| 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 | 43.1 | Very low | 52.2 | Low | 240 Ų | 240 | 146.4 Ų | 146.4 | 100% | 1.182 | 80% | 0.804 | S | S | * | * | 0 | 131.4 | 0 | -65.9 | 165.5 | 73.3 | 0 | 0 | 107.3 | |||||
| 2 | S | 45.8 | Very low | 52.4 | Low | 111 Ų | 111 | 141.2 Ų | 141.2 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | -112.1 | 124.2 | -175.8 | -51.2 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 3 | P | 55.4 | Low | 52.9 | Low | 134 Ų | 134 | 139.3 Ų | 139.3 | 87% | 0.87 | 77% | 0.773 | S | S | * | * | trans | -62.8 | 136.3 | 171.7 | -20.6 | 33.3 | 0 | 0 | 0 | 110.8 | ||||
| 4 | K | 51.8 | Low | 53.5 | Low | 203 Ų | 203 | 139.3 Ų | 139.3 | 88% | 0.883 | 77% | 0.769 | S | S | * | * | trans | -91.7 | 161.3 | 175 | -66.4 | -178.2 | -179.7 | 179.5 | 0 | 110.5 | ||||
| 5 | H | 51 | Low | 53.1 | Low | 184 Ų | 184 | 139.3 Ų | 139.3 | 85% | 0.852 | 77% | 0.766 | S | S | * | * | trans | -39.2 | 139.9 | 178.9 | -82.3 | -98.7 | 0 | 0 | 0 | 114.9 | ||||
| 6 | T | 54.8 | Low | 53 | Low | 134 Ų | 134 | 136.8 Ų | 136.8 | 82% | 0.822 | 76% | 0.762 | S | S | * | * | trans | -121.3 | 136.1 | 141.6 | -173.3 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 7 | T | 60.8 | Low | 52.8 | Low | 113 Ų | 113 | 135.1 Ų | 135.1 | 69% | 0.693 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -94.5 | 131.6 | -176.7 | 45.1 | 0 | 0 | 0 | 0 | 110.4 | ||
| 8 | P | 61.6 | Low | 52.4 | Low | 119 Ų | 119 | 136.9 Ų | 136.9 | 77% | 0.773 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 151.1 | 174.7 | 29.8 | -34.5 | 0 | 0 | 0 | 111.3 | ||
| 9 | F | 42.7 | Very low | 52.2 | Low | 197 Ų | 197 | 137 Ų | 137 | 86% | 0.864 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 143.6 | -179.2 | -63.7 | -93.5 | 0 | 0 | 0 | 113.4 | ||
| 10 | S | 59.2 | Low | 51.8 | Low | 70 Ų | 70 | 139.6 Ų | 139.6 | 49% | 0.49 | 77% | 0.765 | S | S | . | * | P | Polyproline II helix | trans | -85.6 | 149 | 177.9 | -168.2 | 0 | 0 | 0 | 0 | 110.9 | S12 D13 | S10-S12 PolarHBondContact O-N 3.02Å; S10-S12 VanDerWaalsContact O-N 3.14Å; S10-D13 PolarHBondContact N-OD2 3.35Å; S10-D13 PolarHBondContact O-N 3.12Å |
| 11 | V | 48.2 | Very low | 51.3 | Low | 105 Ų | 105 | 138 Ų | 138 | 64% | 0.636 | 76% | 0.764 | S | S | * | * | G | 310 helix | trans | -64 | -21.4 | -179.7 | 177.5 | 0 | 0 | 0 | 0 | 112 | D13 I14 | V11-D13 PolarHBondContact O-N 3.49Å; V11-I14 PolarHBondContact O-N 3.27Å |
| 12 | S | 55.1 | Low | 51.1 | Low | 84 Ų | 84 | 135.3 Ų | 135.3 | 59% | 0.587 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -56 | -35.1 | 174.4 | -50.4 | 0 | 0 | 0 | 0 | 113.6 | S10 I14 L15 | S10-S12 PolarHBondContact O-N 3.02Å; S10-S12 VanDerWaalsContact O-N 3.14Å; S12-I14 PolarHBondContact O-N 3.4Å; S12-I14 VanDerWaalsContact O-N 3.16Å; S12-L15 PolarHBondContact O-N 3.03Å |
| 13 | D | 57.8 | Low | 50.9 | Low | 117 Ų | 117 | 139.3 Ų | 139.3 | 63% | 0.626 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -67.5 | -14.7 | -177.2 | -63.3 | -62.8 | 0 | 0 | 0 | 113.3 | S10 V11 | S10-D13 PolarHBondContact N-OD2 3.35Å; S10-D13 PolarHBondContact O-N 3.12Å; V11-D13 PolarHBondContact O-N 3.49Å |
| 14 | I | 62.5 | Low | 50.2 | Low | 139 Ų | 139 | 142.6 Ų | 142.6 | 71% | 0.713 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -96.2 | -15.8 | -173.6 | -59.2 | 175.1 | 0 | 0 | 0 | 112.2 | V11 S12 | V11-I14 PolarHBondContact O-N 3.27Å; S12-I14 PolarHBondContact O-N 3.4Å; S12-I14 VanDerWaalsContact O-N 3.16Å |
| 15 | L | 46.7 | Very low | 49.4 | Very low | 139 Ų | 139 | 140.4 Ų | 140.4 | 73% | 0.728 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.7 | 1.6 | -168.5 | -76.3 | 169.9 | 0 | 0 | 0 | 115.6 | S12 P17 | S12-L15 PolarHBondContact O-N 3.03Å; L15-P17 WeakPolarHBondContact O-CD 3.5Å |
| 16 | S | 52.4 | Low | 48.7 | Very low | 99 Ų | 99 | 134.9 Ų | 134.9 | 69% | 0.692 | 74% | 0.743 | S | S | * | * | trans | -73.6 | 119.9 | 169.2 | -65 | 0 | 0 | 0 | 0 | 111 | ||||
| 17 | P | 49.4 | Very low | 48 | Very low | 109 Ų | 109 | 137.7 Ų | 137.7 | 71% | 0.708 | 75% | 0.749 | S | S | * | * | trans | -68 | 153.7 | 178.9 | -21.4 | 35.1 | 0 | 0 | 0 | 113.9 | L15 E19 | L15-P17 WeakPolarHBondContact O-CD 3.5Å; P17-E19 PolarHBondContact O-N 2.94Å | ||
| 18 | L | 44.2 | Very low | 46.8 | Very low | 167 Ų | 167 | 142 Ų | 142 | 87% | 0.874 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | 78.5 | 179.1 | -94.7 | 161.5 | 0 | 0 | 0 | 112.5 | ||
| 19 | E | 49.2 | Very low | 45.4 | Very low | 139 Ų | 139 | 140.1 Ų | 140.1 | 65% | 0.65 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.1 | -18.5 | 169.8 | -65 | -165 | 90.3 | 0 | 0 | 114.3 | P17 S21 Y22 | P17-E19 PolarHBondContact O-N 2.94Å; E19-S21 PolarHBondContact O-N 2.89Å; E19-Y22 WeakPolarHBondContact O-CD1 3.36Å; E19-Y22 WeakPolarHBondContact O-CE1 3.39Å |
| 20 | E | 44.1 | Very low | 45 | Very low | 188 Ų | 188 | 134.8 Ų | 134.8 | 88% | 0.879 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.1 | 41.4 | -171.5 | -157.4 | 95.3 | 134 | 0 | 0 | 114.6 | ||
| 21 | S | 41.5 | Very low | 43.8 | Very low | 108 Ų | 108 | 134.8 Ų | 134.8 | 76% | 0.755 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -142.6 | 12.4 | -175.9 | -77.5 | 0 | 0 | 0 | 0 | 117.2 | E19 | E19-S21 PolarHBondContact O-N 2.89Š|
| 22 | Y | 38.3 | Very low | 43.4 | Very low | 182 Ų | 182 | 138.8 Ų | 138.8 | 71% | 0.714 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -115.5 | 28.5 | 178 | 64.6 | -87.9 | 0 | 0 | 0 | 114.4 | E19 | E19-Y22 WeakPolarHBondContact O-CD1 3.36Å; E19-Y22 WeakPolarHBondContact O-CE1 3.39Å |
| 23 | K | 41.7 | Very low | 42.2 | Very low | 196 Ų | 196 | 138.8 Ų | 138.8 | 85% | 0.852 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -144.7 | 35.9 | -174.9 | -127.1 | 173 | -172.7 | 178.4 | 0 | 117.8 | ||
| 24 | K | 40.7 | Very low | 41.4 | Very low | 202 Ų | 202 | 138 Ų | 138 | 88% | 0.878 | 82% | 0.815 | S | S | * | * | trans | -144.7 | 59.9 | 167.2 | -156 | 169.6 | -174.9 | -68.5 | 0 | 115.3 | ||||
| 25 | V | 35.7 | Very low | 41.2 | Very low | 157 Ų | 157 | 137.2 Ų | 137.2 | 95% | 0.952 | 82% | 0.819 | S | S | * | * | trans | -136.7 | 106.1 | 156.8 | -133.8 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 26 | G | 36.5 | Very low | 40.7 | Very low | 69 Ų | 69 | 138.8 Ų | 138.8 | 71% | 0.711 | 83% | 0.827 | S | S | * | * | S | Bend | trans | 153.3 | 128.1 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 27 | M | 38.7 | Very low | 39.8 | Very low | 193 Ų | 193 | 138.7 Ų | 138.7 | 95% | 0.951 | 83% | 0.832 | S | S | * | * | trans | 59.8 | 96.5 | 171.8 | -56.3 | -173.3 | 74.5 | 0 | 0 | 116.6 | ||||
| 28 | E | 37.3 | Very low | 39.1 | Very low | 203 Ų | 203 | 138.6 Ų | 138.6 | 95% | 0.949 | 84% | 0.841 | S | S | * | * | trans | -77.8 | 145.7 | 150.6 | -56.7 | -163.5 | 112.5 | 0 | 0 | 109.5 | ||||
| 29 | G | 32.6 | Very low | 38.5 | Very low | 80 Ų | 80 | 139.8 Ų | 139.8 | 83% | 0.825 | 84% | 0.835 | S | S | * | * | trans | 170.4 | 92.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 30 | G | 33.5 | Very low | 37.6 | Very low | 84 Ų | 84 | 144.5 Ų | 144.5 | 87% | 0.866 | 85% | 0.847 | S | S | * | * | trans | 81.2 | 101.9 | 145.1 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 31 | G | 33.7 | Very low | 37.2 | Very low | 71 Ų | 71 | 143.1 Ų | 143.1 | 73% | 0.732 | 84% | 0.84 | S | S | * | * | 95.5 | 128.9 | 110.9 | 0 | 0 | 0 | 0 | 0 | 121 | |||||
| 32 | L | 39.1 | Very low | 36.7 | Very low | 188 Ų | 188 | 141.6 Ų | 141.6 | 98% | 0.984 | 84% | 0.842 | S | S | * | * | trans | 74.1 | 130.1 | 149.3 | -47.1 | -179.3 | 0 | 0 | 0 | 119.2 | ||||
| 33 | G | 31.1 | Very low | 36.6 | Very low | 84 Ų | 84 | 142.5 Ų | 142.5 | 87% | 0.866 | 85% | 0.853 | S | S | * | * | trans | 149.1 | 106 | 169.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 34 | A | 40.9 | Very low | 36.1 | Very low | 102 Ų | 102 | 138.3 Ų | 138.3 | 84% | 0.843 | 86% | 0.855 | S | S | * | * | trans | -105.5 | 158.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 35 | P | 58.9 | Low | 35.9 | Very low | 122 Ų | 122 | 133.1 Ų | 133.1 | 79% | 0.792 | 85% | 0.85 | S | S | * | * | trans | -100.8 | 150.8 | -167.7 | 37.8 | -34.9 | 0 | 0 | 0 | 115.5 | ||||
| 36 | L | 34.5 | Very low | 37.4 | Very low | 172 Ų | 172 | 131.3 Ų | 131.3 | 90% | 0.901 | 84% | 0.841 | S | S | * | * | trans | -141.4 | 128.2 | 160.9 | -67.4 | 175.3 | 0 | 0 | 0 | 107 | ||||
| 37 | A | 33.6 | Very low | 38.3 | Very low | 97 Ų | 97 | 133.6 Ų | 133.6 | 80% | 0.802 | 84% | 0.843 | S | S | * | * | cis | 91.5 | 106.9 | 48.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 38 | A | 35.4 | Very low | 38.3 | Very low | 107 Ų | 107 | 129.1 Ų | 129.1 | 88% | 0.884 | 84% | 0.837 | S | S | * | * | trans | -154.3 | 152.7 | 167 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 39 | Y | 31 | Very low | 38.2 | Very low | 192 Ų | 192 | 124.3 Ų | 124.3 | 75% | 0.753 | 83% | 0.832 | S | S | * | * | trans | -155.3 | 133.8 | -157.2 | -176.6 | -81.8 | 0 | 0 | 0 | 114 | Q41 | Y39-Q41 HydrophobicContact CE1-CB 4.07Š| ||
| 40 | R | 31.7 | Very low | 38.4 | Very low | 237 Ų | 237 | 124.7 Ų | 124.7 | 89% | 0.894 | 83% | 0.827 | S | S | * | * | trans | 175 | 133.9 | 159.1 | -101.8 | 169.6 | -174.2 | -131.7 | 1.5 | 107.6 | ||||
| 41 | Q | 34 | Very low | 38.8 | Very low | 159 Ų | 159 | 128.6 Ų | 128.6 | 74% | 0.743 | 83% | 0.825 | S | S | * | * | cis | 78.4 | 121.6 | 17.5 | -153.4 | -170.7 | 24.9 | 0 | 0 | 116.3 | Y39 | Y39-Q41 HydrophobicContact CE1-CB 4.07Š| ||
| 42 | G | 32.4 | Very low | 39.3 | Very low | 77 Ų | 77 | 131.4 Ų | 131.4 | 79% | 0.794 | 82% | 0.819 | S | S | * | * | trans | 158.7 | 109.8 | 169.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 43 | Q | 35.3 | Very low | 39.2 | Very low | 200 Ų | 200 | 129 Ų | 129 | 94% | 0.935 | 80% | 0.803 | S | S | * | * | trans | -107.2 | 148.6 | 170.7 | -63.1 | 163.6 | -87.7 | 0 | 0 | 110.1 | ||||
| 44 | A | 32 | Very low | 39.6 | Very low | 108 Ų | 108 | 132.8 Ų | 132.8 | 89% | 0.893 | 80% | 0.798 | S | S | * | * | trans | -173.3 | 152.6 | 150.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 45 | A | 36.2 | Very low | 39.3 | Very low | 94 Ų | 94 | 131.6 Ų | 131.6 | 78% | 0.777 | 79% | 0.788 | S | S | * | * | trans | -172.5 | 171.8 | 165.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 46 | P | 66.7 | Low | 38.3 | Very low | 118 Ų | 118 | 132.8 Ų | 132.8 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | cis | -107.6 | -158.6 | -37.7 | 37.1 | -20.2 | 0 | 0 | 0 | 109.8 | ||||
| 47 | P | 56.2 | Low | 38.3 | Very low | 117 Ų | 117 | 127.7 Ų | 127.7 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | -156.8 | 148.8 | 81.1 | 39.9 | -18.8 | 0 | 0 | 0 | 119.6 | |||||
| 48 | A | 37.3 | Very low | 38.5 | Very low | 99 Ų | 99 | 131.4 Ų | 131.4 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | trans | 50.7 | 162.2 | 135.1 | 0 | 0 | 0 | 0 | 0 | 126 | ||||
