å; E282-W286 VanDerWaalsContact O-CD1 3.29Å; E282-W286 PolarHBondContact O-N 3Å; E282-W286 VanDerWaalsContact O-N 3.08Å; W286-R288 VanDerWaalsContact C-N 3.33Å; W286-R288 PolarHBondContact O-N 3.12Å; W286-K289 HydrophobicContact CE3-CD 4.08Å; W286-K289 HydrophobicContact CZ3-CD 3.96Å; W286-K289 PolarHBondContact O-N 3.09Å; W286-K289 VanDerWaalsContact O-N 3.08Å; W286-D290 PolarHBondContact O-N 3.31Å; W286-D290 VanDerWaalsContact O-N 3.11Å |
| 287 | K | 92.1 | Very high | 92.9 | Very high | 42 Ų | 42 | 72.2 Ų | 72.2 | 18% | 0.183 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -55.8 | -44 | 173.7 | -170.5 | -172.5 | -173.3 | 178.4 | 0 | 112.5 | M283 L291 D305 I308 | M283-K287 WeakPolarHBondContact O-CB 3.5Å; M283-K287 PolarHBondContact O-N 2.92Å; K287-L291 HydrophobicContact CG-CD1 3.76Å; K287-L291 PolarHBondContact O-N 2.92Å; K287-D305 WeakPolarHBondContact CE-OD1 3.34Å; K287-D305 IonicContact NZ-OD1 3.59Å; K287-D305 PolarHBondContact NZ-OD1 3.43Å; K287-I308 HydrophobicContact CB-CD1 4.31Å; K287-I308 HydrophobicContact CD-CD1 3.84Å; K287-I308 HydrophobicContact CG-CD1 4.29Å |
| 288 | R | 92.8 | Very high | 93 | Very high | 193 Ų | 193 | 67 Ų | 67 | 73% | 0.728 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -71.9 | -28.8 | 175.2 | -74.7 | -177.4 | -67.6 | 157.5 | -5.5 | 113.6 | H284 K285 W286 | H284-R288 WeakPolarHBondContact O-CB 3.37Å; H284-R288 WeakPolarHBondContact O-CG 3.45Å; H284-R288 PolarHBondContact O-N 3.27Å; H284-R288 PolarHBondContact O-NE 2.86Å; K285-R288 PolarHBondContact O-N 3.12Å; W286-R288 VanDerWaalsContact C-N 3.33Å; W286-R288 PolarHBondContact O-N 3.12Å |
| 289 | K | 93.4 | Very high | 93 | Very high | 150 Ų | 150 | 62.6 Ų | 62.6 | 65% | 0.652 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -76.1 | -47.8 | -175.8 | -176.4 | 177.5 | 177.2 | -177 | 0 | 112.9 | K285 W286 | K285-K289 VanDerWaalsContact O-CB 3.31Å; K285-K289 WeakPolarHBondContact O-CB 3.43Å; K285-K289 PolarHBondContact O-N 3.39Å; W286-K289 HydrophobicContact CE3-CD 4.08Å; W286-K289 HydrophobicContact CZ3-CD 3.96Å; W286-K289 PolarHBondContact O-N 3.09Å; W286-K289 VanDerWaalsContact O-N 3.08Å |
| 290 | D | 92.4 | Very high | 92.8 | Very high | 62 Ų | 62 | 65.2 Ų | 65.2 | 33% | 0.332 | 31% | 0.305 | S | S | . | . | trans | -155.7 | 77.7 | 177.7 | -169.2 | -9.9 | 0 | 0 | 0 | 111.8 | I196 W286 A292 A293 I294 | I196-D290 HydrophobicContact CD1-CB 3.9Å; I196-D290 WeakPolarHBondContact CD1-O 3.4Å; W286-D290 PolarHBondContact O-N 3.31Å; W286-D290 VanDerWaalsContact O-N 3.11Å; D290-A292 PolarHBondContact O-N 3.34Å; D290-A292 PolarHBondContact OD1-N 3.26Å; D290-A292 VanDerWaalsContact OD1-N 3.16Å; D290-A293 HydrophobicContact CB-CB 4.18Å; D290-A293 PolarHBondContact O-N 3.03Å; D290-A293 PolarHBondContact OD1-N 3.18Å; D290-A293 WeakPolarHBondContact OD2-CB 3.44Å; D290-I294 WeakPolarHBondContact O-CG1 3.38Å; D290-I294 PolarHBondContact O-N 2.95Å | ||
| 291 | L | 92.6 | Very high | 92.6 | Very high | 72 Ų | 72 | 65.3 Ų | 65.3 | 38% | 0.377 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -55.8 | -34.7 | 173 | -169.9 | 66.5 | 0 | 0 | 0 | 112.2 | K287 I294 H295 L304 | K287-L291 HydrophobicContact CG-CD1 3.76Å; K287-L291 PolarHBondContact O-N 2.92Å; L291-I294 PolarHBondContact O-N 3.26Å; L291-H295 WeakPolarHBondContact CD1-NE2 3.47Å; L291-H295 PolarHBondContact O-CD2 3.03Å; L291-H295 VanDerWaalsContact O-CD2 3.32Å; L291-H295 PolarHBondContact O-N 3.38Å; L291-L304 HydrophobicContact CD1-CD2 3.68Å |
| 292 | A | 92.1 | Very high | 92.3 | Very high | 58 Ų | 58 | 65.7 Ų | 65.7 | 48% | 0.479 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -74.3 | -33.8 | -175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | D290 R296 | D290-A292 PolarHBondContact O-N 3.34Å; D290-A292 PolarHBondContact OD1-N 3.26Å; D290-A292 VanDerWaalsContact OD1-N 3.16Å; A292-R296 WeakPolarHBondContact O-CB 3.49Å; A292-R296 VanDerWaalsContact O-CG 3.25Å; A292-R296 WeakPolarHBondContact O-CG 3.14Å; A292-R296 PolarHBondContact O-N 2.88Å; A292-R296 VanDerWaalsContact O-N 3.14Å; A292-R296 PolarHBondContact O-NE 3.2Å; A292-R296 VanDerWaalsContact O-NE 3.09Å |
| 293 | A | 93.3 | Very high | 92 | Very high | 10 Ų | 10 | 66 Ų | 66 | 8% | 0.083 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -69.6 | -37.8 | 169 | 0 | 0 | 0 | 0 | 0 | 112.1 | I196 D290 R296 S297 | I196-A293 HydrophobicContact CD1-CB 4.24Å; I196-A293 HydrophobicContact CG2-CB 3.84Å; D290-A293 HydrophobicContact CB-CB 4.18Å; D290-A293 PolarHBondContact O-N 3.03Å; D290-A293 PolarHBondContact OD1-N 3.18Å; D290-A293 WeakPolarHBondContact OD2-CB 3.44Å; A293-R296 PolarHBondContact O-N 2.92Å; A293-S297 PolarHBondContact O-N 3.32Å; A293-S297 VanDerWaalsContact O-N 3.1Å; A293-S297 PolarHBondContact O-OG 3.3Å |
| 294 | I | 92.7 | Very high | 91.7 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -60.9 | -53.2 | 174.7 | -63.4 | 160.4 | 0 | 0 | 0 | 109.9 | I196 Y197 D290 L291 R296 S297 M298 L304 | I196-I294 HydrophobicContact CD1-CD1 4.04Å; I196-I294 HydrophobicContact CD1-CG1 3.62Å; I196-I294 HydrophobicContact CG1-CD1 4.39Å; I196-I294 HydrophobicContact CG1-CG1 3.71Å; Y197-I294 HydrophobicContact CD2-CG1 4.31Å; Y197-I294 HydrophobicContact CD2-CG2 4.33Å; Y197-I294 HydrophobicContact CE2-CB 4.39Å; Y197-I294 HydrophobicContact CE2-CD1 3.76Å; Y197-I294 HydrophobicContact CE2-CG1 3.81Å; Y197-I294 HydrophobicContact CE2-CG2 3.63Å; Y197-I294 WeakPolarHBondContact OH-CD1 3.48Å; D290-I294 WeakPolarHBondContact O-CG1 3.38Å; D290-I294 PolarHBondContact O-N 2.95Å; L291-I294 PolarHBondContact O-N 3.26Å; I294-R296 VanDerWaalsContact C-N 3.27Å; I294-R296 PolarHBondContact O-N 3.21Å; I294-S297 WeakPolarHBondContact O-CA 3.44Å; I294-S297 PolarHBondContact O-N 3.14Å; I294-S297 PolarHBondContact O-OG 2.88Å; I294-M298 HydrophobicContact CG2-CG 4.4Å; I294-M298 HydrophobicContact CG2-SD 3.77Å; I294-M298 PolarHBondContact O-N 3.36Å; I294-L304 HydrophobicContact CB-CD2 4.31Å; I294-L304 HydrophobicContact CG2-CD1 3.8Å; I294-L304 HydrophobicContact CG2-CD2 3.53Å; I294-L304 HydrophobicContact CG2-CG 4.3Å |
| 295 | H | 92.5 | Very high | 91.4 | Very high | 68 Ų | 68 | 66.1 Ų | 66.1 | 32% | 0.315 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -58.5 | -36.7 | 179.5 | -71.8 | -166.7 | 0 | 0 | 0 | 112.6 | L291 S297 P301 | L291-H295 WeakPolarHBondContact CD1-NE2 3.47Å; L291-H295 PolarHBondContact O-CD2 3.03Å; L291-H295 VanDerWaalsContact O-CD2 3.32Å; L291-H295 PolarHBondContact O-N 3.38Å; H295-S297 VanDerWaalsContact C-N 3.31Å; H295-S297 PolarHBondContact O-N 3.48Å; H295-P301 HydrophobicContact CB-CB 3.84Å |
| 296 | R | 92.8 | Very high | 91.1 | Very high | 152 Ų | 152 | 67.2 Ų | 67.2 | 57% | 0.574 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -66.9 | -28.6 | 173.6 | -76.3 | 179.3 | -65.1 | 148 | -3.6 | 113.6 | Y192 P193 A292 A293 I294 | Y192-R296 WeakPolarHBondContact CD1-O 3.41Å; P193-R296 VanDerWaalsContact CD-O 3.31Å; P193-R296 WeakPolarHBondContact CD-O 3.41Å; P193-R296 HydrophobicContact CG-CB 4.12Å; A292-R296 WeakPolarHBondContact O-CB 3.49Å; A292-R296 VanDerWaalsContact O-CG 3.25Å; A292-R296 WeakPolarHBondContact O-CG 3.14Å; A292-R296 PolarHBondContact O-N 2.88Å; A292-R296 VanDerWaalsContact O-N 3.14Å; A292-R296 PolarHBondContact O-NE 3.2Å; A292-R296 VanDerWaalsContact O-NE 3.09Å; A293-R296 PolarHBondContact O-N 2.92Å; I294-R296 VanDerWaalsContact C-N 3.27Å; I294-R296 PolarHBondContact O-N 3.21Å |