| 49 | A | 37 | Very low | 38.5 | Very low | 103 Ų | 103 | 134 Ų | 134 | 85% | 0.851 | 78% | 0.775 | S | S | * | * | trans | 86.4 | 137 | 166.7 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 50 | A | 36.9 | Very low | 38.6 | Very low | 87 Ų | 87 | 128.6 Ų | 128.6 | 72% | 0.719 | 78% | 0.779 | S | S | * | * | cis | -165.3 | 162.6 | -15.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 51 | M | 41.5 | Very low | 38.8 | Very low | 166 Ų | 166 | 122.3 Ų | 122.3 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | 66.7 | 149.5 | 164.4 | -62.6 | 174.9 | 76.5 | 0 | 0 | 116.4 | ||||
| 52 | Q | 42.9 | Very low | 38.9 | Very low | 130 Ų | 130 | 122 Ų | 122 | 61% | 0.607 | 79% | 0.786 | S | S | * | * | cis | -152.8 | 169 | 10.5 | -102.9 | -36.4 | -108.1 | 0 | 0 | 108.2 | ||||
| 53 | Q | 37.3 | Very low | 39 | Very low | 137 Ų | 137 | 125 Ų | 125 | 64% | 0.64 | 79% | 0.789 | S | S | * | * | cis | -152.5 | -91 | -11.9 | -168 | -171 | 88.4 | 0 | 0 | 113.6 | ||||
| 54 | H | 38.9 | Very low | 38.7 | Very low | 164 Ų | 164 | 120.1 Ų | 120.1 | 76% | 0.759 | 78% | 0.783 | S | S | * | * | trans | -153.3 | 169 | -155.9 | -75.1 | -11.6 | 0 | 0 | 0 | 113 | ||||
| 55 | A | 35.3 | Very low | 38.8 | Very low | 78 Ų | 78 | 118.2 Ų | 118.2 | 65% | 0.645 | 77% | 0.767 | S | S | * | * | cis | -170.9 | 178.9 | -23.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 56 | V | 37.6 | Very low | 38.7 | Very low | 147 Ų | 147 | 123.4 Ų | 123.4 | 89% | 0.891 | 77% | 0.768 | S | S | * | * | trans | 68.1 | 135.4 | 175.7 | -45.9 | 0 | 0 | 0 | 0 | 118 | ||||
| 57 | G | 34.8 | Very low | 37.4 | Very low | 65 Ų | 65 | 126.4 Ų | 126.4 | 67% | 0.67 | 77% | 0.771 | S | S | * | * | cis | 111.8 | 114.9 | -17.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 58 | H | 38.1 | Very low | 37 | Very low | 175 Ų | 175 | 129.1 Ų | 129.1 | 81% | 0.81 | 78% | 0.776 | S | S | * | * | trans | -168.3 | -177.5 | 148.4 | -107.1 | 57.7 | 0 | 0 | 0 | 110.6 | ||||
| 59 | H | 36.4 | Very low | 36.8 | Very low | 160 Ų | 160 | 131.5 Ų | 131.5 | 74% | 0.741 | 78% | 0.781 | S | S | * | * | trans | -127.7 | 166.7 | -149.3 | 45.9 | -113.3 | 0 | 0 | 0 | 115.2 | ||||
| 60 | G | 32.2 | Very low | 37 | Very low | 80 Ų | 80 | 130.9 Ų | 130.9 | 83% | 0.825 | 78% | 0.776 | S | S | * | * | trans | 172.4 | 108.3 | 167.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 61 | A | 36.1 | Very low | 37.1 | Very low | 104 Ų | 104 | 132 Ų | 132 | 86% | 0.86 | 79% | 0.785 | S | S | * | * | trans | -143.2 | 135.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 62 | V | 34.9 | Very low | 36.7 | Very low | 153 Ų | 153 | 127.9 Ų | 127.9 | 93% | 0.927 | 79% | 0.785 | S | S | * | * | trans | -140.8 | 143.3 | 167.4 | -76.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 63 | T | 34.3 | Very low | 36.6 | Very low | 139 Ų | 139 | 128 Ų | 128 | 85% | 0.853 | 79% | 0.794 | S | S | * | * | trans | -108.7 | 143 | -173.7 | 48.7 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 64 | A | 29.6 | Very low | 36.9 | Very low | 99 Ų | 99 | 127.5 Ų | 127.5 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | trans | -145.8 | 135.3 | 154 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 65 | A | 34.8 | Very low | 36.8 | Very low | 67 Ų | 67 | 126.1 Ų | 126.1 | 55% | 0.554 | 80% | 0.796 | S | S | * | * | trans | -131.6 | -155.5 | 171.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 66 | Y | 33.3 | Very low | 36.7 | Very low | 203 Ų | 203 | 130.7 Ų | 130.7 | 80% | 0.796 | 81% | 0.809 | S | S | * | * | trans | 67.9 | 140.8 | 174.9 | -16 | -68.7 | 0 | 0 | 0 | 113.1 | ||||
| 67 | H | 39.3 | Very low | 36.7 | Very low | 181 Ų | 181 | 126.7 Ų | 126.7 | 84% | 0.838 | 79% | 0.788 | S | S | * | * | cis | -161.5 | 170.1 | -2.4 | 43.7 | -86.2 | 0 | 0 | 0 | 110.4 | ||||
| 68 | M | 47.8 | Very low | 36.8 | Very low | 175 Ų | 175 | 131.7 Ų | 131.7 | 86% | 0.862 | 79% | 0.793 | S | S | * | * | trans | -87 | 154.1 | 174.2 | -69.3 | -92.9 | -161.4 | 0 | 0 | 112 | ||||
| 69 | T | 34.7 | Very low | 36.4 | Very low | 149 Ų | 149 | 128.6 Ų | 128.6 | 91% | 0.914 | 79% | 0.791 | S | S | * | * | trans | -175.7 | 161.8 | 138.9 | -81.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 70 | A | 39.2 | Very low | 36.5 | Very low | 90 Ų | 90 | 126.2 Ų | 126.2 | 74% | 0.744 | 80% | 0.799 | S | S | * | * | trans | -125.7 | -177.6 | -170.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 71 | A | 39.8 | Very low | 36.9 | Very low | 111 Ų | 111 | 129.1 Ų | 129.1 | 92% | 0.917 | 80% | 0.801 | S | S | * | * | trans | 77 | 138.6 | 171.5 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 72 | G | 34 | Very low | 36.8 | Very low | 78 Ų | 78 | 126.6 Ų | 126.6 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | trans | 159.2 | 99.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 73 | V | 40 | Very low | 36.8 | Very low | 132 Ų | 132 | 123 Ų | 123 | 80% | 0.8 | 78% | 0.779 | S | S | * | * | trans | -88.7 | 159.8 | 170.3 | -146.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 74 | P | 44.5 | Very low | 37.3 | Very low | 127 Ų | 127 | 126.4 Ų | 126.4 | 83% | 0.825 | 78% | 0.777 | S | S | * | * | -127.9 | 140.9 | 117.5 | 35.6 | -31 | 0 | 0 | 0 | 113.1 | |||||
| 75 | Q | 36.8 | Very low | 37.8 | Very low | 135 Ų | 135 | 127.7 Ų | 127.7 | 63% | 0.631 | 78% | 0.779 | S | S | * | * | trans | -93.1 | 138.4 | 175.6 | -165.3 | -85.2 | 11.8 | 0 | 0 | 108.8 | S77 | Q75-S77 PolarHBondContact NE2-OG 3.02Š| ||
| 76 | L | 32.7 | Very low | 38.1 | Very low | 175 Ų | 175 | 132.6 Ų | 132.6 | 92% | 0.916 | 80% | 0.796 | S | S | * | * | trans | -153.5 | 118.9 | 152.8 | -104.2 | 169.4 | 0 | 0 | 0 | 108 | ||||
| 77 | S | 36.5 | Very low | 38.2 | Very low | 63 Ų | 63 | 126 Ų | 126 | 44% | 0.441 | 79% | 0.79 | S | S | . | * | trans | -104.8 | 158.8 | -171.2 | 46.5 | 0 | 0 | 0 | 0 | 113.3 | Q75 | Q75-S77 PolarHBondContact NE2-OG 3.02Š| ||
| 78 | H | 38.7 | Very low | 38 | Very low | 170 Ų | 170 | 124.5 Ų | 124.5 | 79% | 0.787 | 79% | 0.788 | S | S | * | * | -178.7 | 144.1 | 115.9 | -98 | -69.4 | 0 | 0 | 0 | 114.8 | |||||
| 79 | S | 29 | Very low | 37.5 | Very low | 109 Ų | 109 | 123.5 Ų | 123.5 | 76% | 0.762 | 79% | 0.785 | S | S | * | * | trans | 62 | 99.4 | 147.4 | -57.5 | 0 | 0 | 0 | 0 | 122 | ||||
| 80 | A | 38.6 | Very low | 37.5 | Very low | 110 Ų | 110 | 119.7 Ų | 119.7 | 91% | 0.909 | 78% | 0.776 | S | S | * | * | -147.5 | 130.4 | 127 | 0 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 81 | V | 39.3 | Very low | 37.4 | Very low | 141 Ų | 141 | 123.3 Ų | 123.3 | 86% | 0.855 | 78% | 0.783 | S | S | * | * | trans | -141.7 | 140 | -171.2 | 61 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 82 | G | 35.4 | Very low | 37.3 | Very low | 51 Ų | 51 | 124.4 Ų | 124.4 | 53% | 0.526 | 77% | 0.771 | S | S | . | * | trans | 49.5 | 105.4 | 150.6 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 83 | G | 34.4 | Very low | 37.9 | Very low | 78 Ų | 78 | 127.1 Ų | 127.1 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | trans | -108.8 | 127 | 158 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 84 | Y | 45.6 | Very low | 37.7 | Very low | 210 Ų | 210 | 128.1 Ų | 128.1 | 82% | 0.824 | 77% | 0.773 | S | S | * | * | trans | -141.6 | 103.6 | -178.2 | -48.9 | -89.6 | 0 | 0 | 0 | 113.3 | ||||
| 85 | C | 39.7 | Very low | 37.9 | Very low | 127 Ų | 127 | 129.8 Ų | 129.8 | 86% | 0.858 | 77% | 0.774 | S | S | * | * | trans | 174.8 | 131.5 | 153.8 | 44.3 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 86 | N | 40.3 | Very low | 38.5 | Very low | 170 Ų | 170 | 128.8 Ų | 128.8 | 91% | 0.909 | 78% | 0.779 | S | S | * | * | cis | 99.6 | 117.5 | 12 | -157.2 | 5.8 | 0 | 0 | 0 | 115.8 | ||||
| 87 | G | 36.8 | Very low | 39.1 | Very low | 64 Ų | 64 | 125.7 Ų | 125.7 | 66% | 0.66 | 77% | 0.77 | S | S | * | * | trans | 84 | 143.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 88 | N | 33.7 | Very low | 39 | Very low | 149 Ų | 149 | 133.1 Ų | 133.1 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | cis | -169.4 | 167.3 | -10.4 | -142.6 | -3.2 | 0 | 0 | 0 | 106.9 | ||||
| 89 | L | 37.4 | Very low | 39 | Very low | 154 Ų | 154 | 132.7 Ų | 132.7 | 81% | 0.806 | 79% | 0.788 | S | S | * | * | cis | -145 | 174.7 | 6.9 | -39.4 | 77.6 | 0 | 0 | 0 | 110.1 | ||||
| 90 | G | 34.3 | Very low | 39.7 | Very low | 70 Ų | 70 | 133 Ų | 133 | 72% | 0.722 | 78% | 0.781 | S | S | * | * | trans | 94.5 | 98.3 | 160.3 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 91 | N | 38 | Very low | 39.8 | Very low | 165 Ų | 165 | 133 Ų | 133 | 88% | 0.882 | 77% | 0.77 | S | S | * | * | 63.1 | 120.3 | 72.1 | -159.8 | 35.3 | 0 | 0 | 0 | 112.4 | |||||
| 92 | M | 38.1 | Very low | 40.2 | Very low | 135 Ų | 135 | 134.4 Ų | 134.4 | 67% | 0.665 | 77% | 0.769 | S | S | * | * | cis | -136.7 | 138.4 | 20 | 173 | -170 | 179.5 | 0 | 0 | 111.6 | E94 | M92-E94 HydrophobicContact CE-CB 3.73Š| ||
| 93 | S | 45.2 | Very low | 40.4 | Very low | 134 Ų | 134 | 142.6 Ų | 142.6 | 94% | 0.937 | 78% | 0.784 | S | S | * | * | trans | -129.1 | 94.1 | 171.7 | -68.4 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 94 | E | 36.6 | Very low | 40.5 | Very low | 153 Ų | 153 | 145.9 Ų | 145.9 | 72% | 0.715 | 78% | 0.783 | S | S | * | * | trans | -124.2 | 107.2 | 170.9 | -162.2 | 178 | 139.9 | 0 | 0 | 109.5 | M92 | M92-E94 HydrophobicContact CE-CB 3.73Š| ||
| 95 | L | 48.9 | Very low | 39.9 | Very low | 162 Ų | 162 | 141.5 Ų | 141.5 | 85% | 0.848 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 121 | 169.1 | -73.8 | 167.7 | 0 | 0 | 0 | 107.9 | ||
| 96 | P | 49.3 | Very low | 40.2 | Very low | 114 Ų | 114 | 140.3 Ų | 140.3 | 74% | 0.74 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 127.1 | 172.5 | -22.5 | 33.8 | 0 | 0 | 0 | 110 | ||
| 97 | P | 44.7 | Very low | 40.4 | Very low | 110 Ų | 110 | 138 Ų | 138 | 71% | 0.714 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 142.4 | 174.7 | 28.4 | -34 | 0 | 0 | 0 | 110 | Q99 | P97-Q99 PolarHBondContact O-N 2.89Š|
| 98 | Y | 35.5 | Very low | 40.6 | Very low | 220 Ų | 220 | 138 Ų | 138 | 86% | 0.863 | 78% | 0.781 | S | S | * | * | trans | -68.7 | 94.5 | 172.3 | -175.4 | -88.5 | 0 | 0 | 0 | 109.2 | ||||
| 99 | Q | 37.8 | Very low | 41.3 | Very low | 160 Ų | 160 | 136.9 Ų | 136.9 | 75% | 0.748 | 78% | 0.781 | S | S | * | * | trans | -77.1 | 128 | 167.9 | -82.4 | -157.2 | -17.8 | 0 | 0 | 110.3 | P97 | P97-Q99 PolarHBondContact O-N 2.89Š| ||
| 100 | D | 43.8 | Very low | 41.5 | Very low | 116 Ų | 116 | 132.7 Ų | 132.7 | 62% | 0.62 | 78% | 0.775 | S | S | * | * | trans | -65.4 | 138.2 | 163.2 | -166.3 | -64.6 | 0 | 0 | 0 | 109.5 | M102 | D100-M102 PolarHBondContact OD1-N 3.12Š| ||
| 101 | T | 41.2 | Very low | 42 | Very low | 111 Ų | 111 | 140.8 Ų | 140.8 | 68% | 0.681 | 78% | 0.784 | S | S | * | * | trans | -144.8 | 64.4 | 171.9 | -49.7 | 0 | 0 | 0 | 0 | 111.2 | R103 | T101-R103 PolarHBondContact O-N 3.1Š| ||
| 102 | M | 47.3 | Very low | 42.5 | Very low | 170 Ų | 170 | 141.9 Ų | 141.9 | 84% | 0.837 | 78% | 0.777 | S | S | * | * | trans | -65 | 62.5 | 165 | -85.6 | -80.5 | -161.6 | 0 | 0 | 113.6 | D100 | D100-M102 PolarHBondContact OD1-N 3.12Š| ||
| 103 | R | 39.8 | Very low | 42.5 | Very low | 222 Ų | 222 | 138.6 Ų | 138.6 | 84% | 0.838 | 78% | 0.778 | S | S | * | * | trans | -154.5 | 105.6 | 166.5 | -145.3 | 71.7 | 179.3 | -166 | -0.8 | 116.8 | T101 | T101-R103 PolarHBondContact O-N 3.1Š| ||
| 104 | N | 36.5 | Very low | 42.6 | Very low | 147 Ų | 147 | 137.1 Ų | 137.1 | 79% | 0.786 | 77% | 0.773 | S | S | * | * | trans | 51.1 | 103.5 | 140.6 | -174.8 | 43.4 | 0 | 0 | 0 | 120.2 | ||||
| 105 | S | 32.6 | Very low | 43 | Very low | 118 Ų | 118 | 137.1 Ų | 137.1 | 83% | 0.825 | 78% | 0.778 | S | S | * | * | -166 | 156.8 | 119.7 | 43.1 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 106 | A | 47.3 | Very low | 42.9 | Very low | 102 Ų | 102 | 135.2 Ų | 135.2 | 84% | 0.843 | 78% | 0.776 | S | S | * | * | trans | -98.7 | 122.5 | -167.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 107 | S | 44.5 | Very low | 42.7 | Very low | 122 Ų | 122 | 134 Ų | 134 | 85% | 0.853 | 76% | 0.763 | S | S | * | * | trans | -159.1 | 143.6 | 149.9 | 45.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 108 | G | 40.8 | Very low | 43.2 | Very low | 65 Ų | 65 | 135 Ų | 135 | 67% | 0.67 | 77% | 0.769 | S | S | * | * | trans | -83.6 | 173.2 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114 | G110 | G108-G110 PolarHBondContact O-N 3.46Š| ||
| 109 | P | 48.5 | Very low | 43.9 | Very low | 124 Ų | 124 | 134.4 Ų | 134.4 | 81% | 0.805 | 77% | 0.766 | S | S | * | * | trans | -61.9 | 96.2 | -179.6 | -23.6 | 35.2 | 0 | 0 | 0 | 113.2 | W111 | P109-W111 PolarHBondContact O-N 3.27Š| ||
| 110 | G | 40.5 | Very low | 44.1 | Very low | 66 Ų | 66 | 134.9 Ų | 134.9 | 68% | 0.68 | 77% | 0.765 | S | S | * | * | trans | -70.6 | 109.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | G108 Y112 | G108-G110 PolarHBondContact O-N 3.46Å; G110-Y112 PolarHBondContact O-N 3.29Å | ||
| 111 | W | 45.9 | Very low | 44.5 | Very low | 240 Ų | 240 | 134.6 Ų | 134.6 | 91% | 0.909 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -65.9 | 8.8 | 178.5 | -84.6 | 89.7 | 0 | 0 | 0 | 115.6 | P109 | P109-W111 PolarHBondContact O-N 3.27Š|
| 112 | Y | 47.8 | Very low | 45.2 | Very low | 189 Ų | 189 | 133.6 Ų | 133.6 | 74% | 0.741 | 77% | 0.773 | S | S | * | * | trans | -138.7 | 66.4 | 179.9 | -78.4 | -81.9 | 0 | 0 | 0 | 111.4 | G110 R125 | G110-Y112 PolarHBondContact O-N 3.29Å; Y112-R125 PolarHBondContact OH-NH1 2.97Å | ||
| 113 | G | 38.9 | Very low | 45.3 | Very low | 66 Ų | 66 | 132.4 Ų | 132.4 | 68% | 0.68 | 77% | 0.769 | S | S | * | * | trans | -78 | 115.5 | 164.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | N115 | G113-N115 PolarHBondContact O-N 3.09Å; G113-N115 VanDerWaalsContact O-N 3.08Å | ||
| 114 | A | 46.7 | Very low | 46.1 | Very low | 102 Ų | 102 | 126.9 Ų | 126.9 | 84% | 0.843 | 76% | 0.764 | S | S | * | * | trans | -82.5 | 78.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 115 | N | 44.3 | Very low | 46.8 | Very low | 153 Ų | 153 | 129.1 Ų | 129.1 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | trans | -104 | 114.9 | 171.8 | -96.2 | -44.9 | 0 | 0 | 0 | 111 | G113 D117 | G113-N115 PolarHBondContact O-N 3.09Å; G113-N115 VanDerWaalsContact O-N 3.08Å; N115-D117 PolarHBondContact O-N 2.94Å; N115-D117 VanDerWaalsContact O-N 3.13Å | ||
| 116 | P | 47.6 | Very low | 47.7 | Very low | 123 Ų | 123 | 132.4 Ų | 132.4 | 80% | 0.799 | 76% | 0.761 | S | S | * | * | trans | -83.8 | 75.1 | 175.8 | 34.1 | -33.9 | 0 | 0 | 0 | 111.5 | ||||
| 117 | D | 44.6 | Very low | 47.9 | Very low | 88 Ų | 88 | 136 Ų | 136 | 47% | 0.471 | 76% | 0.763 | S | S | . | * | trans | -71 | 123.8 | 168.9 | -172.9 | -46.5 | 0 | 0 | 0 | 109.9 | N115 R119 | N115-D117 PolarHBondContact O-N 2.94Å; N115-D117 VanDerWaalsContact O-N 3.13Å; D117-R119 PolarHBondContact O-N 3.24Å; D117-R119 VanDerWaalsContact O-N 3.12Å; D117-R119 VanDerWaalsContact OD1-CB 3.26Å; D117-R119 WeakPolarHBondContact OD1-CB 3.46Å; D117-R119 PolarHBondContact OD1-N 2.89Å | ||
| 118 | P | 56.1 | Low | 47.8 | Very low | 130 Ų | 130 | 132.8 Ų | 132.8 | 84% | 0.844 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68 | -8.5 | -176.7 | 28.5 | -36.1 | 0 | 0 | 0 | 114.7 | ||
| 119 | R | 49 | Very low | 48.2 | Very low | 208 Ų | 208 | 135.3 Ų | 135.3 | 79% | 0.785 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.4 | -13.2 | -179.7 | -70.2 | -173.5 | 158.9 | 94.7 | -1.2 | 114.8 | D117 | D117-R119 PolarHBondContact O-N 3.24Å; D117-R119 VanDerWaalsContact O-N 3.12Å; D117-R119 VanDerWaalsContact OD1-CB 3.26Å; D117-R119 WeakPolarHBondContact OD1-CB 3.46Å; D117-R119 PolarHBondContact OD1-N 2.89Å |
| 120 | F | 41.6 | Very low | 48.2 | Very low | 170 Ų | 170 | 134.6 Ų | 134.6 | 75% | 0.746 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -131.3 | 118.5 | 179.6 | -70.2 | -81.2 | 0 | 0 | 0 | 112.2 | A122 | F120-A122 PolarHBondContact O-N 3.47Å; F120-A122 VanDerWaalsContact O-N 3.16Å |
| 121 | P | 53.1 | Low | 48.5 | Very low | 111 Ų | 111 | 136.4 Ų | 136.4 | 72% | 0.721 | 76% | 0.76 | S | S | * | * | trans | -66.5 | 118.1 | 174.4 | 27.4 | -33 | 0 | 0 | 0 | 109.7 | I123 | P121-I123 PolarHBondContact O-N 3.16Š| ||
| 122 | A | 55 | Low | 48.5 | Very low | 90 Ų | 90 | 128.5 Ų | 128.5 | 74% | 0.744 | 75% | 0.754 | S | S | * | * | trans | -57 | 123.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | F120 S124 | F120-A122 PolarHBondContact O-N 3.47Å; F120-A122 VanDerWaalsContact O-N 3.16Å; A122-S124 PolarHBondContact O-N 3.24Å | ||
| 123 | I | 50.8 | Low | 48.6 | Very low | 145 Ų | 145 | 127.8 Ų | 127.8 | 74% | 0.744 | 76% | 0.759 | S | S | * | * | trans | -73.5 | 93 | 176.4 | -61 | 176.4 | 0 | 0 | 0 | 107.7 | P121 R125 | P121-I123 PolarHBondContact O-N 3.16Å; I123-R125 VanDerWaalsContact O-CG 3.3Å; I123-R125 WeakPolarHBondContact O-CG 3.47Å; I123-R125 PolarHBondContact O-N 2.82Å | ||
| 124 | S | 56.1 | Low | 49.3 | Very low | 106 Ų | 106 | 131.1 Ų | 131.1 | 74% | 0.741 | 76% | 0.761 | S | S | * | * | trans | -53.9 | 110.4 | 175.5 | -64.7 | 0 | 0 | 0 | 0 | 110.6 | A122 F126 | A122-S124 PolarHBondContact O-N 3.24Å; S124-F126 PolarHBondContact O-N 3.1Å; S124-F126 VanDerWaalsContact O-N 3.12Å | ||
| 125 | R | 51.6 | Low | 49.4 | Very low | 193 Ų | 193 | 135.6 Ų | 135.6 | 73% | 0.728 | 77% | 0.767 | S | S | * | * | trans | -84.1 | 27.2 | -178.8 | -54.5 | -174.7 | -176.3 | 155.2 | -0.2 | 112.4 | Y112 I123 M127 | Y112-R125 PolarHBondContact OH-NH1 2.97Å; I123-R125 VanDerWaalsContact O-CG 3.3Å; I123-R125 WeakPolarHBondContact O-CG 3.47Å; I123-R125 PolarHBondContact O-N 2.82Å; R125-M127 PolarHBondContact O-N 3.12Å; R125-M127 VanDerWaalsContact O-N 3.1Å | ||
| 126 | F | 51.3 | Low | 49.5 | Very low | 188 Ų | 188 | 133.6 Ų | 133.6 | 83% | 0.825 | 77% | 0.765 | S | S | * | * | trans | -79.7 | 97.3 | -173.2 | -149.2 | -86 | 0 | 0 | 0 | 110 | S124 G128 | S124-F126 PolarHBondContact O-N 3.1Å; S124-F126 VanDerWaalsContact O-N 3.12Å; F126-G128 PolarHBondContact O-N 3.22Å | ||
| 127 | M | 50.6 | Low | 49.4 | Very low | 177 Ų | 177 | 131.5 Ų | 131.5 | 87% | 0.872 | 77% | 0.766 | S | S | * | * | trans | -69.9 | 93.6 | 167.9 | -78.9 | 165.6 | 46.8 | 0 | 0 | 109 | R125 | R125-M127 PolarHBondContact O-N 3.12Å; R125-M127 VanDerWaalsContact O-N 3.1Å | ||
| 128 | G | 41.9 | Very low | 49.4 | Very low | 55 Ų | 55 | 136.3 Ų | 136.3 | 57% | 0.567 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 136.5 | 163.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | F126 | F126-G128 PolarHBondContact O-N 3.22Š|
| 129 | P | 50.1 | Low | 48.9 | Very low | 118 Ų | 118 | 133.8 Ų | 133.8 | 77% | 0.766 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 153 | 178.9 | 29.8 | -35 | 0 | 0 | 0 | 111.4 | ||
| 130 | A | 47.9 | Very low | 48.7 | Very low | 108 Ų | 108 | 127.7 Ų | 127.7 | 89% | 0.893 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 117.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 131 | S | 47 | Very low | 49.1 | Very low | 104 Ų | 104 | 128.6 Ų | 128.6 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | trans | -122 | 110.2 | 165.4 | -62.1 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 132 | G | 46 | Very low | 48.6 | Very low | 75 Ų | 75 | 126.9 Ų | 126.9 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | trans | -94.3 | 121.2 | -174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 133 | M | 50.2 | Low | 48.1 | Very low | 174 Ų | 174 | 128 Ų | 128 | 86% | 0.857 | 80% | 0.804 | S | S | * | * | trans | -124.7 | 134.3 | 163.3 | -80.5 | 79.6 | -164.2 | 0 | 0 | 110.8 | ||||
| 134 | N | 52.7 | Low | 48.1 | Very low | 136 Ų | 136 | 129.7 Ų | 129.7 | 73% | 0.727 | 81% | 0.814 | S | S | * | * | trans | -75 | 135.1 | 171.3 | 168.3 | 7.8 | 0 | 0 | 0 | 109.8 | S136 | N134-S136 PolarHBondContact OD1-N 3.4Š| ||
| 135 | M | 48.8 | Very low | 47.5 | Very low | 195 Ų | 195 | 128 Ų | 128 | 96% | 0.961 | 81% | 0.813 | S | S | * | * | trans | -145.8 | 100.6 | 141.7 | -82.4 | -143.3 | 173.3 | 0 | 0 | 111.1 | ||||
| 136 | S | 46.5 | Very low | 47.4 | Very low | 112 Ų | 112 | 127.2 Ų | 127.2 | 78% | 0.783 | 82% | 0.823 | S | S | * | * | trans | -90.4 | 129.9 | 160.7 | -69.8 | 0 | 0 | 0 | 0 | 110.4 | N134 | N134-S136 PolarHBondContact OD1-N 3.4Š| ||
| 137 | G | 46.2 | Very low | 47.4 | Very low | 79 Ų | 79 | 124.9 Ų | 124.9 | 81% | 0.814 | 82% | 0.824 | S | S | * | * | trans | 82.6 | 96.6 | 157.8 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 138 | M | 45.3 | Very low | 47.4 | Very low | 189 Ų | 189 | 121 Ų | 121 | 93% | 0.931 | 81% | 0.814 | S | S | * | * | trans | -144.3 | 128.4 | 144.7 | -168.8 | 72.7 | 81.4 | 0 | 0 | 108 | ||||
| 139 | G | 44.9 | Very low | 47.8 | Very low | 77 Ų | 77 | 127.1 Ų | 127.1 | 79% | 0.794 | 83% | 0.825 | S | S | * | * | trans | -119.2 | 135.2 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 140 | G | 45.8 | Very low | 47.6 | Very low | 80 Ų | 80 | 128.7 Ų | 128.7 | 83% | 0.825 | 83% | 0.827 | S | S | * | * | trans | -172 | 118.9 | -173.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 141 | L | 49.9 | Very low | 47.7 | Very low | 188 Ų | 188 | 132.3 Ų | 132.3 | 98% | 0.984 | 83% | 0.827 | S | S | * | * | trans | -63 | 151.3 | -173.6 | -57.6 | 160.4 | 0 | 0 | 0 | 114.6 | ||||
| 142 | G | 41.7 | Very low | 48.1 | Very low | 75 Ų | 75 | 131.3 Ų | 131.3 | 77% | 0.773 | 83% | 0.826 | S | S | * | * | trans | 149.4 | 106.6 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 143 | S | 44.7 | Very low | 48.4 | Very low | 113 Ų | 113 | 133.9 Ų | 133.9 | 79% | 0.79 | 83% | 0.829 | S | S | * | * | cis | 89.7 | 117.5 | 44.3 | -165.3 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 144 | L | 50.3 | Low | 48.9 | Very low | 182 Ų | 182 | 133 Ų | 133 | 95% | 0.953 | 83% | 0.827 | S | S | * | * | trans | 59.6 | 148.7 | 178.5 | -102 | 83.8 | 0 | 0 | 0 | 118.5 | ||||
| 145 | G | 43.5 | Very low | 49.1 | Very low | 70 Ų | 70 | 132.3 Ų | 132.3 | 72% | 0.722 | 83% | 0.83 | S | S | * | * | trans | 144.8 | 56.1 | 163.4 | 0 | 0 | 0 | 0 | 0 | 117.3 | V147 | G145-V147 PolarHBondContact O-N 3.41Å; G145-V147 VanDerWaalsContact O-N 3.12Å | ||