| 297 | S | 93.4 | Very high | 90.8 | Very high | 0 Ų | 0 | 64.9 Ų | 64.9 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -85.8 | -12.7 | -179.2 | 72.7 | 0 | 0 | 0 | 0 | 114.5 | P193 A293 I294 H295 | P193-S297 WeakPolarHBondContact O-CB 3.41Å; A293-S297 PolarHBondContact O-N 3.32Å; A293-S297 VanDerWaalsContact O-N 3.1Å; A293-S297 PolarHBondContact O-OG 3.3Å; I294-S297 WeakPolarHBondContact O-CA 3.44Å; I294-S297 PolarHBondContact O-N 3.14Å; I294-S297 PolarHBondContact O-OG 2.88Å; H295-S297 VanDerWaalsContact C-N 3.31Å; H295-S297 PolarHBondContact O-N 3.48Å |
| 298 | M | 94 | Very high | 90.5 | Very high | 4 Ų | 4 | 63 Ų | 63 | 2% | 0.02 | 31% | 0.305 | C | S | . | . | trans | -98.4 | 149.7 | -175.2 | -73.7 | -179.8 | 74.1 | 0 | 0 | 113.4 | Y192 H227 F228 I294 L304 L307 | Y192-M298 WeakPolarHBondContact CE1-O 3.49Å; H227-M298 CarbonylContact O-C 3.45Å; H227-M298 WeakPolarHBondContact O-CA 3.34Å; F228-M298 HydrophobicContact CD1-CG 3.64Å; F228-M298 HydrophobicContact CE1-CG 3.27Å; F228-M298 HydrophobicContact CE1-SD 3.99Å; F228-M298 HydrophobicContact CZ-CE 4.5Å; F228-M298 HydrophobicContact CZ-CG 3.95Å; F228-M298 HydrophobicContact CZ-SD 4.21Å; I294-M298 HydrophobicContact CG2-CG 4.4Å; I294-M298 HydrophobicContact CG2-SD 3.77Å; I294-M298 PolarHBondContact O-N 3.36Å; M298-L304 HydrophobicContact CE-CB 4.02Å; M298-L304 HydrophobicContact CE-CD1 4.36Å; M298-L304 HydrophobicContact SD-CB 3.88Å; M298-L304 HydrophobicContact SD-CD1 3.77Å; M298-L304 HydrophobicContact SD-CD2 4.45Å; M298-L304 HydrophobicContact SD-CG 4.24Å; M298-L307 HydrophobicContact CE-CD1 4.16Å | ||
| 299 | A | 91.4 | Very high | 89.8 | Confident | 30 Ų | 30 | 57.3 Ų | 57.3 | 25% | 0.248 | 30% | 0.295 | C | S | . | . | S | Bend | trans | -64.1 | -53.5 | 168.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | E226 H227 P229 | E226-A299 WeakPolarHBondContact O-CB 3.28Å; H227-A299 PolarHBondContact O-N 2.87Å; P229-A299 HydrophobicContact CG-CB 3.79Å |
| 300 | N | 90.4 | Very high | 88.6 | Confident | 65 Ų | 65 | 55 Ų | 55 | 35% | 0.348 | 29% | 0.29 | S | S | . | . | trans | -122.3 | 87.5 | -172.7 | -53.6 | -16.8 | 0 | 0 | 0 | 108.5 | E302 E303 | N300-E302 PolarHBondContact O-N 3.16Å; N300-E303 HydrophobicContact CB-CB 4.45Å; N300-E303 HydrophobicContact CB-CG 3.96Å; N300-E303 VanDerWaalsContact CB-OE2 3.26Å; N300-E303 WeakPolarHBondContact CB-OE2 3.31Å; N300-E303 PolarHBondContact ND2-OE2 3.06Å; N300-E303 PolarHBondContact O-N 3.01Å | ||
| 301 | P | 88.4 | Confident | 86.9 | Confident | 41 Ų | 41 | 58.4 Ų | 58.4 | 27% | 0.266 | 30% | 0.298 | S | S | . | . | G | 310 helix | trans | -62 | -28.8 | -175.4 | 24.9 | -34.8 | 0 | 0 | 0 | 113.5 | H295 E303 L304 | H295-P301 HydrophobicContact CB-CB 3.84Å; P301-E303 PolarHBondContact O-N 3.47Å; P301-L304 WeakPolarHBondContact O-CB 3.18Å; P301-L304 PolarHBondContact O-N 2.91Å; P301-L304 VanDerWaalsContact O-N 3.15Å |
| 302 | E | 87.2 | Confident | 85.2 | Confident | 128 Ų | 128 | 55.5 Ų | 55.5 | 60% | 0.598 | 28% | 0.283 | S | S | * | . | G | 310 helix | trans | -64.5 | -17.8 | 177.2 | 64.6 | -79 | -178.2 | 0 | 0 | 114.5 | N300 | N300-E302 PolarHBondContact O-N 3.16Š|
| 303 | E | 86.6 | Confident | 83.3 | Confident | 65 Ų | 65 | 59.6 Ų | 59.6 | 30% | 0.304 | 29% | 0.292 | S | S | . | . | G | 310 helix | trans | -84.4 | -13.4 | 176.2 | -61 | -169.8 | 117 | 0 | 0 | 112.7 | N300 P301 D305 K306 L307 | N300-E303 HydrophobicContact CB-CB 4.45Å; N300-E303 HydrophobicContact CB-CG 3.96Å; N300-E303 VanDerWaalsContact CB-OE2 3.26Å; N300-E303 WeakPolarHBondContact CB-OE2 3.31Å; N300-E303 PolarHBondContact ND2-OE2 3.06Å; N300-E303 PolarHBondContact O-N 3.01Å; P301-E303 PolarHBondContact O-N 3.47Å; E303-D305 VanDerWaalsContact C-N 3.3Å; E303-D305 PolarHBondContact O-N 2.83Å; E303-K306 WeakPolarHBondContact O-CB 3.47Å; E303-K306 PolarHBondContact O-N 2.91Å; E303-K306 VanDerWaalsContact O-N 3.1Å; E303-L307 HydrophobicContact CB-CD1 4.47Å; E303-L307 WeakPolarHBondContact O-CG 3.46Å; E303-L307 PolarHBondContact O-N 3.13Å |
| 304 | L | 88.6 | Confident | 81.5 | Confident | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -57.4 | -41.8 | 179.5 | -178.3 | 64.9 | 0 | 0 | 0 | 112.6 | Y197 L291 I294 M298 P301 K306 I308 | Y197-L304 HydrophobicContact CE2-CD1 4.12Å; L291-L304 HydrophobicContact CD1-CD2 3.68Å; I294-L304 HydrophobicContact CB-CD2 4.31Å; I294-L304 HydrophobicContact CG2-CD1 3.8Å; I294-L304 HydrophobicContact CG2-CD2 3.53Å; I294-L304 HydrophobicContact CG2-CG 4.3Å; M298-L304 HydrophobicContact CE-CB 4.02Å; M298-L304 HydrophobicContact CE-CD1 4.36Å; M298-L304 HydrophobicContact SD-CB 3.88Å; M298-L304 HydrophobicContact SD-CD1 3.77Å; M298-L304 HydrophobicContact SD-CD2 4.45Å; M298-L304 HydrophobicContact SD-CG 4.24Å; P301-L304 WeakPolarHBondContact O-CB 3.18Å; P301-L304 PolarHBondContact O-N 2.91Å; P301-L304 VanDerWaalsContact O-N 3.15Å; L304-K306 VanDerWaalsContact C-N 3.3Å; L304-K306 PolarHBondContact O-N 2.99Å; L304-I308 HydrophobicContact CD1-CD1 3.52Å; L304-I308 HydrophobicContact CD1-CG1 4.16Å; L304-I308 HydrophobicContact CG-CD1 3.84Å; L304-I308 WeakPolarHBondContact O-CB 3.48Å; L304-I308 VanDerWaalsContact O-CG1 3.28Å; L304-I308 WeakPolarHBondContact O-CG1 3.36Å; L304-I308 PolarHBondContact O-N 3.48Å; L304-I308 VanDerWaalsContact O-N 3.12Å |
| 305 | D | 86.8 | Confident | 79.5 | Confident | 83 Ų | 83 | 62.6 Ų | 62.6 | 44% | 0.444 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -63.6 | -37.6 | 178.8 | -81.6 | -55.7 | 0 | 0 | 0 | 111.9 | K287 E303 S309 | K287-D305 WeakPolarHBondContact CE-OD1 3.34Å; K287-D305 IonicContact NZ-OD1 3.59Å; K287-D305 PolarHBondContact NZ-OD1 3.43Å; E303-D305 VanDerWaalsContact C-N 3.3Å; E303-D305 PolarHBondContact O-N 2.83Å; D305-S309 WeakPolarHBondContact O-CB 3.42Å; D305-S309 PolarHBondContact O-N 2.6Å; D305-S309 PolarHBondContact O-OG 2.95Å |
| 306 | K | 87.8 | Confident | 77.6 | Confident | 123 Ų | 123 | 67.5 Ų | 67.5 | 54% | 0.535 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -67.7 | -56.2 | 177 | -62.4 | 173.8 | 173.1 | -67.2 | 0 | 110.9 | E303 L304 I308 S309 D310 | E303-K306 WeakPolarHBondContact O-CB 3.47Å; E303-K306 PolarHBondContact O-N 2.91Å; E303-K306 VanDerWaalsContact O-N 3.1Å; L304-K306 VanDerWaalsContact C-N 3.3Å; L304-K306 PolarHBondContact O-N 2.99Å; K306-I308 PolarHBondContact O-N 3.22Å; K306-S309 PolarHBondContact O-N 3.49Å; K306-S309 VanDerWaalsContact O-N 3.13Å; K306-D310 WeakPolarHBondContact CB-OD2 3.46Å; K306-D310 VanDerWaalsContact O-CB 3.26Å; K306-D310 WeakPolarHBondContact O-CB 3.33Å; K306-D310 PolarHBondContact O-N 3.26Å |
| 307 | L | 86.1 | Confident | 75.4 | Confident | 16 Ų | 16 | 70.8 Ų | 70.8 | 8% | 0.084 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -55.7 | -27.7 | 179.7 | -65.5 | 170.9 | 0 | 0 | 0 | 113.7 | F223 M298 E303 | F223-L307 HydrophobicContact CE2-CD2 3.81Å; F223-L307 HydrophobicContact CZ-CD1 4.12Å; F223-L307 HydrophobicContact CZ-CD2 3.88Å; M298-L307 HydrophobicContact CE-CD1 4.16Å; E303-L307 HydrophobicContact CB-CD1 4.47Å; E303-L307 WeakPolarHBondContact O-CG 3.46Å; E303-L307 PolarHBondContact O-N 3.13Å |
| 308 | I | 85.4 | Confident | 73 | Confident | 2 Ų | 2 | 77.1 Ų | 77.1 | 1% | 0.01 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -90 | -43.8 | 177.1 | -68.6 | 179 | 0 | 0 | 0 | 112.4 | Y197 K208 M283 H284 K287 L304 K306 | Y197-I308 WeakPolarHBondContact OH-CD1 3.48Å; K208-I308 PolarHBondContact NZ-O 3.16Å; M283-I308 HydrophobicContact CE-CB 4.39Å; M283-I308 HydrophobicContact CE-CG1 3.81Å; H284-I308 WeakPolarHBondContact CD2-CG2 3.48Å; H284-I308 WeakPolarHBondContact NE2-CG2 3.43Å; K287-I308 HydrophobicContact CB-CD1 4.31Å; K287-I308 HydrophobicContact CD-CD1 3.84Å; K287-I308 HydrophobicContact CG-CD1 4.29Å; L304-I308 HydrophobicContact CD1-CD1 3.52Å; L304-I308 HydrophobicContact CD1-CG1 4.16Å; L304-I308 HydrophobicContact CG-CD1 3.84Å; L304-I308 WeakPolarHBondContact O-CB 3.48Å; L304-I308 VanDerWaalsContact O-CG1 3.28Å; L304-I308 WeakPolarHBondContact O-CG1 3.36Å; L304-I308 PolarHBondContact O-N 3.48Å; L304-I308 VanDerWaalsContact O-N 3.12Å; K306-I308 PolarHBondContact O-N 3.22Å |
| 309 | S | 76.9 | Confident | 70.4 | Confident | 74 Ų | 74 | 80 Ų | 80 | 52% | 0.517 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -94.4 | -24.4 | -168.8 | -43.9 | 0 | 0 | 0 | 0 | 114.1 | D305 K306 R311 | D305-S309 WeakPolarHBondContact O-CB 3.42Å; D305-S309 PolarHBondContact O-N 2.6Å; D305-S309 PolarHBondContact O-OG 2.95Å; K306-S309 PolarHBondContact O-N 3.49Å; K306-S309 VanDerWaalsContact O-N 3.13Å; S309-R311 PolarHBondContact O-N 3.16Å |
| 310 | D | 68.8 | Low | 67.7 | Low | 103 Ų | 103 | 88.3 Ų | 88.3 | 55% | 0.551 | 44% | 0.443 | S | S | * | . | trans | -66.4 | 109.6 | 173.3 | -69.5 | -31.2 | 0 | 0 | 0 | 108.3 | K208 K306 P312 | K208-D310 WeakPolarHBondContact CE-O 3.2Å; K208-D310 PolarHBondContact NZ-O 3.46Å; K306-D310 WeakPolarHBondContact CB-OD2 3.46Å; K306-D310 VanDerWaalsContact O-CB 3.26Å; K306-D310 WeakPolarHBondContact O-CB 3.33Å; K306-D310 PolarHBondContact O-N 3.26Å; D310-P312 WeakPolarHBondContact O-CD 3.42Å | ||
| 311 | R | 57.8 | Low | 65.3 | Low | 133 Ų | 133 | 91.6 Ų | 91.6 | 50% | 0.502 | 47% | 0.468 | S | S | . | . | trans | -85.8 | 110.6 | 175.8 | 176.1 | -173.5 | 175.1 | 141 | 11.6 | 107.7 | S309 E313 C315 | S309-R311 PolarHBondContact O-N 3.16Å; R311-E313 PolarHBondContact O-N 3.43Å; R311-C315 PolarHBondContact NH2-O 3.35Å | ||
| 312 | P | 55.7 | Low | 63.1 | Low | 10 Ų | 10 | 93 Ų | 93 | 7% | 0.065 | 49% | 0.49 | C | S | . | . | trans | -56.5 | 132.1 | -174.4 | 20.8 | -32.7 | 0 | 0 | 0 | 111.6 | K208 D310 S314 C315 | K208-P312 HydrophobicContact CG-CG 4.23Å; D310-P312 WeakPolarHBondContact O-CD 3.42Å; P312-S314 PolarHBondContact O-N 2.92Å; P312-C315 HydrophobicContact CG-CB 4.07Å; P312-C315 WeakPolarHBondContact O-CA 3.32Å; P312-C315 WeakPolarHBondContact O-CB 3.4Å; P312-C315 PolarHBondContact O-N 2.9Å | ||
| 313 | E | 52.9 | Low | 60.4 | Low | 144 Ų | 144 | 96.1 Ų | 96.1 | 67% | 0.673 | 50% | 0.504 | S | S | * | . | G | 310 helix | trans | -58.3 | -33.8 | -175.2 | -78.4 | 62.1 | -144.4 | 0 | 0 | 112.3 | R311 C315 R316 | R311-E313 PolarHBondContact O-N 3.43Å; E313-C315 PolarHBondContact O-N 3.28Å; E313-C315 VanDerWaalsContact O-N 3.09Å; E313-R316 WeakPolarHBondContact O-CB 3.46Å; E313-R316 PolarHBondContact O-N 2.93Å |
| 314 | S | 54.7 | Low | 58.5 | Low | 61 Ų | 61 | 98.4 Ų | 98.4 | 43% | 0.427 | 53% | 0.525 | S | S | . | . | G | 310 helix | trans | -60.8 | -15.2 | 173.2 | 58.5 | 0 | 0 | 0 | 0 | 114.1 | G213 P312 | G213-S314 WeakPolarHBondContact CA-OG 3.2Å; P312-S314 PolarHBondContact O-N 2.92Å |
| 315 | C | 52.1 | Low | 56.1 | Low | 12 Ų | 12 | 107.7 Ų | 107.7 | 8% | 0.081 | 57% | 0.568 | C | S | . | * | G | 310 helix | trans | -110.4 | 11.6 | 178.4 | -57.6 | 0 | 0 | 0 | 0 | 112.6 | I276 R311 P312 E313 | I276-C315 HydrophobicContact CD1-CB 3.54Å; I276-C315 VanDerWaalsContact CD1-SG 3.53Å; R311-C315 PolarHBondContact NH2-O 3.35Å; P312-C315 HydrophobicContact CG-CB 4.07Å; P312-C315 WeakPolarHBondContact O-CA 3.32Å; P312-C315 WeakPolarHBondContact O-CB 3.4Å; P312-C315 PolarHBondContact O-N 2.9Å; E313-C315 PolarHBondContact O-N 3.28Å; E313-C315 VanDerWaalsContact O-N 3.09Å |
| 316 | R | 52 | Low | 53.7 | Low | 172 Ų | 172 | 108.1 Ų | 108.1 | 65% | 0.649 | 58% | 0.584 | S | S | * | * | S | Bend | trans | -73.8 | 128.6 | 151.7 | -68.4 | -168.5 | -177.4 | -144.2 | 5.3 | 107.7 | E313 | E313-R316 WeakPolarHBondContact O-CB 3.46Å; E313-R316 PolarHBondContact O-N 2.93Å |
| 317 | R | 46.9 | Very low | 51.8 | Low | 220 Ų | 220 | 108 Ų | 108 | 83% | 0.83 | 60% | 0.596 | S | S | * | * | trans | -56.8 | 142 | 161.3 | -83 | -171.7 | -78.9 | 175.1 | -6.6 | 108.1 | G319 | R317-G319 PolarHBondContact O-N 3.24Š| ||
| 318 | P | 41.6 | Very low | 49.3 | Very low | 134 Ų | 134 | 116.6 Ų | 116.6 | 87% | 0.87 | 64% | 0.638 | S | S | * | * | trans | -56 | 106.1 | 163.9 | -23.4 | 34.2 | 0 | 0 | 0 | 109 | ||||
| 319 | G | 39.7 | Very low | 47 | Very low | 64 Ų | 64 | 122.8 Ų | 122.8 | 66% | 0.66 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 145.5 | 169.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | R317 | R317-G319 PolarHBondContact O-N 3.24Š|
| 320 | K | 35.8 | Very low | 45.4 | Very low | 204 Ų | 204 | 125.4 Ų | 125.4 | 89% | 0.887 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 127.5 | 169.3 | -69.3 | -177.8 | 175.7 | -177.6 | 0 | 107.9 | G322 | K320-G322 PolarHBondContact O-N 3.35Š|
| 321 | P | 39.1 | Very low | 43.8 | Very low | 135 Ų | 135 | 128.8 Ų | 128.8 | 88% | 0.877 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 121.7 | 177 | 27.8 | -33.1 | 0 | 0 | 0 | 108.7 | ||
| 322 | G | 42.3 | Very low | 42.7 | Very low | 71 Ų | 71 | 126.9 Ų | 126.9 | 73% | 0.732 | 71% | 0.708 | S | S | * | * | trans | 172.6 | 38.1 | -170.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | K320 | K320-G322 PolarHBondContact O-N 3.35Š| ||
| 323 | E | 31.7 | Very low | 41.9 | Very low | 192 Ų | 192 | 132.6 Ų | 132.6 | 90% | 0.897 | 74% | 0.743 | S | S | * | * | trans | -158.7 | 154.4 | 143.2 | -103.9 | -159.1 | 115.6 | 0 | 0 | 110.2 | ||||
| 324 | P | 45.6 | Very low | 41.1 | Very low | 114 Ų | 114 | 132.5 Ų | 132.5 | 74% | 0.74 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -86.2 | 138.4 | -175.6 | 33.3 | -33.3 | 0 | 0 | 0 | 113.2 | ||
| 325 | E | 37.8 | Very low | 40.5 | Very low | 194 Ų | 194 | 135.2 Ų | 135.2 | 91% | 0.907 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 131.5 | 171 | -72.9 | -103.1 | 117.1 | 0 | 0 | 111.7 | ||
| 326 | A | 36.2 | Very low | 39.8 | Very low | 92 Ų | 92 | 139.3 Ų | 139.3 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -95 | 117.4 | 168.9 | 0 | 0 | 0 | 0 | 0 | 110 | M328 | A326-M328 PolarHBondContact O-N 3.28Š|
| 327 | P | 48.3 | Very low | 39.3 | Very low | 122 Ų | 122 | 139.7 Ų | 139.7 | 79% | 0.792 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 122.8 | -175.4 | 28.5 | -34.2 | 0 | 0 | 0 | 111.7 | L329 | P327-L329 PolarHBondContact O-N 3.09Å; P327-L329 VanDerWaalsContact O-N 3.08Å |
| 328 | M | 33.4 | Very low | 38.9 | Very low | 196 Ų | 196 | 132.6 Ų | 132.6 | 97% | 0.966 | 80% | 0.8 | S | S | * | * | trans | -76.7 | 96.5 | 178.5 | -162 | 177 | -164.9 | 0 | 0 | 110.7 | A326 | A326-M328 PolarHBondContact O-N 3.28Š| ||
| 329 | L | 38.2 | Very low | 38.7 | Very low | 131 Ų | 131 | 134.2 Ų | 134.2 | 69% | 0.686 | 80% | 0.796 | S | S | * | * | trans | -89.7 | 132.9 | -174.4 | -161.3 | 148.4 | 0 | 0 | 0 | 112.2 | P327 H331 | P327-L329 PolarHBondContact O-N 3.09Å; P327-L329 VanDerWaalsContact O-N 3.08Å; L329-H331 PolarHBondContact O-N 3.18Å | ||
| 330 | T | 42.6 | Very low | 38.3 | Very low | 129 Ų | 129 | 136.4 Ų | 136.4 | 79% | 0.791 | 80% | 0.801 | S | S | * | * | trans | -68.6 | 121.6 | -177.6 | 50.9 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 331 | H | 36.1 | Very low | 38.3 | Very low | 175 Ų | 175 | 131.8 Ų | 131.8 | 81% | 0.81 | 79% | 0.793 | S | S | * | * | trans | -111.1 | 112.6 | 168.8 | -87.1 | -88.3 | 0 | 0 | 0 | 112.2 | L329 | L329-H331 PolarHBondContact O-N 3.18Š| ||