| 146 | D | 51 | Low | 49.7 | Very low | 176 Ų | 176 | 127.6 Ų | 127.6 | 94% | 0.941 | 82% | 0.816 | S | S | * | * | trans | -66.3 | 106.6 | 167.1 | -98.6 | -83.1 | 0 | 0 | 0 | 111.1 | ||||
| 147 | V | 49.9 | Very low | 50.5 | Low | 140 Ų | 140 | 126.2 Ų | 126.2 | 85% | 0.848 | 81% | 0.812 | S | S | * | * | trans | -141.5 | 122.2 | 152.9 | 75.2 | 0 | 0 | 0 | 0 | 110.7 | G145 | G145-V147 PolarHBondContact O-N 3.41Å; G145-V147 VanDerWaalsContact O-N 3.12Å | ||
| 148 | S | 52 | Low | 51.3 | Low | 95 Ų | 95 | 128.2 Ų | 128.2 | 66% | 0.664 | 81% | 0.81 | S | S | * | * | trans | -97.5 | 128.7 | -178.6 | 178 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 149 | K | 49.3 | Very low | 52.5 | Low | 184 Ų | 184 | 129.7 Ų | 129.7 | 80% | 0.8 | 81% | 0.805 | S | S | * | * | trans | 165.1 | 152.7 | 130.2 | -87.1 | 148.4 | -162.5 | 168.4 | 0 | 114.4 | ||||
| 150 | N | 45.5 | Very low | 53.9 | Low | 150 Ų | 150 | 137.1 Ų | 137.1 | 80% | 0.802 | 81% | 0.809 | S | S | * | * | trans | 61.7 | 50.2 | 152.5 | -66.1 | 29.2 | 0 | 0 | 0 | 119.9 | ||||
| 151 | M | 51.2 | Low | 55.2 | Low | 184 Ų | 184 | 143.1 Ų | 143.1 | 91% | 0.906 | 81% | 0.812 | S | S | * | * | trans | -107.9 | 101.4 | 142 | -77.1 | -67.2 | 165.5 | 0 | 0 | 109 | ||||
| 152 | A | 55 | Low | 56.8 | Low | 84 Ų | 84 | 145.4 Ų | 145.4 | 69% | 0.694 | 81% | 0.808 | S | S | * | * | trans | -65.8 | 136.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 110 | L154 | A152-L154 PolarHBondContact O-N 3.16Š| ||
| 153 | P | 52.6 | Low | 58.9 | Low | 128 Ų | 128 | 150 Ų | 150 | 83% | 0.831 | 80% | 0.802 | S | S | * | * | trans | -69 | 97.8 | 176.2 | 28.3 | -33.3 | 0 | 0 | 0 | 109.3 | ||||
| 154 | L | 60.1 | Low | 61 | Low | 156 Ų | 156 | 150.7 Ų | 150.7 | 82% | 0.817 | 80% | 0.801 | S | S | * | * | trans | -49 | 127.1 | 170.2 | -69.1 | 173 | 0 | 0 | 0 | 108.5 | A152 S156 | A152-L154 PolarHBondContact O-N 3.16Å; L154-S156 PolarHBondContact O-N 3.48Å | ||
| 155 | P | 56.3 | Low | 63.1 | Low | 122 Ų | 122 | 149.3 Ų | 149.3 | 79% | 0.792 | 79% | 0.794 | S | S | * | * | trans | -61 | 108.4 | -171.4 | 22.7 | -33.1 | 0 | 0 | 0 | 109.4 | A157 | P155-A157 PolarHBondContact O-N 3.34Š| ||
| 156 | S | 61.3 | Low | 65.6 | Low | 95 Ų | 95 | 148.8 Ų | 148.8 | 66% | 0.664 | 77% | 0.772 | S | S | * | * | trans | -58.7 | 117.7 | -167.3 | 68.3 | 0 | 0 | 0 | 0 | 110.1 | L154 | L154-S156 PolarHBondContact O-N 3.48Š| ||
| 157 | A | 64 | Low | 67.9 | Low | 84 Ų | 84 | 143.2 Ų | 143.2 | 69% | 0.694 | 75% | 0.747 | S | S | * | * | trans | -46.1 | 130.7 | -170.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | P155 R159 | P155-A157 PolarHBondContact O-N 3.34Å; A157-R159 PolarHBondContact O-N 3.46Å | ||
| 158 | P | 63.2 | Low | 70.1 | Confident | 120 Ų | 120 | 143.9 Ų | 143.9 | 78% | 0.779 | 74% | 0.741 | S | S | * | * | trans | -47.3 | 100.4 | -166.1 | -33.4 | 36.4 | 0 | 0 | 0 | 113.7 | R160 | P158-R160 PolarHBondContact O-N 3.05Š| ||
| 159 | R | 70.8 | Confident | 72.3 | Confident | 220 Ų | 220 | 142.7 Ų | 142.7 | 83% | 0.83 | 74% | 0.737 | S | S | * | * | trans | -65.3 | 108.2 | -168.7 | -168.5 | 178 | -67.4 | -125.9 | 3.3 | 108.7 | A157 K161 | A157-R159 PolarHBondContact O-N 3.46Å; R159-K161 PolarHBondContact O-N 3.49Å; R159-K161 VanDerWaalsContact O-N 3.1Å | ||
| 160 | R | 74.5 | Confident | 74.7 | Confident | 234 Ų | 234 | 135.6 Ų | 135.6 | 88% | 0.883 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -47.9 | 120.1 | -177 | -69.8 | -177.3 | -177.4 | 164.3 | 1.9 | 109.4 | P158 R162 | P158-R160 PolarHBondContact O-N 3.05Å; R160-R162 PolarHBondContact O-N 3.17Å; R160-R162 VanDerWaalsContact O-N 3.16Å |
| 161 | K | 73.2 | Confident | 77.2 | Confident | 205 Ų | 205 | 130 Ų | 130 | 89% | 0.891 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 121.6 | -177 | -71.2 | 174.7 | 177.6 | 176.2 | 0 | 109 | R159 R163 | R159-K161 PolarHBondContact O-N 3.49Å; R159-K161 VanDerWaalsContact O-N 3.1Å; K161-R163 PolarHBondContact O-N 2.92Å |
| 162 | R | 82 | Confident | 79.4 | Confident | 236 Ų | 236 | 127.9 Ų | 127.9 | 89% | 0.891 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 123.3 | -175.5 | -173.2 | 173.3 | 74.8 | 177.2 | 3 | 108.7 | R160 V164 | R160-R162 PolarHBondContact O-N 3.17Å; R160-R162 VanDerWaalsContact O-N 3.16Å; R162-V164 PolarHBondContact O-N 3.04Å |
| 163 | R | 87.5 | Confident | 81.5 | Confident | 171 Ų | 171 | 125.8 Ų | 125.8 | 65% | 0.645 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 125.7 | 175.5 | -77.5 | -177.7 | 169.3 | 155.9 | -0.9 | 109.3 | K161 | K161-R163 PolarHBondContact O-N 2.92Š|
| 164 | V | 87.1 | Confident | 83.7 | Confident | 128 Ų | 128 | 119.7 Ų | 119.7 | 78% | 0.776 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 131.3 | 171.6 | -179.2 | 0 | 0 | 0 | 0 | 107.7 | R162 | R162-V164 PolarHBondContact O-N 3.04Š|
| 165 | L | 94.2 | Very high | 85.5 | Confident | 153 Ų | 153 | 115.5 Ų | 115.5 | 80% | 0.801 | 57% | 0.573 | S | S | * | * | P | Polyproline II helix | trans | -98.3 | 147.8 | 172.2 | -59.4 | 178.8 | 0 | 0 | 0 | 108.9 | ||
| 166 | F | 97.4 | Very high | 87.5 | Confident | 60 Ų | 60 | 115.4 Ų | 115.4 | 26% | 0.263 | 56% | 0.557 | S | S | . | * | P | Polyproline II helix | trans | -74.2 | 149 | 171.6 | -56.2 | -36.8 | 0 | 0 | 0 | 110.4 | Q170 V171 L174 L198 Q202 W206 | F166-Q170 HydrophobicContact CB-CB 4.13Å; F166-V171 HydrophobicContact CB-CG2 4.03Å; F166-L174 HydrophobicContact CD2-CD1 4.24Å; F166-L198 HydrophobicContact CD1-CD1 3.95Å; F166-L198 HydrophobicContact CD1-CD2 3.65Å; F166-L198 HydrophobicContact CD1-CG 4.5Å; F166-L198 HydrophobicContact CD2-CD1 4.38Å; F166-L198 HydrophobicContact CE1-CD1 3.96Å; F166-L198 HydrophobicContact CE1-CD2 3.63Å; F166-L198 HydrophobicContact CE1-CG 4.48Å; F166-L198 HydrophobicContact CE2-CD1 4.38Å; F166-L198 HydrophobicContact CG-CD1 4.19Å; F166-L198 HydrophobicContact CZ-CD1 4.19Å; F166-Q202 HydrophobicContact CE1-CB 4.32Å; F166-Q202 HydrophobicContact CE1-CG 4.26Å; F166-Q202 HydrophobicContact CZ-CB 3.93Å; F166-Q202 HydrophobicContact CZ-CG 4.14Å; F166-W206 AromaticContact CD2-CD1 3.87Å; F166-W206 HydrophobicContact CE2-CB 4.29Å; F166-W206 AromaticContact CE2-CD1 3.78Å; F166-W206 HydrophobicContact CE2-CG 4.37Å |
| 167 | S | 97.9 | Very high | 89.3 | Confident | 58 Ų | 58 | 114.9 Ų | 114.9 | 41% | 0.406 | 54% | 0.54 | S | S | . | . | P | Polyproline II helix | trans | -70.1 | 159.2 | 176.4 | 76.5 | 0 | 0 | 0 | 0 | 111.4 | A169 Q170 V171 | S167-A169 PolarHBondContact O-N 3.21Å; S167-Q170 WeakPolarHBondContact O-CB 3.4Å; S167-Q170 PolarHBondContact O-N 2.98Å; S167-Q170 VanDerWaalsContact O-N 3.09Å; S167-Q170 WeakPolarHBondContact OG-CG 3.3Å; S167-Q170 PolarHBondContact OG-N 2.72Å; S167-V171 WeakPolarHBondContact O-CG2 3.5Å; S167-V171 PolarHBondContact O-N 3.35Å |
| 168 | Q | 98 | Very high | 90.9 | Very high | 154 Ų | 154 | 111.2 Ų | 111.2 | 72% | 0.72 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -60.7 | -33.1 | 179.8 | -171.9 | 61.6 | 14.6 | 0 | 0 | 112.4 | V171 Y172 | Q168-V171 PolarHBondContact O-N 3.08Å; Q168-Y172 WeakPolarHBondContact O-CB 3.49Å; Q168-Y172 PolarHBondContact O-N 3.33Å |
| 169 | A | 97.9 | Very high | 92.6 | Very high | 71 Ų | 71 | 112.7 Ų | 112.7 | 59% | 0.587 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -67 | -42.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | S167 Y172 E173 | S167-A169 PolarHBondContact O-N 3.21Å; A169-Y172 PolarHBondContact O-N 2.79Å; A169-E173 PolarHBondContact O-N 3.47Å; A169-E173 VanDerWaalsContact O-N 3.08Å |
| 170 | Q | 98.4 | Very high | 93.8 | Very high | 35 Ų | 35 | 107.9 Ų | 107.9 | 16% | 0.164 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -62.1 | -44.3 | 173.9 | -72.6 | 172.2 | -32 | 0 | 0 | 111.2 | F166 S167 L174 I196 | F166-Q170 HydrophobicContact CB-CB 4.13Å; S167-Q170 WeakPolarHBondContact O-CB 3.4Å; S167-Q170 PolarHBondContact O-N 2.98Å; S167-Q170 VanDerWaalsContact O-N 3.09Å; S167-Q170 WeakPolarHBondContact OG-CG 3.3Å; S167-Q170 PolarHBondContact OG-N 2.72Å; Q170-L174 WeakPolarHBondContact O-CB 3.12Å; Q170-L174 WeakPolarHBondContact O-CD1 3.34Å; Q170-L174 WeakPolarHBondContact O-CG 3.45Å; Q170-L174 PolarHBondContact O-N 3.23Å; Q170-I196 HydrophobicContact CG-CB 4.32Å; Q170-I196 WeakPolarHBondContact CG-O 3.43Å; Q170-I196 PolarHBondContact NE2-O 2.85Å |
| 171 | V | 98.3 | Very high | 94.9 | Very high | 32 Ų | 32 | 100.3 Ų | 100.3 | 19% | 0.194 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -63.4 | -41.3 | 176.4 | 176.5 | 0 | 0 | 0 | 0 | 111.3 | F166 S167 Q168 L174 E175 | F166-V171 HydrophobicContact CB-CG2 4.03Å; S167-V171 WeakPolarHBondContact O-CG2 3.5Å; S167-V171 PolarHBondContact O-N 3.35Å; Q168-V171 PolarHBondContact O-N 3.08Å; V171-L174 PolarHBondContact O-N 3.37Å; V171-E175 HydrophobicContact CG1-CG 4.42Å; V171-E175 WeakPolarHBondContact O-CB 3.45Å; V171-E175 WeakPolarHBondContact O-CG 3.44Å; V171-E175 PolarHBondContact O-N 3.42Å |
| 172 | Y | 98.4 | Very high | 96.1 | Very high | 140 Ų | 140 | 94.5 Ų | 94.5 | 55% | 0.549 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -59.2 | -50.2 | 177.1 | 174.2 | -90.1 | 0 | 0 | 0 | 112.3 | Q168 A169 E175 R176 | Q168-Y172 WeakPolarHBondContact O-CB 3.49Å; Q168-Y172 PolarHBondContact O-N 3.33Å; A169-Y172 PolarHBondContact O-N 2.79Å; Y172-E175 PolarHBondContact O-N 2.89Å; Y172-R176 WeakPolarHBondContact O-CB 3.36Å; Y172-R176 PolarHBondContact O-N 3.03Å |
| 173 | E | 98.4 | Very high | 96.9 | Very high | 39 Ų | 39 | 90.8 Ų | 90.8 | 18% | 0.182 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -68 | -36.5 | 179.4 | -81.9 | -58.2 | 132.6 | 0 | 0 | 112.6 | A169 E175 R176 R177 I196 | A169-E173 PolarHBondContact O-N 3.47Å; A169-E173 VanDerWaalsContact O-N 3.08Å; E173-E175 VanDerWaalsContact C-N 3.35Å; E173-E175 PolarHBondContact O-N 3.24Å; E173-R176 PolarHBondContact O-N 2.94Å; E173-R176 WeakPolarHBondContact OE1-CD 3.37Å; E173-R176 IonicContact OE1-CZ 3.81Å; E173-R176 IonicContact OE1-NE 2.92Å; E173-R176 IonicContact OE1-NH1 2.72Å; E173-R176 PolarHBondContact OE1-NH1 3.26Å; E173-R176 WeakPolarHBondContact OE2-CD 3.44Å; E173-R176 IonicContact OE2-NH1 3.35Å; E173-R176 PolarHBondContact OE2-NH1 3.48Å; E173-R177 PolarHBondContact O-N 3.04Å; E173-I196 HydrophobicContact CB-CG2 3.79Å; E173-I196 HydrophobicContact CG-CG2 4.32Å |
| 174 | L | 98.6 | Very high | 97.4 | Very high | 0 Ų | 0 | 84 Ų | 84 | 0% | 0 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -59.7 | -43.9 | 171 | -72.7 | 166.8 | 0 | 0 | 0 | 111.4 | F166 Q170 V171 F178 L192 I196 L198 V203 W206 F207 | F166-L174 HydrophobicContact CD2-CD1 4.24Å; Q170-L174 WeakPolarHBondContact O-CB 3.12Å; Q170-L174 WeakPolarHBondContact O-CD1 3.34Å; Q170-L174 WeakPolarHBondContact O-CG 3.45Å; Q170-L174 PolarHBondContact O-N 3.23Å; V171-L174 PolarHBondContact O-N 3.37Å; L174-F178 WeakPolarHBondContact O-CB 3.36Å; L174-F178 PolarHBondContact O-N 2.92Å; L174-L192 HydrophobicContact CD2-CD2 4.26Å; L174-I196 HydrophobicContact CD1-CD1 4.27Å; L174-I196 HydrophobicContact CD2-CD1 3.67Å; L174-I196 HydrophobicContact CG-CD1 3.73Å; L174-L198 HydrophobicContact CD1-CD1 4.12Å; L174-V203 HydrophobicContact CD2-CG1 4.03Å; L174-V203 HydrophobicContact CD2-CG2 4.35Å; L174-W206 VanDerWaalsContact C-CH2 3.46Å; L174-W206 HydrophobicContact CB-CD2 3.94Å; L174-W206 HydrophobicContact CB-CE3 3.9Å; L174-W206 HydrophobicContact CB-CH2 3.65Å; L174-W206 HydrophobicContact CB-CZ2 3.68Å; L174-W206 HydrophobicContact CB-CZ3 3.78Å; L174-W206 HydrophobicContact CD1-CB 4.49Å; L174-W206 HydrophobicContact CD1-CD2 3.92Å; L174-W206 HydrophobicContact CD1-CG 3.88Å; L174-W206 HydrophobicContact CD2-CD2 4.33Å; L174-W206 HydrophobicContact CD2-CE3 4.18Å; L174-W206 HydrophobicContact CG-CD2 4.29Å; L174-W206 HydrophobicContact CG-CE3 4.44Å; L174-F207 HydrophobicContact CD2-CD2 4.32Å; L174-F207 HydrophobicContact CD2-CE2 3.85Å |