| 332 | A | 34.2 | Very low | 38.2 | Very low | 93 Ų | 93 | 133.8 Ų | 133.8 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | trans | -91.5 | 160.2 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 333 | T | 38.1 | Very low | 37.8 | Very low | 130 Ų | 130 | 134.1 Ų | 134.1 | 80% | 0.798 | 80% | 0.799 | S | S | * | * | trans | -29.1 | 132.6 | 174.1 | -50.7 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 334 | T | 37.4 | Very low | 38 | Very low | 141 Ų | 141 | 133.2 Ų | 133.2 | 87% | 0.865 | 80% | 0.799 | S | S | * | * | trans | -149.8 | 147.6 | 146.1 | -73.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 335 | V | 41.3 | Very low | 37.3 | Very low | 118 Ų | 118 | 132.7 Ų | 132.7 | 72% | 0.715 | 80% | 0.798 | S | S | * | * | trans | -109 | 138.8 | -171.2 | 174.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 336 | A | 38.3 | Very low | 37.1 | Very low | 98 Ų | 98 | 132.9 Ų | 132.9 | 81% | 0.81 | 80% | 0.798 | S | S | * | * | trans | -150.5 | 138.1 | 159.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 337 | M | 40.7 | Very low | 37.1 | Very low | 180 Ų | 180 | 136 Ų | 136 | 89% | 0.887 | 80% | 0.801 | S | S | * | * | trans | -112.4 | 170.7 | 164.2 | -50.9 | -173.2 | -179.6 | 0 | 0 | 107.1 | ||||
| 338 | A | 38 | Very low | 37 | Very low | 71 Ų | 71 | 135.6 Ų | 135.6 | 59% | 0.587 | 80% | 0.799 | S | S | * | * | cis | -165.4 | -162 | -0.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 339 | H | 37.6 | Very low | 37.6 | Very low | 169 Ų | 169 | 131.7 Ų | 131.7 | 78% | 0.782 | 79% | 0.788 | S | S | * | * | trans | 97.5 | 113.9 | 150.8 | -56.9 | -79.3 | 0 | 0 | 0 | 120.5 | ||||
| 340 | S | 32.3 | Very low | 37.4 | Very low | 109 Ų | 109 | 134.9 Ų | 134.9 | 76% | 0.762 | 80% | 0.797 | S | S | * | * | trans | 70.2 | 152.4 | 131.1 | -57.5 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 341 | C | 34.7 | Very low | 37.8 | Very low | 107 Ų | 107 | 134.1 Ų | 134.1 | 72% | 0.723 | 79% | 0.794 | S | S | * | * | cis | -170.3 | 131 | -36.9 | -114.4 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 342 | L | 37.2 | Very low | 37.6 | Very low | 177 Ų | 177 | 133.3 Ų | 133.3 | 93% | 0.927 | 80% | 0.795 | S | S | * | * | trans | 53 | 134 | 152.6 | -54.6 | 177.5 | 0 | 0 | 0 | 121.8 | ||||
| 343 | G | 34 | Very low | 37.7 | Very low | 78 Ų | 78 | 136.6 Ų | 136.6 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | -157.7 | 136.9 | 166.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 344 | I | 36.1 | Very low | 37.5 | Very low | 174 Ų | 174 | 135.8 Ų | 135.8 | 89% | 0.892 | 79% | 0.791 | S | S | * | * | trans | -94.4 | 154.2 | -154.6 | -68.3 | 168.6 | 0 | 0 | 0 | 115.2 | ||||
| 345 | S | 31.6 | Very low | 37.3 | Very low | 103 Ų | 103 | 135.7 Ų | 135.7 | 72% | 0.72 | 79% | 0.785 | S | S | * | * | trans | -54.3 | 160 | -177.9 | -40.1 | 0 | 0 | 0 | 0 | 119 | ||||
| 346 | Q | 32 | Very low | 37 | Very low | 197 Ų | 197 | 135.2 Ų | 135.2 | 92% | 0.921 | 79% | 0.786 | S | S | * | * | -158.2 | 157.9 | 126.7 | -112.1 | 169.1 | 108 | 0 | 0 | 113.6 | |||||
| 347 | L | 36.5 | Very low | 36.7 | Very low | 157 Ų | 157 | 138.8 Ų | 138.8 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | trans | -109.4 | -179.9 | 176.4 | -123.5 | 81.1 | 0 | 0 | 0 | 109.1 | ||||
| 348 | P | 46.2 | Very low | 36.3 | Very low | 114 Ų | 114 | 139.8 Ų | 139.8 | 74% | 0.74 | 79% | 0.794 | S | S | * | * | cis | -136 | -142 | 30.7 | 32.7 | -5.2 | 0 | 0 | 0 | 114 | ||||
| 349 | P | 47 | Very low | 36.3 | Very low | 115 Ų | 115 | 141.7 Ų | 141.7 | 75% | 0.747 | 80% | 0.803 | S | S | * | * | -116.4 | -176.2 | -88.6 | 38.6 | -24.5 | 0 | 0 | 0 | 116.3 | |||||
| 350 | K | 34 | Very low | 36.2 | Very low | 197 Ų | 197 | 140.8 Ų | 140.8 | 86% | 0.857 | 81% | 0.809 | S | S | * | * | trans | -83.2 | -173.8 | -174.8 | -43.9 | 175.1 | -178.4 | 174.6 | 0 | 112.3 | ||||
| 351 | P | 50.9 | Low | 37.4 | Very low | 113 Ų | 113 | 141 Ų | 141 | 73% | 0.734 | 81% | 0.808 | S | S | * | * | cis | -139.3 | 174.2 | -2.8 | 42.9 | -26.1 | 0 | 0 | 0 | 116.9 | ||||
| 352 | L | 30.7 | Very low | 37.3 | Very low | 159 Ų | 159 | 144.3 Ų | 144.3 | 83% | 0.832 | 82% | 0.817 | S | S | * | * | -171.6 | 139.3 | 124.6 | -101.9 | 170.1 | 0 | 0 | 0 | 113 | |||||
| 353 | M | 37.7 | Very low | 37.1 | Very low | 162 Ų | 162 | 143.1 Ų | 143.1 | 80% | 0.798 | 81% | 0.807 | S | S | * | * | trans | -2.2 | 156.2 | 150.3 | -62.6 | -60.7 | 176.4 | 0 | 0 | 120.4 | ||||
| 354 | T | 33.3 | Very low | 37.3 | Very low | 113 Ų | 113 | 146.7 Ų | 146.7 | 69% | 0.693 | 80% | 0.802 | S | S | * | * | cis | -177.6 | 178.2 | -13.8 | -160.3 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 355 | L | 33.8 | Very low | 36.9 | Very low | 138 Ų | 138 | 146 Ų | 146 | 72% | 0.723 | 80% | 0.795 | S | S | * | * | cis | -149.7 | 175.4 | 10.7 | -132.5 | -169.3 | 0 | 0 | 0 | 108.9 | ||||
| 356 | S | 33.5 | Very low | 36.8 | Very low | 108 Ų | 108 | 147.1 Ų | 147.1 | 76% | 0.755 | 80% | 0.797 | S | S | * | * | trans | -139 | 154.9 | 166.2 | -68.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 357 | L | 32.1 | Very low | 36.7 | Very low | 173 Ų | 173 | 146 Ų | 146 | 91% | 0.906 | 79% | 0.792 | S | S | * | * | trans | -127.4 | 143 | 174 | -75 | 175.4 | 0 | 0 | 0 | 111.7 | ||||
| 358 | Q | 33.3 | Very low | 37.5 | Very low | 201 Ų | 201 | 142.9 Ų | 142.9 | 94% | 0.939 | 78% | 0.781 | S | S | * | * | trans | -152.4 | 148.7 | 176.9 | -158.9 | 168.2 | 32.8 | 0 | 0 | 109.1 | ||||
| 359 | S | 37.9 | Very low | 36.7 | Very low | 111 Ų | 111 | 145.5 Ų | 145.5 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | trans | -148.8 | 139.3 | -160.7 | 49 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 360 | V | 35.9 | Very low | 36 | Very low | 151 Ų | 151 | 145.4 Ų | 145.4 | 92% | 0.915 | 78% | 0.781 | S | S | * | * | trans | -160.9 | 169.9 | 165.1 | -105.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 361 | P | 56.8 | Low | 35.9 | Very low | 114 Ų | 114 | 143.4 Ų | 143.4 | 74% | 0.74 | 77% | 0.774 | S | S | * | * | trans | -128.3 | -175.2 | -134.6 | 45.6 | -33.1 | 0 | 0 | 0 | 118.3 | ||||
| 362 | L | 32.3 | Very low | 35.1 | Very low | 175 Ų | 175 | 145.6 Ų | 145.6 | 92% | 0.916 | 78% | 0.779 | S | S | * | * | trans | -149.6 | -158.7 | 166.2 | -147.2 | 66.4 | 0 | 0 | 0 | 113.6 | ||||
| 363 | H | 34.5 | Very low | 35 | Very low | 153 Ų | 153 | 142.3 Ų | 142.3 | 71% | 0.708 | 78% | 0.775 | S | S | * | * | trans | -152.8 | 177.8 | -159.7 | -167.4 | -113.5 | 0 | 0 | 0 | 115.3 | ||||
| 364 | H | 36.4 | Very low | 35.7 | Very low | 152 Ų | 152 | 140 Ų | 140 | 70% | 0.704 | 77% | 0.772 | S | S | * | * | trans | 75.8 | 160.9 | 174.6 | -62.7 | 131 | 0 | 0 | 0 | 117.6 | ||||
| 365 | Q | 29.2 | Very low | 35.6 | Very low | 161 Ų | 161 | 141.7 Ų | 141.7 | 75% | 0.752 | 78% | 0.777 | S | S | * | * | cis | -178.2 | 167.2 | -26.7 | -173.1 | -164.6 | -13.7 | 0 | 0 | 109.4 | ||||
| 366 | V | 28.7 | Very low | 35.7 | Very low | 126 Ų | 126 | 140 Ų | 140 | 76% | 0.764 | 78% | 0.777 | S | S | * | * | trans | 94.3 | 155.1 | 158 | -168.8 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 367 | Q | 30.9 | Very low | 36.7 | Very low | 174 Ų | 174 | 140.9 Ų | 140.9 | 81% | 0.813 | 78% | 0.78 | S | S | * | * | trans | -151.1 | -160.2 | -177.5 | -134.1 | -154.9 | 15 | 0 | 0 | 109.5 | ||||
| 368 | P | 52.3 | Low | 36.8 | Very low | 91 Ų | 91 | 137 Ų | 137 | 59% | 0.591 | 77% | 0.772 | S | S | * | * | cis | -140.2 | -146.6 | 10.2 | 35.8 | -8.1 | 0 | 0 | 0 | 115.5 | ||||
| 369 | Q | 30.3 | Very low | 38.1 | Very low | 169 Ų | 169 | 133.6 Ų | 133.6 | 79% | 0.79 | 77% | 0.768 | S | S | * | * | trans | 78.6 | 157.8 | 165.7 | -58.6 | -167.8 | -100.7 | 0 | 0 | 118.7 | ||||
| 370 | T | 31.8 | Very low | 37.7 | Very low | 112 Ų | 112 | 133 Ų | 133 | 69% | 0.687 | 77% | 0.769 | S | S | * | * | cis | -161.6 | -162.8 | -21 | 32.4 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 371 | H | 32 | Very low | 37.6 | Very low | 156 Ų | 156 | 133.8 Ų | 133.8 | 72% | 0.722 | 76% | 0.763 | S | S | * | * | cis | -167.9 | 168.5 | 10.7 | -151.7 | -153 | 0 | 0 | 0 | 113.8 | ||||
| 372 | L | 32.8 | Very low | 36.4 | Very low | 158 Ų | 158 | 134 Ų | 134 | 83% | 0.827 | 76% | 0.762 | S | S | * | * | trans | 68.7 | 159.7 | 161.4 | -77.2 | 166.1 | 0 | 0 | 0 | 122.8 | ||||
| 373 | A | 28.6 | Very low | 37.1 | Very low | 91 Ų | 91 | 131.2 Ų | 131.2 | 75% | 0.752 | 76% | 0.755 | S | S | * | * | trans | -136.7 | -163.4 | -166.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 374 | P | 53.5 | Low | 38.5 | Very low | 114 Ų | 114 | 129.7 Ų | 129.7 | 74% | 0.74 | 76% | 0.758 | S | S | * | * | cis | -122.8 | -144.5 | 24 | 32.5 | -6.6 | 0 | 0 | 0 | 112.8 | ||||
| 375 | D | 30.9 | Very low | 38.4 | Very low | 148 Ų | 148 | 129.5 Ų | 129.5 | 79% | 0.791 | 76% | 0.762 | S | S | * | * | cis | -159.7 | -158 | 8.3 | -144.3 | -58.7 | 0 | 0 | 0 | 113.1 | ||||
| 376 | S | 35.9 | Very low | 38.7 | Very low | 103 Ų | 103 | 130.1 Ų | 130.1 | 72% | 0.72 | 76% | 0.764 | S | S | * | * | trans | -140.9 | -172.6 | -172.1 | -130.1 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 377 | P | 54.3 | Low | 39 | Very low | 126 Ų | 126 | 128.2 Ų | 128.2 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | cis | -141.5 | -167.5 | 33.5 | 42.8 | -20.4 | 0 | 0 | 0 | 118.1 | ||||
| 378 | A | 34.6 | Very low | 39.2 | Very low | 91 Ų | 91 | 127.2 Ų | 127.2 | 75% | 0.752 | 76% | 0.762 | S | S | * | * | trans | -118.7 | -145.4 | -176.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 379 | P | 60.4 | Low | 39.1 | Very low | 130 Ų | 130 | 129.1 Ų | 129.1 | 84% | 0.844 | 77% | 0.774 | S | S | * | * | cis | -143.1 | 175.6 | 0.5 | 44.5 | -25.1 | 0 | 0 | 0 | 119.3 | ||||
| 380 | A | 29.9 | Very low | 39.3 | Very low | 98 Ų | 98 | 127.8 Ų | 127.8 | 81% | 0.81 | 77% | 0.772 | S | S | * | * | trans | -170.1 | 177.3 | 164.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 381 | Q | 34.3 | Very low | 39.3 | Very low | 168 Ų | 168 | 130.3 Ų | 130.3 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | -154.8 | -177.3 | -63.7 | -109.6 | -61.5 | 1.3 | 0 | 0 | 111.2 | |||||
| 382 | T | 31.3 | Very low | 39.6 | Very low | 118 Ų | 118 | 128.3 Ų | 128.3 | 72% | 0.724 | 78% | 0.784 | S | S | * | * | trans | -143.4 | -175 | -171.1 | 60.7 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 383 | P | 45.9 | Very low | 40.8 | Very low | 116 Ų | 116 | 127.1 Ų | 127.1 | 75% | 0.753 | 79% | 0.786 | S | S | * | * | cis | -138.4 | -174.9 | 1.2 | 42.6 | -22.2 | 0 | 0 | 0 | 117.4 | ||||
| 384 | P | 64.9 | Low | 40.9 | Very low | 121 Ų | 121 | 126.2 Ų | 126.2 | 79% | 0.786 | 79% | 0.785 | S | S | * | * | trans | -120.9 | -176.2 | 179.9 | 43.3 | -32.6 | 0 | 0 | 0 | 115.4 | ||||
| 385 | L | 34.2 | Very low | 40.8 | Very low | 149 Ų | 149 | 127.1 Ų | 127.1 | 78% | 0.78 | 79% | 0.791 | S | S | * | * | trans | -170 | 159.6 | 159.1 | -111.8 | 178.8 | 0 | 0 | 0 | 119.2 | ||||
| 386 | H | 35.5 | Very low | 41.1 | Very low | 173 Ų | 173 | 127.9 Ų | 127.9 | 80% | 0.801 | 79% | 0.794 | S | S | * | * | trans | 84.1 | 156.6 | 157 | -79.8 | -61.2 | 0 | 0 | 0 | 124.7 | ||||
| 387 | A | 33.7 | Very low | 41.5 | Very low | 87 Ų | 87 | 128.9 Ų | 128.9 | 72% | 0.719 | 80% | 0.798 | S | S | * | * | trans | -153.4 | 165.6 | -149.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 388 | L | 35.4 | Very low | 40.5 | Very low | 153 Ų | 153 | 131.9 Ų | 131.9 | 80% | 0.801 | 80% | 0.802 | S | S | * | * | trans | 38.1 | 145.8 | 148 | -88.7 | 168.5 | 0 | 0 | 0 | 122.2 | ||||
| 389 | P | 51.6 | Low | 41.4 | Very low | 131 Ų | 131 | 132.9 Ų | 132.9 | 85% | 0.851 | 80% | 0.8 | S | S | * | * | -147.1 | -155.3 | 72.4 | 40.5 | -19.2 | 0 | 0 | 0 | 116.9 | |||||
| 390 | N | 33 | Very low | 40.2 | Very low | 141 Ų | 141 | 133.8 Ų | 133.8 | 75% | 0.754 | 80% | 0.803 | S | S | * | * | trans | -146.3 | 159.2 | -151.2 | -177.2 | 19.3 | 0 | 0 | 0 | 113.6 | ||||
| 391 | L | 33.3 | Very low | 40.4 | Very low | 165 Ų | 165 | 138.1 Ų | 138.1 | 86% | 0.864 | 81% | 0.809 | S | S | * | * | trans | -151 | 167.9 | 174.7 | -94.7 | 176.4 | 0 | 0 | 0 | 114.7 | ||||
| 392 | S | 37.7 | Very low | 40.2 | Very low | 113 Ų | 113 | 133.7 Ų | 133.7 | 79% | 0.79 | 81% | 0.808 | S | S | * | * | trans | -121.2 | 172.7 | -150.7 | -64.1 | 0 | 0 | 0 | 0 | 118 | ||||
| 393 | P | 56.8 | Low | 40.3 | Very low | 133 Ų | 133 | 139.6 Ų | 139.6 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | trans | -124.3 | 179.1 | -159.7 | 44.6 | -33.6 | 0 | 0 | 0 | 118.8 | ||||
| 394 | G | 32.1 | Very low | 40.3 | Very low | 72 Ų | 72 | 138.9 Ų | 138.9 | 74% | 0.742 | 81% | 0.812 | S | S | * | * | trans | 136.7 | 173.6 | 161.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 395 | P | 51 | Low | 39.6 | Very low | 134 Ų | 134 | 138 Ų | 138 | 87% | 0.87 | 81% | 0.807 | S | S | * | * | cis | -136.3 | -167.2 | -14.4 | 42.9 | -24.2 | 0 | 0 | 0 | 115.2 | ||||
| 396 | L | 36.9 | Very low | 39.5 | Very low | 163 Ų | 163 | 134.5 Ų | 134.5 | 85% | 0.853 | 81% | 0.806 | S | S | * | * | trans | -98 | 170.3 | 179.4 | -75.5 | 166 | 0 | 0 | 0 | 114.9 | ||||
| 397 | P | 43.7 | Very low | 39.4 | Very low | 124 Ų | 124 | 132.5 Ų | 132.5 | 81% | 0.805 | 80% | 0.801 | S | S | * | * | trans | -129.3 | 174.4 | 139.6 | 38 | -27.3 | 0 | 0 | 0 | 114.8 | ||||
| 398 | Q | 34.5 | Very low | 39.4 | Very low | 190 Ų | 190 | 138.2 Ų | 138.2 | 89% | 0.888 | 81% | 0.811 | S | S | * | * | trans | -132.8 | 175.4 | -171.4 | -106.3 | -152.4 | 12.5 | 0 | 0 | 113.8 | ||||
| 399 | P | 53.7 | Low | 39.5 | Very low | 111 Ų | 111 | 139.2 Ų | 139.2 | 72% | 0.721 | 82% | 0.816 | S | S | * | * | trans | -98 | 178 | -155.9 | 39.5 | -39.4 | 0 | 0 | 0 | 117.3 | ||||
| 400 | V | 34.7 | Very low | 38.6 | Very low | 150 Ų | 150 | 140.3 Ų | 140.3 | 91% | 0.909 | 82% | 0.815 | S | S | * | * | trans | -133.2 | 157.9 | 174.8 | 173.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 401 | M | 34.4 | Very low | 38.8 | Very low | 189 Ų | 189 | 141 Ų | 141 | 93% | 0.931 | 82% | 0.817 | S | S | * | * | trans | -127.8 | 148.7 | -164.6 | -163.5 | 171.5 | -165 | 0 | 0 | 113 | ||||
| 402 | G | 30.1 | Very low | 38.8 | Very low | 74 Ų | 74 | 137.4 Ų | 137.4 | 76% | 0.763 | 81% | 0.805 | S | S | * | * | trans | -145.4 | -17.9 | -164.7 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 403 | R | 32.3 | Very low | 38.7 | Very low | 243 Ų | 243 | 137.3 Ų | 137.3 | 92% | 0.917 | 80% | 0.8 | S | S | * | * | trans | 63.3 | 167.6 | 173.7 | -94.1 | -144.1 | 138.1 | 162.2 | -5.1 | 119.8 | ||||
| 404 | P | 47 | Very low | 37.6 | Very low | 100 Ų | 100 | 137.7 Ų | 137.7 | 65% | 0.649 | 80% | 0.795 | S | S | * | * | trans | -129.2 | -149 | -156.3 | 48.3 | -30.3 | 0 | 0 | 0 | 111.4 | ||||
| 405 | P | 49.8 | Very low | 37.8 | Very low | 104 Ų | 104 | 141.4 Ų | 141.4 | 68% | 0.675 | 79% | 0.794 | S | S | * | * | cis | -135.3 | 173.4 | -7.3 | 39.2 | -20 | 0 | 0 | 0 | 117.7 | ||||
| 406 | G | 33.2 | Very low | 37.2 | Very low | 74 Ų | 74 | 141.3 Ų | 141.3 | 76% | 0.763 | 79% | 0.787 | S | S | * | * | trans | -143.9 | 126.8 | 149 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 407 | D | 32.3 | Very low | 37.5 | Very low | 131 Ų | 131 | 140.5 Ų | 140.5 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | trans | -86.5 | 142.1 | -160.4 | -51.8 | -85.2 | 0 | 0 | 0 | 114.6 | ||||
| 408 | F | 33.6 | Very low | 37.7 | Very low | 208 Ų | 208 | 143.4 Ų | 143.4 | 91% | 0.912 | 79% | 0.791 | S | S | * | * | -163.9 | 159.9 | 116.9 | -99.1 | -66.2 | 0 | 0 | 0 | 110.3 | |||||
| 409 | L | 37.4 | Very low | 38.4 | Very low | 174 Ų | 174 | 141.6 Ų | 141.6 | 91% | 0.911 | 79% | 0.793 | S | S | * | * | trans | -95.4 | 149.6 | -155.9 | -68.6 | 163.2 | 0 | 0 | 0 | 115.1 | ||||
| 410 | N | 34.1 | Very low | 38.4 | Very low | 154 Ų | 154 | 143.7 Ų | 143.7 | 82% | 0.824 | 80% | 0.798 | S | S | * | * | trans | -143.7 | 122.5 | 167.8 | 178.6 | 23.6 | 0 | 0 | 0 | 110.7 | ||||