| 175 | E | 98.3 | Very high | 97.9 | Very high | 68 Ų | 68 | 80.3 Ų | 80.3 | 32% | 0.318 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -71.5 | -35 | 175.9 | -71.2 | -162.1 | 162.8 | 0 | 0 | 113.3 | V171 Y172 E173 F178 K179 W206 H210 | V171-E175 HydrophobicContact CG1-CG 4.42Å; V171-E175 WeakPolarHBondContact O-CB 3.45Å; V171-E175 WeakPolarHBondContact O-CG 3.44Å; V171-E175 PolarHBondContact O-N 3.42Å; Y172-E175 PolarHBondContact O-N 2.89Å; E173-E175 VanDerWaalsContact C-N 3.35Å; E173-E175 PolarHBondContact O-N 3.24Å; E175-F178 PolarHBondContact O-N 2.68Å; E175-K179 WeakPolarHBondContact O-CB 3.22Å; E175-K179 VanDerWaalsContact O-CG 3.25Å; E175-K179 WeakPolarHBondContact O-CG 3.16Å; E175-K179 PolarHBondContact O-N 3.08Å; E175-W206 HydrophobicContact CB-CH2 4.41Å; E175-W206 HydrophobicContact CG-CH2 3.65Å; E175-W206 HydrophobicContact CG-CZ2 3.67Å; E175-H210 IonicContact OE1-CE1 3.47Å; E175-H210 PolarHBondContact OE1-CE1 2.81Å |
| 176 | R | 98.4 | Very high | 98.1 | Very high | 120 Ų | 120 | 75.3 Ų | 75.3 | 45% | 0.453 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -61.7 | -50.8 | 174.3 | -175.9 | -173.5 | 178 | -162.1 | -0.5 | 111 | Y172 E173 K179 Q180 | Y172-R176 WeakPolarHBondContact O-CB 3.36Å; Y172-R176 PolarHBondContact O-N 3.03Å; E173-R176 PolarHBondContact O-N 2.94Å; E173-R176 WeakPolarHBondContact OE1-CD 3.37Å; E173-R176 IonicContact OE1-CZ 3.81Å; E173-R176 IonicContact OE1-NE 2.92Å; E173-R176 IonicContact OE1-NH1 2.72Å; E173-R176 PolarHBondContact OE1-NH1 3.26Å; E173-R176 WeakPolarHBondContact OE2-CD 3.44Å; E173-R176 IonicContact OE2-NH1 3.35Å; E173-R176 PolarHBondContact OE2-NH1 3.48Å; R176-K179 WeakPolarHBondContact O-CB 3.3Å; R176-K179 PolarHBondContact O-N 3.33Å; R176-Q180 PolarHBondContact O-N 3.26Å |
| 177 | R | 98.2 | Very high | 98.1 | Very high | 85 Ų | 85 | 76.5 Ų | 76.5 | 32% | 0.321 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -66.8 | -38.3 | 175.1 | -68.5 | -54 | -161.8 | 159.6 | 7.5 | 112.2 | E173 K179 Q180 Q181 L192 F207 | E173-R177 PolarHBondContact O-N 3.04Å; R177-K179 VanDerWaalsContact C-N 3.31Å; R177-K179 PolarHBondContact O-N 2.91Å; R177-Q180 WeakPolarHBondContact O-CB 3.49Å; R177-Q180 PolarHBondContact O-N 3.05Å; R177-Q181 PolarHBondContact O-N 3.45Å; R177-L192 HydrophobicContact CB-CD2 3.95Å; R177-L192 HydrophobicContact CG-CD1 3.82Å; R177-L192 HydrophobicContact CG-CD2 3.97Å; R177-F207 HydrophobicContact CB-CZ 4.28Å |
| 178 | F | 98.4 | Very high | 98.1 | Very high | 6 Ų | 6 | 77 Ų | 77 | 3% | 0.026 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -67.4 | -28.1 | 175.7 | -174.9 | -100.3 | 0 | 0 | 0 | 113.5 | L174 E175 Q181 K182 W206 F207 H210 R211 M214 | L174-F178 WeakPolarHBondContact O-CB 3.36Å; L174-F178 PolarHBondContact O-N 2.92Å; E175-F178 PolarHBondContact O-N 2.68Å; F178-Q181 WeakPolarHBondContact CA-O 3.46Å; F178-K182 HydrophobicContact CD1-CD 4.32Å; F178-K182 HydrophobicContact CD2-CD 4.34Å; F178-K182 HydrophobicContact CE1-CD 3.82Å; F178-K182 HydrophobicContact CE2-CB 4.04Å; F178-K182 HydrophobicContact CE2-CD 3.86Å; F178-K182 HydrophobicContact CZ-CB 4.41Å; F178-K182 HydrophobicContact CZ-CD 3.58Å; F178-K182 WeakPolarHBondContact O-CD 3.39Å; F178-K182 WeakPolarHBondContact O-CE 3.47Å; F178-K182 PolarHBondContact O-NZ 3.05Å; F178-W206 HydrophobicContact CB-CH2 4.17Å; F178-W206 HydrophobicContact CB-CZ3 3.87Å; F178-W206 HydrophobicContact CD2-CZ3 4.49Å; F178-W206 HydrophobicContact CG-CZ3 4.2Å; F178-F207 HydrophobicContact CB-CE1 4.05Å; F178-F207 HydrophobicContact CB-CZ 4.07Å; F178-F207 AromaticContact CD2-CD1 3.74Å; F178-F207 HydrophobicContact CD2-CD1 3.74Å; F178-F207 AromaticContact CD2-CE1 3.73Å; F178-F207 HydrophobicContact CD2-CE1 3.73Å; F178-F207 HydrophobicContact CD2-CZ 4.49Å; F178-F207 HydrophobicContact CE2-CD1 4.45Å; F178-F207 HydrophobicContact CG-CE1 4.4Å; F178-H210 AromaticContact CD1-CD2 3.6Å; F178-H210 AromaticContact CD1-CG 3.95Å; F178-H210 AromaticContact CD1-NE2 3.72Å; F178-H210 HydrophobicContact CE1-CB 4.5Å; F178-H210 AromaticContact CE1-CD2 3.17Å; F178-H210 WeakPolarHBondContact CE1-CD2 3.36Å; F178-H210 AromaticContact CE1-CG 3.84Å; F178-H210 AromaticContact CE1-NE2 3.59Å; F178-H210 HydrophobicContact CE2-CB 4.39Å; F178-H210 HydrophobicContact CZ-CB 4.33Å; F178-H210 AromaticContact CZ-CD2 3.68Å; F178-R211 HydrophobicContact CE2-CG 3.8Å; F178-R211 HydrophobicContact CZ-CG 4.03Å; F178-M214 HydrophobicContact CE1-SD 3.57Å; F178-M214 VanDerWaalsContact CE1-SD 3.57Å; F178-M214 HydrophobicContact CZ-SD 3.83Å |
| 179 | K | 97.8 | Very high | 98.2 | Very high | 151 Ų | 151 | 72.1 Ų | 72.1 | 66% | 0.657 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -62 | -46.9 | 170.3 | -78.9 | 164.9 | -175 | 174 | 0 | 110.8 | E175 R176 R177 K182 | E175-K179 WeakPolarHBondContact O-CB 3.22Å; E175-K179 VanDerWaalsContact O-CG 3.25Å; E175-K179 WeakPolarHBondContact O-CG 3.16Å; E175-K179 PolarHBondContact O-N 3.08Å; R176-K179 WeakPolarHBondContact O-CB 3.3Å; R176-K179 PolarHBondContact O-N 3.33Å; R177-K179 VanDerWaalsContact C-N 3.31Å; R177-K179 PolarHBondContact O-N 2.91Å; K179-K182 PolarHBondContact O-NZ 3.29Å |
| 180 | Q | 97.8 | Very high | 98.2 | Very high | 119 Ų | 119 | 73.3 Ų | 73.3 | 56% | 0.556 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -62.8 | -50 | 175.9 | -62.4 | 168.7 | -10.5 | 0 | 0 | 112.2 | R176 R177 | R176-Q180 PolarHBondContact O-N 3.26Å; R177-Q180 WeakPolarHBondContact O-CB 3.49Å; R177-Q180 PolarHBondContact O-N 3.05Å |
| 181 | Q | 97.8 | Very high | 98.2 | Very high | 76 Ų | 76 | 76.7 Ų | 76.7 | 36% | 0.355 | 36% | 0.357 | S | S | . | . | trans | -145.7 | 122 | -167.3 | -174.5 | 171.8 | -24.7 | 0 | 0 | 111.6 | R177 F178 Y183 L184 E188 F207 | R177-Q181 PolarHBondContact O-N 3.45Å; F178-Q181 WeakPolarHBondContact CA-O 3.46Å; Q181-Y183 VanDerWaalsContact C-N 3.35Å; Q181-Y183 WeakPolarHBondContact CG-O 3.5Å; Q181-Y183 PolarHBondContact NE2-O 3.15Å; Q181-Y183 PolarHBondContact O-N 3.49Å; Q181-L184 HydrophobicContact CB-CD2 4.42Å; Q181-L184 HydrophobicContact CG-CD2 4.23Å; Q181-E188 VanDerWaalsContact NE2-CD 3.31Å; Q181-E188 PolarHBondContact NE2-OE1 3.5Å; Q181-E188 PolarHBondContact NE2-OE2 3.39Å; Q181-E188 PolarHBondContact OE1-OE1 3.07Å; Q181-F207 WeakPolarHBondContact O-CE1 3.38Å | ||
| 182 | K | 97.4 | Very high | 98.2 | Very high | 82 Ų | 82 | 75.3 Ų | 75.3 | 36% | 0.357 | 35% | 0.348 | S | S | . | . | S | Bend | trans | -79 | -16.4 | -174.5 | -49.1 | -60 | 165.7 | -156.6 | 0 | 113.9 | F178 K179 R211 | F178-K182 HydrophobicContact CD1-CD 4.32Å; F178-K182 HydrophobicContact CD2-CD 4.34Å; F178-K182 HydrophobicContact CE1-CD 3.82Å; F178-K182 HydrophobicContact CE2-CB 4.04Å; F178-K182 HydrophobicContact CE2-CD 3.86Å; F178-K182 HydrophobicContact CZ-CB 4.41Å; F178-K182 HydrophobicContact CZ-CD 3.58Å; F178-K182 WeakPolarHBondContact O-CD 3.39Å; F178-K182 WeakPolarHBondContact O-CE 3.47Å; F178-K182 PolarHBondContact O-NZ 3.05Å; K179-K182 PolarHBondContact O-NZ 3.29Å; K182-R211 WeakPolarHBondContact O-CD 3.36Å |
| 183 | Y | 98.1 | Very high | 98.2 | Very high | 159 Ų | 159 | 68.7 Ų | 68.7 | 62% | 0.624 | 32% | 0.323 | S | S | * | . | S | Bend | trans | -138.6 | 115.2 | -174.2 | -63.1 | -102.6 | 0 | 0 | 0 | 109.6 | Q181 | Q181-Y183 VanDerWaalsContact C-N 3.35Å; Q181-Y183 WeakPolarHBondContact CG-O 3.5Å; Q181-Y183 PolarHBondContact NE2-O 3.15Å; Q181-Y183 PolarHBondContact O-N 3.49Å |
| 184 | L | 98.1 | Very high | 98.2 | Very high | 27 Ų | 27 | 71 Ų | 71 | 14% | 0.141 | 34% | 0.343 | C | S | . | . | trans | -95.8 | 134.5 | 174.4 | -58.2 | -178.9 | 0 | 0 | 0 | 111.2 | Q181 E188 R189 L192 V203 F207 | Q181-L184 HydrophobicContact CB-CD2 4.42Å; Q181-L184 HydrophobicContact CG-CD2 4.23Å; L184-E188 HydrophobicContact CB-CB 4.32Å; L184-E188 HydrophobicContact CD2-CB 4.23Å; L184-R189 HydrophobicContact CB-CB 4.23Å; L184-R189 HydrophobicContact CD1-CB 4.47Å; L184-R189 PolarHBondContact O-NH2 3.42Å; L184-L192 HydrophobicContact CD1-CD2 3.69Å; L184-V203 HydrophobicContact CD1-CG1 4.24Å; L184-F207 HydrophobicContact CD1-CD1 4.34Å; L184-F207 HydrophobicContact CD1-CD2 4.34Å; L184-F207 HydrophobicContact CD1-CE1 3.81Å; L184-F207 HydrophobicContact CD1-CE2 3.83Å; L184-F207 HydrophobicContact CD1-CZ 3.54Å; L184-F207 HydrophobicContact CD2-CE1 4.23Å; L184-F207 HydrophobicContact CD2-CZ 4.49Å; L184-F207 HydrophobicContact CG-CD1 4.05Å; L184-F207 HydrophobicContact CG-CE1 3.62Å; L184-F207 HydrophobicContact CG-CZ 3.91Å | ||
| 185 | S | 98.3 | Very high | 98.2 | Very high | 52 Ų | 52 | 75.2 Ų | 75.2 | 36% | 0.364 | 36% | 0.364 | S | S | . | . | trans | -61.8 | -174.6 | 164.8 | 69.6 | 0 | 0 | 0 | 0 | 111.8 | E188 R189 | S185-E188 WeakPolarHBondContact CB-OE2 3.5Å; S185-E188 PolarHBondContact N-OE2 3.49Å; S185-E188 WeakPolarHBondContact OG-CG 3.13Å; S185-E188 PolarHBondContact OG-OE2 3.21Å; S185-R189 VanDerWaalsContact C-NH2 3.35Å; S185-R189 VanDerWaalsContact O-CB 3.26Å; S185-R189 WeakPolarHBondContact O-CB 3.25Å; S185-R189 VanDerWaalsContact O-CZ 3.22Å; S185-R189 PolarHBondContact O-NH2 3.33Å | ||
| 186 | A | 98.1 | Very high | 98.2 | Very high | 47 Ų | 47 | 72.7 Ų | 72.7 | 39% | 0.388 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -66.4 | -60.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | E188 R189 E190 | A186-E188 PolarHBondContact O-N 3.34Å; A186-R189 WeakPolarHBondContact O-CB 3.47Å; A186-R189 PolarHBondContact O-N 3.22Å; A186-E190 PolarHBondContact O-N 3.29Å |
| 187 | P | 98.2 | Very high | 98.2 | Very high | 85 Ų | 85 | 74.9 Ų | 74.9 | 55% | 0.552 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -64.7 | -38 | -172.9 | 24.3 | -35.4 | 0 | 0 | 0 | 113.5 | R189 E190 H191 | P187-R189 PolarHBondContact O-N 3.16Å; P187-E190 PolarHBondContact O-N 2.87Å; P187-H191 WeakPolarHBondContact O-CB 3.49Å; P187-H191 PolarHBondContact O-N 3.45Å |
| 188 | E | 98.3 | Very high | 98.1 | Very high | 70 Ų | 70 | 71.8 Ų | 71.8 | 33% | 0.327 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -60.3 | -34.6 | 175.5 | -63.9 | 165.4 | 128.9 | 0 | 0 | 112.1 | Q181 L184 S185 A186 L192 | Q181-E188 VanDerWaalsContact NE2-CD 3.31Å; Q181-E188 PolarHBondContact NE2-OE1 3.5Å; Q181-E188 PolarHBondContact NE2-OE2 3.39Å; Q181-E188 PolarHBondContact OE1-OE1 3.07Å; L184-E188 HydrophobicContact CB-CB 4.32Å; L184-E188 HydrophobicContact CD2-CB 4.23Å; S185-E188 WeakPolarHBondContact CB-OE2 3.5Å; S185-E188 PolarHBondContact N-OE2 3.49Å; S185-E188 WeakPolarHBondContact OG-CG 3.13Å; S185-E188 PolarHBondContact OG-OE2 3.21Å; A186-E188 PolarHBondContact O-N 3.34Å; E188-L192 WeakPolarHBondContact O-CB 3.31Å; E188-L192 PolarHBondContact O-N 2.92Å |