| 411 | I | 36.7 | Very low | 39 | Very low | 156 Ų | 156 | 141.3 Ų | 141.3 | 80% | 0.8 | 79% | 0.794 | S | S | * | * | trans | -171.9 | 141.2 | 167.7 | -123.5 | 168.3 | 0 | 0 | 0 | 107.5 | ||||
| 412 | S | 32.8 | Very low | 39.7 | Very low | 88 Ų | 88 | 140 Ų | 140 | 62% | 0.615 | 79% | 0.791 | S | S | * | * | cis | -127.6 | 146.8 | 0.5 | -67.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 413 | T | 35.5 | Very low | 40.3 | Very low | 111 Ų | 111 | 141.5 Ų | 141.5 | 68% | 0.681 | 78% | 0.781 | S | S | * | * | 45 | 138.9 | 79.1 | 34.2 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 414 | D | 33.2 | Very low | 41.1 | Very low | 142 Ų | 142 | 135.8 Ų | 135.8 | 76% | 0.759 | 78% | 0.775 | S | S | * | * | cis | -155.6 | 162.5 | 17.7 | -126.8 | -47.6 | 0 | 0 | 0 | 113 | ||||
| 415 | M | 37.3 | Very low | 41.1 | Very low | 149 Ų | 149 | 134.9 Ų | 134.9 | 73% | 0.734 | 77% | 0.771 | S | S | * | * | trans | 161.4 | 133.9 | 146.7 | -85.4 | -116.3 | 79.2 | 0 | 0 | 114 | ||||
| 416 | N | 37.9 | Very low | 41.2 | Very low | 133 Ų | 133 | 137.1 Ų | 137.1 | 71% | 0.711 | 78% | 0.776 | S | S | * | * | trans | 70.8 | 87.9 | 159 | -55 | -34.8 | 0 | 0 | 0 | 119.3 | ||||
| 417 | T | 44.2 | Very low | 42.1 | Very low | 145 Ų | 145 | 141.7 Ų | 141.7 | 89% | 0.89 | 78% | 0.779 | S | S | * | * | trans | -121.9 | 56.5 | 164.6 | -46.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 418 | E | 47.2 | Very low | 42.6 | Very low | 185 Ų | 185 | 141.7 Ų | 141.7 | 86% | 0.864 | 78% | 0.779 | S | S | * | * | trans | -141 | 83.5 | -179.6 | -69.7 | -171.1 | 177.5 | 0 | 0 | 112.2 | ||||
| 419 | V | 48.4 | Very low | 43 | Very low | 153 Ų | 153 | 141.5 Ų | 141.5 | 93% | 0.927 | 78% | 0.779 | S | S | * | * | trans | -167.1 | 67.5 | 156.3 | -91.6 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 420 | D | 53.6 | Low | 43.4 | Very low | 155 Ų | 155 | 137.7 Ų | 137.7 | 83% | 0.829 | 77% | 0.772 | S | S | * | * | trans | -145.8 | 87.5 | 159.8 | -156.2 | -4.6 | 0 | 0 | 0 | 111.7 | ||||
| 421 | A | 47 | Very low | 44.2 | Very low | 100 Ų | 100 | 137.6 Ų | 137.6 | 83% | 0.826 | 77% | 0.771 | S | S | * | * | trans | -161.1 | 51.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 422 | L | 49.7 | Very low | 44.5 | Very low | 162 Ų | 162 | 139.3 Ų | 139.3 | 85% | 0.848 | 78% | 0.775 | S | S | * | * | trans | -75.7 | 131.6 | 176 | -72.8 | 174.5 | 0 | 0 | 0 | 110.6 | ||||
| 423 | D | 42.7 | Very low | 45.4 | Very low | 105 Ų | 105 | 138 Ų | 138 | 56% | 0.561 | 78% | 0.776 | S | S | * | * | trans | -62.4 | 123.9 | 178.4 | 173.9 | 18.4 | 0 | 0 | 0 | 111.2 | S425 | D423-S425 PolarHBondContact O-N 3.37Å; D423-S425 PolarHBondContact OD1-N 3.19Å; D423-S425 WeakPolarHBondContact OD2-CB 3.34Å; D423-S425 PolarHBondContact OD2-OG 3.23Å | ||
| 424 | P | 50.4 | Low | 46.2 | Very low | 123 Ų | 123 | 140 Ų | 140 | 80% | 0.799 | 78% | 0.782 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.5 | 14.9 | 179.9 | 31.4 | -36.9 | 0 | 0 | 0 | 114.6 | ||
| 425 | S | 46.8 | Very low | 47.1 | Very low | 81 Ų | 81 | 140.2 Ų | 140.2 | 57% | 0.566 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -17.1 | 177.2 | 73 | 0 | 0 | 0 | 0 | 115.2 | D423 M427 | D423-S425 PolarHBondContact O-N 3.37Å; D423-S425 PolarHBondContact OD1-N 3.19Å; D423-S425 WeakPolarHBondContact OD2-CB 3.34Å; D423-S425 PolarHBondContact OD2-OG 3.23Å; S425-M427 VanDerWaalsContact C-N 3.26Å; S425-M427 PolarHBondContact O-N 3.4Å |
| 426 | I | 50.2 | Low | 47.7 | Very low | 150 Ų | 150 | 143.6 Ų | 143.6 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | trans | -85.2 | 49 | -172.5 | -160.3 | 165.8 | 0 | 0 | 0 | 114.4 | ||||
| 427 | M | 53.7 | Low | 48.2 | Very low | 170 Ų | 170 | 144.4 Ų | 144.4 | 84% | 0.837 | 79% | 0.787 | S | S | * | * | trans | -128 | 33.9 | 178.9 | -162.7 | 81.9 | 81.6 | 0 | 0 | 113 | S425 | S425-M427 VanDerWaalsContact C-N 3.26Å; S425-M427 PolarHBondContact O-N 3.4Å | ||
| 428 | D | 42.6 | Very low | 48.4 | Very low | 131 Ų | 131 | 145.4 Ų | 145.4 | 70% | 0.701 | 78% | 0.782 | S | S | * | * | trans | -135.5 | 32.7 | -176.9 | -154.8 | -135.3 | 0 | 0 | 0 | 115.5 | ||||
| 429 | F | 41.4 | Very low | 48.8 | Very low | 205 Ų | 205 | 142.4 Ų | 142.4 | 90% | 0.899 | 78% | 0.776 | S | S | * | * | trans | -109.6 | 23.6 | 170.9 | -76.5 | -71.9 | 0 | 0 | 0 | 113.6 | ||||
| 430 | A | 45.3 | Very low | 48.7 | Very low | 93 Ų | 93 | 142.9 Ų | 142.9 | 77% | 0.769 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -97.9 | -5.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 431 | L | 52 | Low | 48.3 | Very low | 153 Ų | 153 | 142.6 Ų | 142.6 | 80% | 0.801 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -130.7 | 50 | -170.2 | -83.7 | 173.2 | 0 | 0 | 0 | 114.9 | ||
| 432 | Q | 42.6 | Very low | 48 | Very low | 191 Ų | 191 | 145.5 Ų | 145.5 | 89% | 0.893 | 76% | 0.761 | S | S | * | * | trans | -152 | 93.2 | 151.9 | -115.4 | 157 | 46.4 | 0 | 0 | 111.9 | ||||
| 433 | G | 51.8 | Low | 47.8 | Very low | 61 Ų | 61 | 142.4 Ų | 142.4 | 63% | 0.629 | 75% | 0.753 | S | S | * | * | trans | -71.2 | 178.8 | 153.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 434 | N | 51.6 | Low | 47.6 | Very low | 152 Ų | 152 | 147.1 Ų | 147.1 | 81% | 0.813 | 77% | 0.769 | S | S | * | * | trans | 77.3 | 55.4 | 176.2 | -44.2 | -10.8 | 0 | 0 | 0 | 115.6 | ||||
| 435 | L | 51.9 | Low | 46.8 | Very low | 148 Ų | 148 | 147.2 Ų | 147.2 | 78% | 0.775 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -146.4 | 26.4 | 158.2 | -151.4 | 75 | 0 | 0 | 0 | 114 | ||
| 436 | W | 50.7 | Low | 46.5 | Very low | 220 Ų | 220 | 151.5 Ų | 151.5 | 83% | 0.833 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -124.5 | 1.7 | 179.6 | -105.4 | 119.9 | 0 | 0 | 0 | 115 | ||
| 437 | E | 48.8 | Very low | 45.9 | Very low | 150 Ų | 150 | 153.2 Ų | 153.2 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -96.4 | -31 | 177.9 | -63.3 | -174.6 | 128.4 | 0 | 0 | 112 | V439 K440 | E437-V439 PolarHBondContact O-N 3.17Å; E437-K440 WeakPolarHBondContact O-CB 3.35Å; E437-K440 PolarHBondContact O-N 3.32Å |
| 438 | E | 47.4 | Very low | 45 | Very low | 165 Ų | 165 | 151.6 Ų | 151.6 | 77% | 0.771 | 79% | 0.792 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.9 | -23 | -173.5 | -163.1 | 168 | -157.6 | 0 | 0 | 114.6 | K440 | E438-K440 VanDerWaalsContact C-N 3.27Å; E438-K440 PolarHBondContact O-N 3Å |
| 439 | V | 55.7 | Low | 44.9 | Very low | 122 Ų | 122 | 153.3 Ų | 153.3 | 74% | 0.739 | 80% | 0.801 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.5 | 8.3 | 178.8 | -172.3 | 0 | 0 | 0 | 0 | 112.1 | E437 | E437-V439 PolarHBondContact O-N 3.17Š|
| 440 | K | 47.4 | Very low | 44.4 | Very low | 163 Ų | 163 | 146.8 Ų | 146.8 | 71% | 0.709 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -109 | -21.9 | -172.4 | -163.6 | -177.7 | 169 | -158.8 | 0 | 114.7 | E437 E438 | E437-K440 WeakPolarHBondContact O-CB 3.35Å; E437-K440 PolarHBondContact O-N 3.32Å; E438-K440 VanDerWaalsContact C-N 3.27Å; E438-K440 PolarHBondContact O-N 3Å |
| 441 | E | 43.7 | Very low | 44.1 | Very low | 149 Ų | 149 | 146.6 Ų | 146.6 | 70% | 0.696 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -81.4 | -22.1 | -170.8 | -63.4 | -58 | 119.6 | 0 | 0 | 114.1 | S443 | E441-S443 PolarHBondContact O-N 2.98Š|
| 442 | D | 42.6 | Very low | 43 | Very low | 162 Ų | 162 | 150.1 Ų | 150.1 | 87% | 0.866 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | 17 | -169 | -124.6 | -7 | 0 | 0 | 0 | 115 | ||
| 443 | S | 45.6 | Very low | 42.5 | Very low | 97 Ų | 97 | 144.5 Ų | 144.5 | 68% | 0.678 | 79% | 0.792 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -158.1 | 45.6 | 179.7 | -80.5 | 0 | 0 | 0 | 0 | 116.1 | E441 | E441-S443 PolarHBondContact O-N 2.98Š|