| 189 | R | 98.5 | Very high | 98.1 | Very high | 50 Ų | 50 | 74.7 Ų | 74.7 | 19% | 0.189 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -77.4 | -35.3 | -179.4 | -164.8 | -169.8 | -44.8 | 117.9 | 6.5 | 111.7 | L184 S185 A186 P187 A193 P200 V203 | L184-R189 HydrophobicContact CB-CB 4.23Å; L184-R189 HydrophobicContact CD1-CB 4.47Å; L184-R189 PolarHBondContact O-NH2 3.42Å; S185-R189 VanDerWaalsContact C-NH2 3.35Å; S185-R189 VanDerWaalsContact O-CB 3.26Å; S185-R189 WeakPolarHBondContact O-CB 3.25Å; S185-R189 VanDerWaalsContact O-CZ 3.22Å; S185-R189 PolarHBondContact O-NH2 3.33Å; A186-R189 WeakPolarHBondContact O-CB 3.47Å; A186-R189 PolarHBondContact O-N 3.22Å; P187-R189 PolarHBondContact O-N 3.16Å; R189-A193 WeakPolarHBondContact O-CB 3.48Å; R189-A193 PolarHBondContact O-N 3.34Å; R189-P200 WeakPolarHBondContact CD-O 3.49Å; R189-V203 HydrophobicContact CG-CB 3.8Å; R189-V203 HydrophobicContact CG-CG1 3.65Å |
| 190 | E | 98.5 | Very high | 98.2 | Very high | 97 Ų | 97 | 69.9 Ų | 69.9 | 45% | 0.453 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -67.5 | -46.1 | 173.1 | -75 | 149.8 | -158.6 | 0 | 0 | 111 | A186 P187 L192 A193 S194 P200 | A186-E190 PolarHBondContact O-N 3.29Å; P187-E190 PolarHBondContact O-N 2.87Å; E190-L192 PolarHBondContact O-N 3.34Å; E190-A193 PolarHBondContact O-N 3.15Å; E190-S194 PolarHBondContact O-N 3.48Å; E190-S194 PolarHBondContact O-OG 3.43Å; E190-S194 VanDerWaalsContact O-OG 3.1Å; E190-P200 HydrophobicContact CG-CB 4.22Å; E190-P200 HydrophobicContact CG-CG 3.84Å |
| 191 | H | 98.5 | Very high | 98.2 | Very high | 105 Ų | 105 | 68.3 Ų | 68.3 | 49% | 0.486 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -59 | -47.1 | 173.1 | 175 | 63.3 | 0 | 0 | 0 | 112.2 | P187 S194 M195 | P187-H191 WeakPolarHBondContact O-CB 3.49Å; P187-H191 PolarHBondContact O-N 3.45Å; H191-S194 PolarHBondContact O-N 3.2Å; H191-M195 VanDerWaalsContact NE2-CE 3.31Å; H191-M195 WeakPolarHBondContact NE2-CE 3.36Å; H191-M195 WeakPolarHBondContact O-CG 3.01Å; H191-M195 PolarHBondContact O-N 2.9Å; H191-M195 VanDerWaalsContact O-N 3.15Å |
| 192 | L | 98.5 | Very high | 98.2 | Very high | 4 Ų | 4 | 67.9 Ų | 67.9 | 2% | 0.021 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -63.5 | -43.8 | 176.4 | -178.3 | 56.3 | 0 | 0 | 0 | 112.5 | L174 R177 L184 E188 E190 S194 M195 I196 V203 F207 | L174-L192 HydrophobicContact CD2-CD2 4.26Å; R177-L192 HydrophobicContact CB-CD2 3.95Å; R177-L192 HydrophobicContact CG-CD1 3.82Å; R177-L192 HydrophobicContact CG-CD2 3.97Å; L184-L192 HydrophobicContact CD1-CD2 3.69Å; E188-L192 WeakPolarHBondContact O-CB 3.31Å; E188-L192 PolarHBondContact O-N 2.92Å; E190-L192 PolarHBondContact O-N 3.34Å; L192-S194 VanDerWaalsContact C-N 3.34Å; L192-S194 PolarHBondContact O-N 3.39Å; L192-M195 HydrophobicContact CD1-CE 4Å; L192-M195 PolarHBondContact O-N 2.85Å; L192-I196 HydrophobicContact CD1-CD1 4.27Å; L192-I196 HydrophobicContact CD1-CG2 4.09Å; L192-I196 HydrophobicContact CG-CD1 4.19Å; L192-I196 WeakPolarHBondContact O-CG1 3.44Å; L192-I196 PolarHBondContact O-N 3.17Å; L192-V203 HydrophobicContact CD2-CG1 4.01Å; L192-V203 HydrophobicContact CG-CG1 4.49Å; L192-F207 HydrophobicContact CD2-CE2 3.97Å; L192-F207 HydrophobicContact CD2-CZ 4.2Å |
| 193 | A | 98.6 | Very high | 98.2 | Very high | 1 Ų | 1 | 64 Ų | 64 | 1% | 0.008 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -56.2 | -47.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | R189 E190 I196 H197 L198 P200 V203 | R189-A193 WeakPolarHBondContact O-CB 3.48Å; R189-A193 PolarHBondContact O-N 3.34Å; E190-A193 PolarHBondContact O-N 3.15Å; A193-I196 PolarHBondContact O-N 2.74Å; A193-H197 PolarHBondContact O-N 2.76Å; A193-H197 VanDerWaalsContact O-N 3.07Å; A193-L198 CarbonylContact C-O 3.4Å; A193-L198 VanDerWaalsContact CB-O 3.29Å; A193-L198 WeakPolarHBondContact CB-O 3.17Å; A193-L198 PolarHBondContact O-N 3.22Å; A193-L198 VanDerWaalsContact O-O 3.1Å; A193-P200 HydrophobicContact CB-CB 4.41Å; A193-P200 HydrophobicContact CB-CG 3.92Å; A193-V203 HydrophobicContact CB-CG2 3.97Å |
| 194 | S | 98.4 | Very high | 98.3 | Very high | 87 Ų | 87 | 62.2 Ų | 62.2 | 61% | 0.608 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -60.9 | -45 | 176.6 | -63.4 | 0 | 0 | 0 | 0 | 112.9 | E190 H191 L192 I196 H197 | E190-S194 PolarHBondContact O-N 3.48Å; E190-S194 PolarHBondContact O-OG 3.43Å; E190-S194 VanDerWaalsContact O-OG 3.1Å; H191-S194 PolarHBondContact O-N 3.2Å; L192-S194 VanDerWaalsContact C-N 3.34Å; L192-S194 PolarHBondContact O-N 3.39Å; S194-I196 VanDerWaalsContact C-N 3.33Å; S194-I196 PolarHBondContact O-N 3.01Å; S194-H197 PolarHBondContact O-N 3.35Å; S194-H197 PolarHBondContact O-ND1 2.89Å |
| 195 | M | 98.1 | Very high | 98.3 | Very high | 89 Ų | 89 | 64.7 Ų | 64.7 | 44% | 0.438 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -63.9 | -32.6 | -179.8 | -74.7 | -172 | -65.1 | 0 | 0 | 114.1 | H191 L192 | H191-M195 VanDerWaalsContact NE2-CE 3.31Å; H191-M195 WeakPolarHBondContact NE2-CE 3.36Å; H191-M195 WeakPolarHBondContact O-CG 3.01Å; H191-M195 PolarHBondContact O-N 2.9Å; H191-M195 VanDerWaalsContact O-N 3.15Å; L192-M195 HydrophobicContact CD1-CE 4Å; L192-M195 PolarHBondContact O-N 2.85Å |
| 196 | I | 97.9 | Very high | 98.3 | Very high | 15 Ų | 15 | 63.8 Ų | 63.8 | 8% | 0.077 | 34% | 0.336 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -107.2 | 9.2 | -175.4 | 73.7 | -172.9 | 0 | 0 | 0 | 113.2 | Q170 E173 L174 L192 A193 S194 L198 V203 | Q170-I196 HydrophobicContact CG-CB 4.32Å; Q170-I196 WeakPolarHBondContact CG-O 3.43Å; Q170-I196 PolarHBondContact NE2-O 2.85Å; E173-I196 HydrophobicContact CB-CG2 3.79Å; E173-I196 HydrophobicContact CG-CG2 4.32Å; L174-I196 HydrophobicContact CD1-CD1 4.27Å; L174-I196 HydrophobicContact CD2-CD1 3.67Å; L174-I196 HydrophobicContact CG-CD1 3.73Å; L192-I196 HydrophobicContact CD1-CD1 4.27Å; L192-I196 HydrophobicContact CD1-CG2 4.09Å; L192-I196 HydrophobicContact CG-CD1 4.19Å; L192-I196 WeakPolarHBondContact O-CG1 3.44Å; L192-I196 PolarHBondContact O-N 3.17Å; A193-I196 PolarHBondContact O-N 2.74Å; S194-I196 VanDerWaalsContact C-N 3.33Å; S194-I196 PolarHBondContact O-N 3.01Å; I196-L198 VanDerWaalsContact C-N 3.33Å; I196-L198 HydrophobicContact CD1-CB 4.49Å; I196-L198 HydrophobicContact CD1-CD1 3.84Å; I196-L198 HydrophobicContact CD1-CG 4.32Å; I196-L198 HydrophobicContact CG1-CB 4.08Å; I196-L198 HydrophobicContact CG1-CD1 4.07Å; I196-L198 HydrophobicContact CG1-CG 3.99Å; I196-L198 PolarHBondContact O-N 3.4Å; I196-V203 HydrophobicContact CD1-CG2 4.32Å |
| 197 | H | 98.2 | Very high | 98.3 | Very high | 165 Ų | 165 | 61.9 Ų | 61.9 | 76% | 0.764 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.5 | 48.4 | -177.5 | -50.7 | -48.4 | 0 | 0 | 0 | 113.5 | A193 S194 | A193-H197 PolarHBondContact O-N 2.76Å; A193-H197 VanDerWaalsContact O-N 3.07Å; S194-H197 PolarHBondContact O-N 3.35Å; S194-H197 PolarHBondContact O-ND1 2.89Å |
| 198 | L | 97.8 | Very high | 98.3 | Very high | 21 Ų | 21 | 61.8 Ų | 61.8 | 11% | 0.11 | 31% | 0.311 | C | S | . | . | trans | -119.3 | 165.9 | 169.3 | -68.7 | -178.4 | 0 | 0 | 0 | 109.9 | F166 L174 A193 I196 Q202 V203 | F166-L198 HydrophobicContact CD1-CD1 3.95Å; F166-L198 HydrophobicContact CD1-CD2 3.65Å; F166-L198 HydrophobicContact CD1-CG 4.5Å; F166-L198 HydrophobicContact CD2-CD1 4.38Å; F166-L198 HydrophobicContact CE1-CD1 3.96Å; F166-L198 HydrophobicContact CE1-CD2 3.63Å; F166-L198 HydrophobicContact CE1-CG 4.48Å; F166-L198 HydrophobicContact CE2-CD1 4.38Å; F166-L198 HydrophobicContact CG-CD1 4.19Å; F166-L198 HydrophobicContact CZ-CD1 4.19Å; L174-L198 HydrophobicContact CD1-CD1 4.12Å; A193-L198 CarbonylContact C-O 3.4Å; A193-L198 VanDerWaalsContact CB-O 3.29Å; A193-L198 WeakPolarHBondContact CB-O 3.17Å; A193-L198 PolarHBondContact O-N 3.22Å; A193-L198 VanDerWaalsContact O-O 3.1Å; I196-L198 VanDerWaalsContact C-N 3.33Å; I196-L198 HydrophobicContact CD1-CB 4.49Å; I196-L198 HydrophobicContact CD1-CD1 3.84Å; I196-L198 HydrophobicContact CD1-CG 4.32Å; I196-L198 HydrophobicContact CG1-CB 4.08Å; I196-L198 HydrophobicContact CG1-CD1 4.07Å; I196-L198 HydrophobicContact CG1-CG 3.99Å; I196-L198 PolarHBondContact O-N 3.4Å; L198-Q202 HydrophobicContact CB-CB 4.35Å; L198-V203 HydrophobicContact CB-CG2 4.3Å | ||
| 199 | T | 98.4 | Very high | 98.3 | Very high | 67 Ų | 67 | 63 Ų | 63 | 41% | 0.411 | 32% | 0.32 | S | S | . | . | trans | -79.1 | 150.7 | 170.2 | 60.7 | 0 | 0 | 0 | 0 | 111.3 | T201 Q202 V203 | T199-T201 PolarHBondContact O-N 2.83Å; T199-T201 VanDerWaalsContact O-N 3.11Å; T199-Q202 PolarHBondContact O-N 2.85Å; T199-Q202 WeakPolarHBondContact OG1-CB 3.43Å; T199-Q202 VanDerWaalsContact OG1-CG 3.31Å; T199-Q202 WeakPolarHBondContact OG1-CG 3.28Å; T199-Q202 PolarHBondContact OG1-N 2.85Å; T199-Q202 VanDerWaalsContact OG1-N 3.13Å; T199-Q202 PolarHBondContact OG1-OE1 3.32Å; T199-V203 PolarHBondContact O-N 3.02Å; T199-V203 VanDerWaalsContact O-N 3.11Å | ||
| 200 | P | 98.2 | Very high | 98.2 | Very high | 49 Ų | 49 | 61.8 Ų | 61.8 | 32% | 0.318 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -55.3 | -30.5 | 172.4 | -26.1 | 34.7 | 0 | 0 | 0 | 113 | R189 E190 A193 K204 | R189-P200 WeakPolarHBondContact CD-O 3.49Å; E190-P200 HydrophobicContact CG-CB 4.22Å; E190-P200 HydrophobicContact CG-CG 3.84Å; A193-P200 HydrophobicContact CB-CB 4.41Å; A193-P200 HydrophobicContact CB-CG 3.92Å; P200-K204 WeakPolarHBondContact O-CB 3.42Å; P200-K204 PolarHBondContact O-N 3.2Å |
| 201 | T | 98.3 | Very high | 98.2 | Very high | 87 Ų | 87 | 61 Ų | 61 | 53% | 0.534 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -67.6 | -42.6 | 174.4 | -59.3 | 0 | 0 | 0 | 0 | 112.6 | T199 K204 I205 | T199-T201 PolarHBondContact O-N 2.83Å; T199-T201 VanDerWaalsContact O-N 3.11Å; T201-K204 WeakPolarHBondContact O-CB 3.33Å; T201-K204 PolarHBondContact O-N 3.24Å; T201-I205 HydrophobicContact CG2-CD1 3.94Å; T201-I205 VanDerWaalsContact O-CG1 3.31Å; T201-I205 WeakPolarHBondContact O-CG1 3.05Å; T201-I205 PolarHBondContact O-N 3.34Å |
| 202 | Q | 98 | Very high | 98.1 | Very high | 67 Ų | 67 | 62.3 Ų | 62.3 | 31% | 0.313 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62.6 | -42.8 | 173.8 | -78.6 | 160.4 | -48.6 | 0 | 0 | 111.5 | F166 L198 T199 I205 W206 | F166-Q202 HydrophobicContact CE1-CB 4.32Å; F166-Q202 HydrophobicContact CE1-CG 4.26Å; F166-Q202 HydrophobicContact CZ-CB 3.93Å; F166-Q202 HydrophobicContact CZ-CG 4.14Å; L198-Q202 HydrophobicContact CB-CB 4.35Å; T199-Q202 PolarHBondContact O-N 2.85Å; T199-Q202 WeakPolarHBondContact OG1-CB 3.43Å; T199-Q202 VanDerWaalsContact OG1-CG 3.31Å; T199-Q202 WeakPolarHBondContact OG1-CG 3.28Å; T199-Q202 PolarHBondContact OG1-N 2.85Å; T199-Q202 VanDerWaalsContact OG1-N 3.13Å; T199-Q202 PolarHBondContact OG1-OE1 3.32Å; Q202-I205 PolarHBondContact O-N 3.32Å; Q202-W206 WeakPolarHBondContact O-CB 3.32Å; Q202-W206 PolarHBondContact O-N 3.23Å |
| 203 | V | 98.4 | Very high | 98 | Very high | 1 Ų | 1 | 66.6 Ų | 66.6 | 1% | 0.006 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.3 | -43.8 | 174.7 | -176.5 | 0 | 0 | 0 | 0 | 110.8 | L174 L184 R189 L192 A193 I196 L198 T199 I205 W206 F207 | L174-V203 HydrophobicContact CD2-CG1 4.03Å; L174-V203 HydrophobicContact CD2-CG2 4.35Å; L184-V203 HydrophobicContact CD1-CG1 4.24Å; R189-V203 HydrophobicContact CG-CB 3.8Å; R189-V203 HydrophobicContact CG-CG1 3.65Å; L192-V203 HydrophobicContact CD2-CG1 4.01Å; L192-V203 HydrophobicContact CG-CG1 4.49Å; A193-V203 HydrophobicContact CB-CG2 3.97Å; I196-V203 HydrophobicContact CD1-CG2 4.32Å; L198-V203 HydrophobicContact CB-CG2 4.3Å; T199-V203 PolarHBondContact O-N 3.02Å; T199-V203 VanDerWaalsContact O-N 3.11Å; V203-I205 PolarHBondContact O-N 3.31Å; V203-W206 PolarHBondContact O-N 2.97Å; V203-F207 HydrophobicContact CG1-CD2 3.75Å; V203-F207 HydrophobicContact CG1-CE2 3.87Å; V203-F207 WeakPolarHBondContact O-CB 3.31Å; V203-F207 WeakPolarHBondContact O-CD2 3.34Å; V203-F207 PolarHBondContact O-N 3.04Å |
| 204 | K | 98.3 | Very high | 97.8 | Very high | 120 Ų | 120 | 71.1 Ų | 71.1 | 52% | 0.522 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -56.9 | -47.6 | 175.6 | -177.3 | -179.4 | 177.3 | -179.8 | 0 | 111.9 | P200 T201 Q208 | P200-K204 WeakPolarHBondContact O-CB 3.42Å; P200-K204 PolarHBondContact O-N 3.2Å; T201-K204 WeakPolarHBondContact O-CB 3.33Å; T201-K204 PolarHBondContact O-N 3.24Å; K204-Q208 WeakPolarHBondContact O-CB 3.44Å; K204-Q208 PolarHBondContact O-N 3.5Å |
| 205 | I | 98.2 | Very high | 97.6 | Very high | 80 Ų | 80 | 73 Ų | 73 | 41% | 0.41 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -65.8 | -44.6 | 179.4 | -69.5 | 166.6 | 0 | 0 | 0 | 110.6 | T201 Q202 V203 Q208 N209 | T201-I205 HydrophobicContact CG2-CD1 3.94Å; T201-I205 VanDerWaalsContact O-CG1 3.31Å; T201-I205 WeakPolarHBondContact O-CG1 3.05Å; T201-I205 PolarHBondContact O-N 3.34Å; Q202-I205 PolarHBondContact O-N 3.32Å; V203-I205 PolarHBondContact O-N 3.31Å; I205-Q208 WeakPolarHBondContact O-CB 3.43Å; I205-Q208 PolarHBondContact O-N 3Å; I205-N209 WeakPolarHBondContact O-CB 3.29Å; I205-N209 VanDerWaalsContact O-CG 3.27Å; I205-N209 PolarHBondContact O-N 3.04Å |
| 206 | W | 98.1 | Very high | 97.4 | Very high | 33 Ų | 33 | 76.4 Ų | 76.4 | 13% | 0.125 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -63 | -46 | 178.1 | -171.2 | 101 | 0 | 0 | 0 | 111.6 | F166 L174 E175 F178 Q202 V203 Q208 N209 H210 | F166-W206 AromaticContact CD2-CD1 3.87Å; F166-W206 HydrophobicContact CE2-CB 4.29Å; F166-W206 AromaticContact CE2-CD1 3.78Å; F166-W206 HydrophobicContact CE2-CG 4.37Å; L174-W206 VanDerWaalsContact C-CH2 3.46Å; L174-W206 HydrophobicContact CB-CD2 3.94Å; L174-W206 HydrophobicContact CB-CE3 3.9Å; L174-W206 HydrophobicContact CB-CH2 3.65Å; L174-W206 HydrophobicContact CB-CZ2 3.68Å; L174-W206 HydrophobicContact CB-CZ3 3.78Å; L174-W206 HydrophobicContact CD1-CB 4.49Å; L174-W206 HydrophobicContact CD1-CD2 3.92Å; L174-W206 HydrophobicContact CD1-CG 3.88Å; L174-W206 HydrophobicContact CD2-CD2 4.33Å; L174-W206 HydrophobicContact CD2-CE3 4.18Å; L174-W206 HydrophobicContact CG-CD2 4.29Å; L174-W206 HydrophobicContact CG-CE3 4.44Å; E175-W206 HydrophobicContact CB-CH2 4.41Å; E175-W206 HydrophobicContact CG-CH2 3.65Å; E175-W206 HydrophobicContact CG-CZ2 3.67Å; F178-W206 HydrophobicContact CB-CH2 4.17Å; F178-W206 HydrophobicContact CB-CZ3 3.87Å; F178-W206 HydrophobicContact CD2-CZ3 4.49Å; F178-W206 HydrophobicContact CG-CZ3 4.2Å; Q202-W206 WeakPolarHBondContact O-CB 3.32Å; Q202-W206 PolarHBondContact O-N 3.23Å; V203-W206 PolarHBondContact O-N 2.97Å; W206-Q208 VanDerWaalsContact C-N 3.26Å; W206-Q208 PolarHBondContact O-N 3.39Å; W206-N209 PolarHBondContact O-N 2.9Å; W206-H210 HydrophobicContact CE3-CB 4.2Å; W206-H210 HydrophobicContact CH2-CB 4.28Å; W206-H210 AromaticContact CH2-CE1 3.77Å; W206-H210 AromaticContact CH2-CG 3.89Å; W206-H210 AromaticContact CH2-ND1 3.01Å; W206-H210 WeakPolarHBondContact CH2-ND1 3.31Å; W206-H210 AromaticContact CZ2-ND1 3.3Å; W206-H210 VanDerWaalsContact CZ2-ND1 3.3Å; W206-H210 WeakPolarHBondContact CZ2-ND1 3.5Å; W206-H210 HydrophobicContact CZ3-CB 3.99Å; W206-H210 AromaticContact CZ3-ND1 3.61Å; W206-H210 WeakPolarHBondContact O-CB 3.43Å; W206-H210 PolarHBondContact O-N 3.46Å |
| 207 | F | 98.6 | Very high | 97.1 | Very high | 7 Ų | 7 | 80.8 Ų | 80.8 | 3% | 0.031 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -65 | -27.7 | 176.2 | -90.6 | -107.7 | 0 | 0 | 0 | 112.8 | L174 R177 F178 Q181 L184 L192 V203 R211 | L174-F207 HydrophobicContact CD2-CD2 4.32Å; L174-F207 HydrophobicContact CD2-CE2 3.85Å; R177-F207 HydrophobicContact CB-CZ 4.28Å; F178-F207 HydrophobicContact CB-CE1 4.05Å; F178-F207 HydrophobicContact CB-CZ 4.07Å; F178-F207 AromaticContact CD2-CD1 3.74Å; F178-F207 HydrophobicContact CD2-CD1 3.74Å; F178-F207 AromaticContact CD2-CE1 3.73Å; F178-F207 HydrophobicContact CD2-CE1 3.73Å; F178-F207 HydrophobicContact CD2-CZ 4.49Å; F178-F207 HydrophobicContact CE2-CD1 4.45Å; F178-F207 HydrophobicContact CG-CE1 4.4Å; Q181-F207 WeakPolarHBondContact O-CE1 3.38Å; L184-F207 HydrophobicContact CD1-CD1 4.34Å; L184-F207 HydrophobicContact CD1-CD2 4.34Å; L184-F207 HydrophobicContact CD1-CE1 3.81Å; L184-F207 HydrophobicContact CD1-CE2 3.83Å; L184-F207 HydrophobicContact CD1-CZ 3.54Å; L184-F207 HydrophobicContact CD2-CE1 4.23Å; L184-F207 HydrophobicContact CD2-CZ 4.49Å; L184-F207 HydrophobicContact CG-CD1 4.05Å; L184-F207 HydrophobicContact CG-CE1 3.62Å; L184-F207 HydrophobicContact CG-CZ 3.91Å; L192-F207 HydrophobicContact CD2-CE2 3.97Å; L192-F207 HydrophobicContact CD2-CZ 4.2Å; V203-F207 HydrophobicContact CG1-CD2 3.75Å; V203-F207 HydrophobicContact CG1-CE2 3.87Å; V203-F207 WeakPolarHBondContact O-CB 3.31Å; V203-F207 WeakPolarHBondContact O-CD2 3.34Å; V203-F207 PolarHBondContact O-N 3.04Å; F207-R211 WeakPolarHBondContact O-CG 3.11Å; F207-R211 PolarHBondContact O-N 3.31Å; F207-R211 PolarHBondContact O-NE 3.3Å |
| 208 | Q | 98.3 | Very high | 96.6 | Very high | 82 Ų | 82 | 76 Ų | 76 | 38% | 0.383 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -71 | -53.1 | 170.3 | -171.5 | 168.3 | 27 | 0 | 0 | 110.7 | K204 I205 W206 H210 R211 Y212 | K204-Q208 WeakPolarHBondContact O-CB 3.44Å; K204-Q208 PolarHBondContact O-N 3.5Å; I205-Q208 WeakPolarHBondContact O-CB 3.43Å; I205-Q208 PolarHBondContact O-N 3Å; W206-Q208 VanDerWaalsContact C-N 3.26Å; W206-Q208 PolarHBondContact O-N 3.39Å; Q208-H210 VanDerWaalsContact C-N 3.32Å; Q208-H210 PolarHBondContact O-N 3.12Å; Q208-R211 PolarHBondContact O-N 3.13Å; Q208-Y212 HydrophobicContact CG-CD2 3.88Å; Q208-Y212 HydrophobicContact CG-CE2 3.77Å; Q208-Y212 WeakPolarHBondContact O-CD2 3.44Å; Q208-Y212 PolarHBondContact O-N 2.89Å |
| 209 | N | 97.9 | Very high | 96.2 | Very high | 97 Ų | 97 | 82.2 Ų | 82.2 | 52% | 0.519 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -59.4 | -39.1 | -179.6 | -70.7 | -13.6 | 0 | 0 | 0 | 112.4 | I205 W206 Y212 K213 | I205-N209 WeakPolarHBondContact O-CB 3.29Å; I205-N209 VanDerWaalsContact O-CG 3.27Å; I205-N209 PolarHBondContact O-N 3.04Å; W206-N209 PolarHBondContact O-N 2.9Å; N209-Y212 PolarHBondContact O-N 3.29Å; N209-K213 WeakPolarHBondContact O-CB 3.35Å; N209-K213 PolarHBondContact O-N 3.07Å |
| 210 | H | 97.8 | Very high | 95.6 | Very high | 24 Ų | 24 | 81.8 Ų | 81.8 | 11% | 0.111 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -65.1 | -43.1 | 177.5 | -154.4 | 122.3 | 0 | 0 | 0 | 111.9 | E175 F178 W206 Q208 Y212 K213 M214 | E175-H210 IonicContact OE1-CE1 3.47Å; E175-H210 PolarHBondContact OE1-CE1 2.81Å; F178-H210 AromaticContact CD1-CD2 3.6Å; F178-H210 AromaticContact CD1-CG 3.95Å; F178-H210 AromaticContact CD1-NE2 3.72Å; F178-H210 HydrophobicContact CE1-CB 4.5Å; F178-H210 AromaticContact CE1-CD2 3.17Å; F178-H210 WeakPolarHBondContact CE1-CD2 3.36Å; F178-H210 AromaticContact CE1-CG 3.84Å; F178-H210 AromaticContact CE1-NE2 3.59Å; F178-H210 HydrophobicContact CE2-CB 4.39Å; F178-H210 HydrophobicContact CZ-CB 4.33Å; F178-H210 AromaticContact CZ-CD2 3.68Å; W206-H210 HydrophobicContact CE3-CB 4.2Å; W206-H210 HydrophobicContact CH2-CB 4.28Å; W206-H210 AromaticContact CH2-CE1 3.77Å; W206-H210 AromaticContact CH2-CG 3.89Å; W206-H210 AromaticContact CH2-ND1 3.01Å; W206-H210 WeakPolarHBondContact CH2-ND1 3.31Å; W206-H210 AromaticContact CZ2-ND1 3.3Å; W206-H210 VanDerWaalsContact CZ2-ND1 3.3Å; W206-H210 WeakPolarHBondContact CZ2-ND1 3.5Å; W206-H210 HydrophobicContact CZ3-CB 3.99Å; W206-H210 AromaticContact CZ3-ND1 3.61Å; W206-H210 WeakPolarHBondContact O-CB 3.43Å; W206-H210 PolarHBondContact O-N 3.46Å; Q208-H210 VanDerWaalsContact C-N 3.32Å; Q208-H210 PolarHBondContact O-N 3.12Å; H210-Y212 PolarHBondContact O-N 3.1Å; H210-K213 WeakPolarHBondContact O-CB 3.26Å; H210-K213 PolarHBondContact O-N 2.98Å; H210-M214 PolarHBondContact O-N 3.33Å |
| 211 | R | 97.8 | Very high | 95 | Very high | 79 Ų | 79 | 86.3 Ų | 86.3 | 30% | 0.298 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.9 | -40.6 | 173.6 | -74.6 | 178.7 | -71.8 | 144.1 | -3.4 | 112.3 | F178 K182 F207 Q208 K215 | F178-R211 HydrophobicContact CE2-CG 3.8Å; F178-R211 HydrophobicContact CZ-CG 4.03Å; K182-R211 WeakPolarHBondContact O-CD 3.36Å; F207-R211 WeakPolarHBondContact O-CG 3.11Å; F207-R211 PolarHBondContact O-N 3.31Å; F207-R211 PolarHBondContact O-NE 3.3Å; Q208-R211 PolarHBondContact O-N 3.13Å; R211-K215 WeakPolarHBondContact O-CB 3.41Å; R211-K215 PolarHBondContact O-N 3.08Å |
| 212 | Y | 97.6 | Very high | 94.3 | Very high | 133 Ų | 133 | 84.8 Ų | 84.8 | 52% | 0.522 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -63.6 | -41.4 | 173.4 | -86.4 | -82.4 | 0 | 0 | 0 | 112 | Q208 N209 H210 K215 R216 | Q208-Y212 HydrophobicContact CG-CD2 3.88Å; Q208-Y212 HydrophobicContact CG-CE2 3.77Å; Q208-Y212 WeakPolarHBondContact O-CD2 3.44Å; Q208-Y212 PolarHBondContact O-N 2.89Å; N209-Y212 PolarHBondContact O-N 3.29Å; H210-Y212 PolarHBondContact O-N 3.1Å; Y212-K215 PolarHBondContact O-N 3.13Å; Y212-R216 VanDerWaalsContact O-CB 3.28Å; Y212-R216 WeakPolarHBondContact O-CB 3.43Å; Y212-R216 PolarHBondContact O-N 3.45Å |
| 213 | K | 95.8 | Very high | 93.6 | Very high | 95 Ų | 95 | 83.8 Ų | 83.8 | 41% | 0.413 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -57 | -51.6 | 175.4 | -172.5 | -178.9 | 70.6 | 174.2 | 0 | 111.4 | N209 H210 R216 Q217 | N209-K213 WeakPolarHBondContact O-CB 3.35Å; N209-K213 PolarHBondContact O-N 3.07Å; H210-K213 WeakPolarHBondContact O-CB 3.26Å; H210-K213 PolarHBondContact O-N 2.98Å; K213-R216 PolarHBondContact O-N 3.48Å; K213-Q217 WeakPolarHBondContact O-CG 3.17Å; K213-Q217 PolarHBondContact O-N 3Å |
| 214 | M | 93.5 | Very high | 92.7 | Very high | 95 Ų | 95 | 90.2 Ų | 90.2 | 47% | 0.468 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -59.8 | -49.1 | 177.1 | -72.8 | -171.1 | 75.6 | 0 | 0 | 112.3 | F178 H210 R216 Q217 A218 | F178-M214 HydrophobicContact CE1-SD 3.57Å; F178-M214 VanDerWaalsContact CE1-SD 3.57Å; F178-M214 HydrophobicContact CZ-SD 3.83Å; H210-M214 PolarHBondContact O-N 3.33Å; M214-R216 VanDerWaalsContact C-N 3.25Å; M214-R216 PolarHBondContact O-N 2.89Å; M214-Q217 PolarHBondContact O-N 3.48Å; M214-A218 PolarHBondContact O-N 2.89Å |