| 444 | F | 37 | Very low | 41.5 | Very low | 204 Ų | 204 | 149.1 Ų | 149.1 | 90% | 0.895 | 80% | 0.802 | S | S | * | * | trans | -151.3 | 116.5 | 146.2 | -83 | -62.6 | 0 | 0 | 0 | 112.2 | ||||
| 445 | S | 34.6 | Very low | 40.5 | Very low | 125 Ų | 125 | 146.8 Ų | 146.8 | 87% | 0.874 | 80% | 0.798 | S | S | * | * | trans | -156.8 | 85.8 | 168.4 | -82.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 446 | L | 39.4 | Very low | 40.8 | Very low | 171 Ų | 171 | 145 Ų | 145 | 90% | 0.895 | 80% | 0.796 | S | S | * | * | trans | -154.8 | 53.1 | 178.2 | -165.5 | 70.9 | 0 | 0 | 0 | 113.2 | ||||
| 447 | E | 37.8 | Very low | 40 | Very low | 185 Ų | 185 | 142.8 Ų | 142.8 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | trans | -163.8 | 75.2 | 162.1 | 48.1 | -169.4 | 148.4 | 0 | 0 | 114.9 | ||||
| 448 | T | 36.1 | Very low | 39 | Very low | 137 Ų | 137 | 138.7 Ų | 138.7 | 84% | 0.84 | 80% | 0.797 | S | S | * | * | trans | -176.7 | 142 | 150.8 | 11.7 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 449 | L | 39.7 | Very low | 38.4 | Very low | 167 Ų | 167 | 137.1 Ų | 137.1 | 87% | 0.874 | 80% | 0.803 | S | S | * | * | cis | -127.8 | 162.7 | 4.5 | -87.2 | 147 | 0 | 0 | 0 | 110.5 | ||||
| 450 | G | 31.8 | Very low | 37.2 | Very low | 68 Ų | 68 | 138.4 Ų | 138.4 | 70% | 0.701 | 81% | 0.806 | S | S | * | * | trans | -98.9 | 162.9 | 165.3 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 451 | A | 37.2 | Very low | 36.6 | Very low | 88 Ų | 88 | 138.7 Ų | 138.7 | 73% | 0.727 | 81% | 0.814 | S | S | * | * | trans | 67 | 97 | 167.2 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 452 | F | 30.6 | Very low | 36 | Very low | 227 Ų | 227 | 134.6 Ų | 134.6 | 100% | 0.996 | 81% | 0.812 | S | S | * | * | trans | -177.3 | 141.6 | 133.2 | -69.3 | -54.8 | 0 | 0 | 0 | 105.4 | ||||
| 453 | G | 30.4 | Very low | 35.7 | Very low | 74 Ų | 74 | 131.4 Ų | 131.4 | 76% | 0.763 | 81% | 0.807 | S | S | * | * | cis | -164.7 | -164.2 | -3.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 454 | D | 32.3 | Very low | 35.8 | Very low | 157 Ų | 157 | 132.9 Ų | 132.9 | 84% | 0.84 | 82% | 0.815 | S | S | * | * | trans | -66 | 143.3 | -170.1 | -70.7 | -95.1 | 0 | 0 | 0 | 118.4 | ||||
| 455 | S | 30.5 | Very low | 35.4 | Very low | 104 Ų | 104 | 128.3 Ų | 128.3 | 73% | 0.727 | 81% | 0.808 | S | S | * | * | trans | 28.2 | 161.3 | 130.3 | -50.9 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 456 | P | 57.2 | Low | 35.4 | Very low | 110 Ų | 110 | 130.1 Ų | 130.1 | 71% | 0.714 | 81% | 0.807 | S | S | * | * | cis | -134.3 | -165.5 | -43.5 | 39.9 | -22.3 | 0 | 0 | 0 | 111.7 | ||||
| 457 | L | 34.6 | Very low | 35.2 | Very low | 174 Ų | 174 | 127.7 Ų | 127.7 | 91% | 0.911 | 80% | 0.799 | S | S | * | * | trans | 143.1 | 154.6 | 144.9 | -77.8 | 169.6 | 0 | 0 | 0 | 115.6 | ||||
| 458 | G | 27.4 | Very low | 35.8 | Very low | 63 Ų | 63 | 124.6 Ų | 124.6 | 65% | 0.649 | 80% | 0.795 | S | S | * | * | trans | 92.3 | 106.7 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 459 | C | 35.5 | Very low | 35.7 | Very low | 133 Ų | 133 | 125.1 Ų | 125.1 | 90% | 0.899 | 80% | 0.798 | S | S | * | * | 64.2 | 133.6 | 61.1 | -52.5 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 460 | D | 29.1 | Very low | 35.5 | Very low | 149 Ų | 149 | 123.1 Ų | 123.1 | 80% | 0.797 | 80% | 0.798 | S | S | * | * | cis | -144.5 | 159.1 | 17.4 | -177 | 34.4 | 0 | 0 | 0 | 112.9 | ||||
| 461 | L | 36.5 | Very low | 35.5 | Very low | 169 Ų | 169 | 123.8 Ų | 123.8 | 89% | 0.885 | 81% | 0.805 | S | S | * | * | trans | -139.6 | 111.4 | 172.1 | -115 | 176.1 | 0 | 0 | 0 | 109.7 | A463 | L461-A463 PolarHBondContact O-N 2.59Š| ||
| 462 | G | 30 | Very low | 35.2 | Very low | 63 Ų | 63 | 125.6 Ų | 125.6 | 65% | 0.649 | 81% | 0.812 | S | S | * | * | trans | -75.6 | 111.5 | -164 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 463 | A | 37.5 | Very low | 35.2 | Very low | 94 Ų | 94 | 118.4 Ų | 118.4 | 78% | 0.777 | 80% | 0.803 | S | S | * | * | trans | 61.9 | 160.5 | 134.6 | 0 | 0 | 0 | 0 | 0 | 121.2 | L461 | L461-A463 PolarHBondContact O-N 2.59Š| ||
| 464 | P | 45.7 | Very low | 35.3 | Very low | 128 Ų | 128 | 121.3 Ų | 121.3 | 83% | 0.831 | 80% | 0.801 | S | S | * | * | cis | -127.5 | 164.9 | -33.6 | 34.6 | -19.4 | 0 | 0 | 0 | 113.2 | ||||
| 465 | S | 30.5 | Very low | 35.5 | Very low | 108 Ų | 108 | 121.8 Ų | 121.8 | 76% | 0.755 | 80% | 0.798 | S | S | * | * | trans | -109.9 | 146 | 176.7 | 53.6 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 466 | L | 33.5 | Very low | 35.5 | Very low | 164 Ų | 164 | 122 Ų | 122 | 86% | 0.859 | 80% | 0.799 | S | S | * | * | trans | -158.8 | 102.1 | 153.8 | -82.8 | -166.4 | 0 | 0 | 0 | 112.9 | ||||
| 467 | T | 34.4 | Very low | 34.5 | Very low | 119 Ų | 119 | 126 Ų | 126 | 73% | 0.73 | 81% | 0.806 | S | S | * | * | 14.7 | 166.8 | 126.6 | 64.4 | 0 | 0 | 0 | 0 | 122.1 | |||||
| 468 | P | 51.4 | Low | 35.5 | Very low | 120 Ų | 120 | 123.1 Ų | 123.1 | 78% | 0.779 | 80% | 0.798 | S | S | * | * | -144.2 | 170.8 | -50.8 | 42.1 | -25.4 | 0 | 0 | 0 | 114.2 | |||||
| 469 | V | 33.2 | Very low | 35.7 | Very low | 149 Ų | 149 | 127 Ų | 127 | 90% | 0.903 | 80% | 0.803 | S | S | * | * | trans | -160.2 | 158.2 | 152.7 | 81.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 470 | S | 36.3 | Very low | 35.8 | Very low | 124 Ų | 124 | 125.6 Ų | 125.6 | 87% | 0.867 | 79% | 0.791 | S | S | * | * | trans | -92.8 | 155.2 | -171.1 | -49.5 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 471 | G | 30.7 | Very low | 36.1 | Very low | 83 Ų | 83 | 127.3 Ų | 127.3 | 86% | 0.856 | 79% | 0.794 | S | S | * | * | trans | -165.8 | 131 | 167.6 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 472 | S | 31.5 | Very low | 36.3 | Very low | 125 Ų | 125 | 125.5 Ų | 125.5 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | trans | -95.9 | 149.1 | -160.5 | 53.8 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 473 | G | 31.1 | Very low | 36.7 | Very low | 77 Ų | 77 | 128.9 Ų | 128.9 | 79% | 0.794 | 80% | 0.798 | S | S | * | * | trans | 101.9 | 150.2 | 155.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 474 | D | 33.2 | Very low | 36.7 | Very low | 134 Ų | 134 | 127.3 Ų | 127.3 | 72% | 0.717 | 79% | 0.791 | S | S | * | * | cis | -162.5 | 147.3 | -11.1 | -169 | 12.2 | 0 | 0 | 0 | 110.6 | ||||
| 475 | Q | 34.8 | Very low | 36.3 | Very low | 167 Ų | 167 | 129.1 Ų | 129.1 | 78% | 0.78 | 79% | 0.793 | S | S | * | * | trans | 51 | 162.4 | 170.1 | -73.8 | 160 | 77.8 | 0 | 0 | 120.3 | ||||
| 476 | S | 30.6 | Very low | 36.4 | Very low | 109 Ų | 109 | 134.4 Ų | 134.4 | 76% | 0.762 | 80% | 0.798 | S | S | * | * | cis | -157.3 | 142.2 | -49.6 | -171.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 477 | F | 38.2 | Very low | 36.5 | Very low | 195 Ų | 195 | 130.7 Ų | 130.7 | 86% | 0.855 | 79% | 0.79 | S | S | * | * | trans | -80.9 | -178.9 | 163.7 | -81 | -79.1 | 0 | 0 | 0 | 109.9 | ||||
| 478 | P | 55 | Low | 36.5 | Very low | 113 Ų | 113 | 129.2 Ų | 129.2 | 73% | 0.734 | 79% | 0.791 | S | S | * | * | cis | -145.1 | -156.6 | 27.7 | 45.5 | -21.4 | 0 | 0 | 0 | 114.3 | ||||
| 479 | D | 32.2 | Very low | 35.7 | Very low | 144 Ų | 144 | 134.2 Ų | 134.2 | 77% | 0.77 | 80% | 0.795 | S | S | * | * | cis | -150.8 | 174.5 | 0.9 | -153.3 | 7.3 | 0 | 0 | 0 | 114.6 | ||||
| 480 | V | 37.1 | Very low | 35.9 | Very low | 104 Ų | 104 | 132.3 Ų | 132.3 | 63% | 0.63 | 79% | 0.789 | S | S | * | * | trans | -72.2 | 148.4 | 174.5 | 167.7 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 481 | Q | 35.6 | Very low | 35.9 | Very low | 185 Ų | 185 | 132.6 Ų | 132.6 | 86% | 0.864 | 79% | 0.786 | S | S | * | * | -162.3 | 153.2 | 129 | -113.5 | 164.3 | 102.1 | 0 | 0 | 115.6 | |||||
| 482 | V | 40.7 | Very low | 36.9 | Very low | 130 Ų | 130 | 134.8 Ų | 134.8 | 79% | 0.788 | 79% | 0.785 | S | S | * | * | trans | -129.8 | 122.5 | -177.9 | 171.1 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 483 | T | 38.8 | Very low | 36.9 | Very low | 134 Ų | 134 | 135.3 Ų | 135.3 | 82% | 0.822 | 78% | 0.778 | S | S | * | * | trans | -150 | 140.4 | 156.1 | -46.2 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 484 | G | 35.7 | Very low | 37.1 | Very low | 62 Ų | 62 | 136.9 Ų | 136.9 | 64% | 0.639 | 78% | 0.777 | S | S | * | * | trans | -110.7 | -179.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 485 | L | 38.5 | Very low | 37.4 | Very low | 166 Ų | 166 | 138.7 Ų | 138.7 | 87% | 0.869 | 78% | 0.783 | S | S | * | * | trans | 173.4 | 133.1 | 148.2 | -95.2 | 167.5 | 0 | 0 | 0 | 111.1 | ||||
| 486 | Y | 32.1 | Very low | 37.6 | Very low | 218 Ų | 218 | 135 Ų | 135 | 86% | 0.855 | 78% | 0.781 | S | S | * | * | trans | 32.9 | 149.6 | 143.9 | -90.2 | -100.2 | 0 | 0 | 0 | 125.4 | ||||
| 487 | A | 36.3 | Very low | 38.7 | Very low | 86 Ų | 86 | 135.5 Ų | 135.5 | 71% | 0.711 | 78% | 0.782 | S | S | * | * | trans | 73.8 | 86.7 | 143.7 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 488 | A | 34 | Very low | 38.5 | Very low | 89 Ų | 89 | 130.3 Ų | 130.3 | 74% | 0.736 | 78% | 0.775 | S | S | * | * | 34.7 | 142.5 | 113.8 | 0 | 0 | 0 | 0 | 0 | 123.6 | |||||
| 489 | Y | 34.6 | Very low | 37.6 | Very low | 224 Ų | 224 | 131.9 Ų | 131.9 | 88% | 0.878 | 78% | 0.782 | S | S | * | * | trans | 90.8 | 132.9 | 151.4 | -83.8 | -69.2 | 0 | 0 | 0 | 122.9 | ||||
| 490 | S | 37.6 | Very low | 37.7 | Very low | 110 Ų | 110 | 128.9 Ų | 128.9 | 77% | 0.769 | 78% | 0.777 | S | S | * | * | trans | 88.2 | 132.6 | 147.6 | -63.1 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 491 | T | 36.3 | Very low | 37.6 | Very low | 130 Ų | 130 | 130.4 Ų | 130.4 | 80% | 0.798 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -81.1 | 153.9 | 171.6 | 47.2 | 0 | 0 | 0 | 0 | 111.9 | ||
| 492 | P | 50.7 | Low | 37.5 | Very low | 129 Ų | 129 | 127.2 Ų | 127.2 | 84% | 0.838 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 157.7 | -176.6 | 30.5 | -36 | 0 | 0 | 0 | 114.8 | ||
| 493 | D | 31.3 | Very low | 37.2 | Very low | 135 Ų | 135 | 126.1 Ų | 126.1 | 72% | 0.722 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 165.5 | 178.5 | 173.7 | 58.2 | 0 | 0 | 0 | 114.4 | M495 | D493-M495 PolarHBondContact OD1-N 3.3Å; D493-M495 PolarHBondContact OD2-N 3.2Å |
| 494 | S | 37.1 | Very low | 37.1 | Very low | 111 Ų | 111 | 128 Ų | 128 | 78% | 0.776 | 79% | 0.789 | S | S | * | * | trans | -150.6 | 90.3 | 149.4 | -78.1 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 495 | M | 38 | Very low | 36.9 | Very low | 172 Ų | 172 | 134.7 Ų | 134.7 | 85% | 0.847 | 80% | 0.796 | S | S | * | * | trans | 69.1 | 109.9 | 143.7 | -68.5 | -176.8 | 168.5 | 0 | 0 | 119.9 | D493 | D493-M495 PolarHBondContact OD1-N 3.3Å; D493-M495 PolarHBondContact OD2-N 3.2Å | ||
| 496 | A | 38.7 | Very low | 36.9 | Very low | 89 Ų | 89 | 134 Ų | 134 | 74% | 0.736 | 79% | 0.793 | S | S | * | * | trans | -62.8 | -177.1 | 150.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 497 | P | 55 | Low | 36.8 | Very low | 120 Ų | 120 | 127.4 Ų | 127.4 | 78% | 0.779 | 79% | 0.791 | S | S | * | * | cis | -144.3 | 174.9 | 13.8 | 41.5 | -21.1 | 0 | 0 | 0 | 117.9 | ||||
| 498 | A | 34.6 | Very low | 37 | Very low | 86 Ų | 86 | 130 Ų | 130 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | 157.1 | 152.4 | 103.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 499 | V | 35 | Very low | 37.9 | Very low | 145 Ų | 145 | 131.8 Ų | 131.8 | 88% | 0.879 | 80% | 0.802 | S | S | * | * | trans | 76.2 | 144.1 | 161.1 | -157.3 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 500 | A | 34.9 | Very low | 37.8 | Very low | 82 Ų | 82 | 124.7 Ų | 124.7 | 68% | 0.678 | 80% | 0.798 | S | S | * | * | trans | -88.8 | -172.9 | -179 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 501 | T | 33.6 | Very low | 37.8 | Very low | 136 Ų | 136 | 127.3 Ų | 127.3 | 83% | 0.834 | 80% | 0.803 | S | S | * | * | cis | -162.8 | 162.8 | 35.6 | -33.8 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 502 | S | 33.8 | Very low | 38.1 | Very low | 118 Ų | 118 | 130.4 Ų | 130.4 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | trans | -82.3 | 148.3 | -178.1 | -37 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 503 | A | 34.9 | Very low | 38 | Very low | 106 Ų | 106 | 129.9 Ų | 129.9 | 88% | 0.876 | 80% | 0.802 | S | S | * | * | trans | -169.3 | 166.2 | 144.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 504 | Q | 36.6 | Very low | 38.5 | Very low | 174 Ų | 174 | 131 Ų | 131 | 81% | 0.813 | 81% | 0.806 | S | S | * | * | trans | -124.1 | 151.4 | -176.7 | -55.3 | 163.5 | 3.2 | 0 | 0 | 110.5 | ||||
| 505 | Y | 31.3 | Very low | 38.3 | Very low | 203 Ų | 203 | 130.2 Ų | 130.2 | 80% | 0.796 | 81% | 0.806 | S | S | * | * | -173.6 | 155.4 | 125.3 | -121.3 | -121.1 | 0 | 0 | 0 | 115.5 | |||||
| 506 | L | 37.8 | Very low | 38.2 | Very low | 151 Ų | 151 | 129.6 Ų | 129.6 | 79% | 0.791 | 81% | 0.806 | S | S | * | * | trans | -4.5 | 144.1 | 168.6 | -90.6 | 53.3 | 0 | 0 | 0 | 122.8 | ||||
| 507 | G | 30.3 | Very low | 37.9 | Very low | 79 Ų | 79 | 136.8 Ų | 136.8 | 81% | 0.814 | 83% | 0.83 | S | S | * | * | trans | 164 | 115.8 | 151.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 508 | T | 41.3 | Very low | 37.1 | Very low | 140 Ų | 140 | 137.6 Ų | 137.6 | 86% | 0.859 | 83% | 0.833 | S | S | * | * | trans | -131.8 | 170.7 | 171.4 | 52.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 509 | P | 52.1 | Low | 37.2 | Very low | 127 Ų | 127 | 140.3 Ų | 140.3 | 83% | 0.825 | 84% | 0.839 | S | S | * | * | cis | -125.2 | 163.8 | -45.7 | 36.1 | -23.1 | 0 | 0 | 0 | 112.3 | ||||
| 510 | G | 32.3 | Very low | 37.3 | Very low | 76 Ų | 76 | 140.1 Ų | 140.1 | 78% | 0.784 | 84% | 0.837 | S | S | * | * | trans | 178.4 | 141.6 | 170.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 511 | N | 39.1 | Very low | 37.5 | Very low | 165 Ų | 165 | 143.5 Ų | 143.5 | 88% | 0.882 | 85% | 0.847 | S | S | * | * | trans | -66.3 | 140.6 | -178.8 | -69.9 | -16.6 | 0 | 0 | 0 | 113.6 | ||||
| 512 | K | 42 | Very low | 37.7 | Very low | 195 Ų | 195 | 143.9 Ų | 143.9 | 85% | 0.848 | 85% | 0.847 | S | S | * | * | trans | -174 | 150.1 | 147.7 | -101 | 150.3 | -170.5 | -177.8 | 0 | 110.8 | ||||
| 513 | P | 47.9 | Very low | 38 | Very low | 118 Ų | 118 | 145.7 Ų | 145.7 | 77% | 0.766 | 85% | 0.849 | S | S | * | * | -117 | 170 | 129.4 | 35.8 | -33.4 | 0 | 0 | 0 | 111.5 | |||||
| 514 | I | 41.5 | Very low | 38.2 | Very low | 157 Ų | 157 | 148.5 Ų | 148.5 | 81% | 0.805 | 85% | 0.847 | S | S | * | * | trans | 73.6 | 124.6 | -178.4 | -50.2 | 172.4 | 0 | 0 | 0 | 114.6 | ||||
| 515 | A | 33.6 | Very low | 38.3 | Very low | 95 Ų | 95 | 146.5 Ų | 146.5 | 79% | 0.785 | 85% | 0.85 | S | S | * | * | trans | -142.2 | 137.6 | 153.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 516 | L | 35 | Very low | 38.9 | Very low | 159 Ų | 159 | 141.8 Ų | 141.8 | 83% | 0.832 | 85% | 0.854 | S | S | * | * | trans | -138.5 | 126.1 | 166 | -110 | 175.4 | 0 | 0 | 0 | 105.5 | ||||
| 517 | L | 33.9 | Very low | 39 | Very low | 240 Ų | 240 | 141 Ų | 141 | 100% | 1.257 | 86% | 0.86 | S | S | * | * | trans | 65.1 | 0 | -163.1 | -78.6 | 68.8 | 0 | 0 | 0 | 113.8 |
Retrieved 517 of 517 residues in 166.9 ms
(Link to these results)