| 215 | K | 94.6 | Very high | 91.6 | Very high | 126 Ų | 126 | 91 Ų | 91 | 55% | 0.548 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.5 | -34.6 | 179.8 | -175.5 | 171.4 | 66.1 | 176.3 | 0 | 112.3 | R211 Y212 K219 | R211-K215 WeakPolarHBondContact O-CB 3.41Å; R211-K215 PolarHBondContact O-N 3.08Å; Y212-K215 PolarHBondContact O-N 3.13Å; K215-K219 PolarHBondContact O-N 3.11Å |
| 216 | R | 94.4 | Very high | 90.3 | Very high | 161 Ų | 161 | 94 Ų | 94 | 61% | 0.608 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -70.3 | -48.8 | 176.7 | -174.4 | 67.8 | -149 | -157.2 | 10.7 | 111.2 | Y212 K213 M214 A218 K219 D220 | Y212-R216 VanDerWaalsContact O-CB 3.28Å; Y212-R216 WeakPolarHBondContact O-CB 3.43Å; Y212-R216 PolarHBondContact O-N 3.45Å; K213-R216 PolarHBondContact O-N 3.48Å; M214-R216 VanDerWaalsContact C-N 3.25Å; M214-R216 PolarHBondContact O-N 2.89Å; R216-A218 VanDerWaalsContact C-N 3.28Å; R216-A218 PolarHBondContact O-N 2.89Å; R216-K219 PolarHBondContact O-N 3Å; R216-K219 VanDerWaalsContact O-N 3.07Å; R216-D220 WeakPolarHBondContact CG-OD2 3.32Å; R216-D220 IonicContact CZ-OD1 3.8Å; R216-D220 IonicContact CZ-OD2 2.91Å; R216-D220 VanDerWaalsContact NE-CG 3.31Å; R216-D220 IonicContact NE-OD1 3.64Å; R216-D220 PolarHBondContact NE-OD1 3.29Å; R216-D220 IonicContact NE-OD2 2.68Å; R216-D220 PolarHBondContact NE-OD2 3.33Å; R216-D220 IonicContact NH2-OD1 3.18Å; R216-D220 PolarHBondContact NH2-OD1 3.44Å; R216-D220 IonicContact NH2-OD2 3.8Å; R216-D220 PolarHBondContact O-N 2.91Å |
| 217 | Q | 90.9 | Very high | 88.9 | Confident | 107 Ų | 107 | 98.6 Ų | 98.6 | 50% | 0.5 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -57.9 | -37.1 | 177 | -73.5 | 175.5 | -15.5 | 0 | 0 | 113.2 | K213 M214 K221 | K213-Q217 WeakPolarHBondContact O-CG 3.17Å; K213-Q217 PolarHBondContact O-N 3Å; M214-Q217 PolarHBondContact O-N 3.48Å; Q217-K221 WeakPolarHBondContact O-CB 3.34Å; Q217-K221 WeakPolarHBondContact O-CG 3.26Å; Q217-K221 PolarHBondContact O-N 3.11Å; Q217-K221 VanDerWaalsContact O-N 3.08Å |
| 218 | A | 88 | Confident | 87.1 | Confident | 65 Ų | 65 | 105.2 Ų | 105.2 | 54% | 0.537 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.7 | -42.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | M214 R216 A222 | M214-A218 PolarHBondContact O-N 2.89Å; R216-A218 VanDerWaalsContact C-N 3.28Å; R216-A218 PolarHBondContact O-N 2.89Å; A218-A222 PolarHBondContact O-N 3.37Å |
| 219 | K | 88.5 | Confident | 85.1 | Confident | 151 Ų | 151 | 108.6 Ų | 108.6 | 66% | 0.657 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -69.9 | -42.1 | 177.3 | -70.6 | -161.4 | 171.6 | -148.7 | 0 | 112.8 | K215 R216 K221 A222 A223 | K215-K219 PolarHBondContact O-N 3.11Å; R216-K219 PolarHBondContact O-N 3Å; R216-K219 VanDerWaalsContact O-N 3.07Å; K219-K221 VanDerWaalsContact C-N 3.31Å; K219-K221 PolarHBondContact O-N 2.88Å; K219-A222 PolarHBondContact O-N 2.84Å; K219-A223 PolarHBondContact O-N 3.24Å |
| 220 | D | 86.4 | Confident | 83.1 | Confident | 58 Ų | 58 | 111 Ų | 111 | 31% | 0.31 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -67.5 | -33.5 | -178.3 | -64.7 | -25.6 | 0 | 0 | 0 | 111.7 | R216 Q224 | R216-D220 WeakPolarHBondContact CG-OD2 3.32Å; R216-D220 IonicContact CZ-OD1 3.8Å; R216-D220 IonicContact CZ-OD2 2.91Å; R216-D220 VanDerWaalsContact NE-CG 3.31Å; R216-D220 IonicContact NE-OD1 3.64Å; R216-D220 PolarHBondContact NE-OD1 3.29Å; R216-D220 IonicContact NE-OD2 2.68Å; R216-D220 PolarHBondContact NE-OD2 3.33Å; R216-D220 IonicContact NH2-OD1 3.18Å; R216-D220 PolarHBondContact NH2-OD1 3.44Å; R216-D220 IonicContact NH2-OD2 3.8Å; R216-D220 PolarHBondContact O-N 2.91Å; D220-Q224 WeakPolarHBondContact O-CG 3.35Å; D220-Q224 PolarHBondContact O-N 2.87Å |
| 221 | K | 85.1 | Confident | 81 | Confident | 145 Ų | 145 | 114.8 Ų | 114.8 | 63% | 0.63 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -64.3 | -44.6 | 170.9 | -79 | -173.2 | 172.9 | -164.7 | 0 | 113.1 | Q217 K219 A223 Q224 Q225 | Q217-K221 WeakPolarHBondContact O-CB 3.34Å; Q217-K221 WeakPolarHBondContact O-CG 3.26Å; Q217-K221 PolarHBondContact O-N 3.11Å; Q217-K221 VanDerWaalsContact O-N 3.08Å; K219-K221 VanDerWaalsContact C-N 3.31Å; K219-K221 PolarHBondContact O-N 2.88Å; K221-A223 VanDerWaalsContact C-N 3.33Å; K221-A223 PolarHBondContact O-N 3.49Å; K221-Q224 PolarHBondContact O-N 2.94Å; K221-Q225 PolarHBondContact O-N 3Å |
| 222 | A | 83.2 | Confident | 78.5 | Confident | 55 Ų | 55 | 113.9 Ų | 113.9 | 46% | 0.455 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -62.3 | -41.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | A218 K219 Q224 Q225 Q226 | A218-A222 PolarHBondContact O-N 3.37Å; K219-A222 PolarHBondContact O-N 2.84Å; A222-Q224 PolarHBondContact O-N 2.9Å; A222-Q225 PolarHBondContact O-N 3.27Å; A222-Q226 PolarHBondContact O-N 3.29Å; A222-Q226 VanDerWaalsContact O-N 3.15Å |
| 223 | A | 83.8 | Confident | 75.8 | Confident | 45 Ų | 45 | 111.3 Ų | 111.3 | 37% | 0.372 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -62.1 | -41.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | K219 K221 Q225 Q226 L227 | K219-A223 PolarHBondContact O-N 3.24Å; K221-A223 VanDerWaalsContact C-N 3.33Å; K221-A223 PolarHBondContact O-N 3.49Å; A223-Q225 PolarHBondContact O-N 3.36Å; A223-Q226 PolarHBondContact O-N 2.79Å; A223-L227 VanDerWaalsContact O-CD1 3.22Å; A223-L227 WeakPolarHBondContact O-CD1 3.35Å; A223-L227 PolarHBondContact O-N 3.05Å; A223-L227 VanDerWaalsContact O-N 3.16Å |
| 224 | Q | 79.8 | Confident | 73.2 | Confident | 137 Ų | 137 | 110.6 Ų | 110.6 | 64% | 0.64 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -64 | -38.6 | 176.5 | -76.9 | 177.1 | -18 | 0 | 0 | 112.7 | D220 K221 A222 Q226 L227 Q228 | D220-Q224 WeakPolarHBondContact O-CG 3.35Å; D220-Q224 PolarHBondContact O-N 2.87Å; K221-Q224 PolarHBondContact O-N 2.94Å; A222-Q224 PolarHBondContact O-N 2.9Å; Q224-Q226 VanDerWaalsContact C-N 3.34Å; Q224-Q226 PolarHBondContact O-N 3.26Å; Q224-L227 PolarHBondContact O-N 3.04Å; Q224-Q228 PolarHBondContact O-N 2.93Å; Q224-Q228 VanDerWaalsContact O-N 3.12Å |
| 225 | Q | 76.3 | Confident | 70.7 | Confident | 135 Ų | 135 | 110 Ų | 110 | 63% | 0.631 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -63.5 | -38.8 | 175 | -73.1 | 175.6 | -30.2 | 0 | 0 | 112.2 | K221 A222 A223 Q228 Q229 | K221-Q225 PolarHBondContact O-N 3Å; A222-Q225 PolarHBondContact O-N 3.27Å; A223-Q225 PolarHBondContact O-N 3.36Å; Q225-Q228 WeakPolarHBondContact O-CB 3.1Å; Q225-Q228 PolarHBondContact O-N 2.75Å; Q225-Q229 PolarHBondContact O-N 2.95Å |
| 226 | Q | 69.8 | Low | 67.9 | Low | 144 Ų | 144 | 108 Ų | 108 | 67% | 0.673 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -65.2 | -41.5 | 177.3 | -169.1 | 174.4 | -2.4 | 0 | 0 | 112.3 | A222 A223 Q224 Q228 Q229 | A222-Q226 PolarHBondContact O-N 3.29Å; A222-Q226 VanDerWaalsContact O-N 3.15Å; A223-Q226 PolarHBondContact O-N 2.79Å; Q224-Q226 VanDerWaalsContact C-N 3.34Å; Q224-Q226 PolarHBondContact O-N 3.26Å; Q226-Q228 VanDerWaalsContact C-N 3.27Å; Q226-Q228 PolarHBondContact O-N 3.18Å; Q226-Q229 PolarHBondContact O-N 2.87Å |
| 227 | L | 68.5 | Low | 65.1 | Low | 129 Ų | 129 | 104 Ų | 104 | 68% | 0.675 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -67.7 | -25.7 | 174.3 | -87.3 | 78.6 | 0 | 0 | 0 | 113 | A223 Q224 | A223-L227 VanDerWaalsContact O-CD1 3.22Å; A223-L227 WeakPolarHBondContact O-CD1 3.35Å; A223-L227 PolarHBondContact O-N 3.05Å; A223-L227 VanDerWaalsContact O-N 3.16Å; Q224-L227 PolarHBondContact O-N 3.04Å |
| 228 | Q | 61.3 | Low | 62.4 | Low | 147 Ų | 147 | 103.1 Ų | 103.1 | 69% | 0.687 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -73.5 | -32.9 | 179.5 | -154.7 | 78.7 | 84.8 | 0 | 0 | 112.3 | Q224 Q225 Q226 G232 | Q224-Q228 PolarHBondContact O-N 2.93Å; Q224-Q228 VanDerWaalsContact O-N 3.12Å; Q225-Q228 WeakPolarHBondContact O-CB 3.1Å; Q225-Q228 PolarHBondContact O-N 2.75Å; Q226-Q228 VanDerWaalsContact C-N 3.27Å; Q226-Q228 PolarHBondContact O-N 3.18Å; Q228-G232 PolarHBondContact O-N 2.58Å |
| 229 | Q | 57 | Low | 59.9 | Low | 152 Ų | 152 | 103.7 Ų | 103.7 | 71% | 0.71 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -72.9 | -37.8 | -179.3 | -71 | -179.8 | -8.7 | 0 | 0 | 112.6 | Q225 Q226 S231 G232 | Q225-Q229 PolarHBondContact O-N 2.95Å; Q226-Q229 PolarHBondContact O-N 2.87Å; Q229-S231 PolarHBondContact O-N 3.29Å; Q229-S231 VanDerWaalsContact O-N 3.17Å; Q229-G232 PolarHBondContact O-N 3.4Å |
| 230 | D | 54.4 | Low | 57.4 | Low | 148 Ų | 148 | 100.4 Ų | 100.4 | 79% | 0.791 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -60.6 | -23.7 | 176.8 | -168.2 | 64 | 0 | 0 | 0 | 113.2 | ||
| 231 | S | 55.1 | Low | 55 | Low | 103 Ų | 103 | 102.9 Ų | 102.9 | 72% | 0.72 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.2 | 6.8 | 175.9 | -59.9 | 0 | 0 | 0 | 0 | 114.4 | Q229 | Q229-S231 PolarHBondContact O-N 3.29Å; Q229-S231 VanDerWaalsContact O-N 3.17Å |
| 232 | G | 43.7 | Very low | 52.5 | Low | 60 Ų | 60 | 99.7 Ų | 99.7 | 62% | 0.619 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.1 | -8.6 | -176 | 0 | 0 | 0 | 0 | 0 | 115.8 | Q228 Q229 G234 | Q228-G232 PolarHBondContact O-N 2.58Å; Q229-G232 PolarHBondContact O-N 3.4Å; G232-G234 PolarHBondContact O-N 3Å |
| 233 | G | 42.7 | Very low | 50.2 | Low | 79 Ų | 79 | 103 Ų | 103 | 81% | 0.814 | 75% | 0.751 | S | S | * | * | trans | -77.3 | 42.2 | -171.7 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 234 | G | 41 | Very low | 48.7 | Very low | 81 Ų | 81 | 106.3 Ų | 106.3 | 84% | 0.835 | 77% | 0.769 | S | S | * | * | trans | -93.6 | 92.9 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | G232 | G232-G234 PolarHBondContact O-N 3Š| ||
| 235 | G | 39.5 | Very low | 46.6 | Very low | 81 Ų | 81 | 106.7 Ų | 106.7 | 84% | 0.835 | 77% | 0.771 | S | S | * | * | trans | 136.9 | 101.5 | 164.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 236 | G | 36.3 | Very low | 44.6 | Very low | 85 Ų | 85 | 107.4 Ų | 107.4 | 88% | 0.876 | 77% | 0.774 | S | S | * | * | trans | -164 | -0.7 | -174.7 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 237 | G | 35.5 | Very low | 43.1 | Very low | 78 Ų | 78 | 106.5 Ų | 106.5 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | trans | 93.7 | 114.4 | 164.7 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 238 | G | 34.8 | Very low | 41.7 | Very low | 87 Ų | 87 | 108.4 Ų | 108.4 | 90% | 0.897 | 78% | 0.775 | S | S | * | * | trans | 82.6 | 122.4 | 154.5 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 239 | G | 34.8 | Very low | 41.2 | Very low | 78 Ų | 78 | 106.2 Ų | 106.2 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | cis | 171.5 | 132.3 | -9.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 240 | G | 37.1 | Very low | 40.5 | Very low | 82 Ų | 82 | 107.9 Ų | 107.9 | 85% | 0.845 | 79% | 0.79 | S | S | * | * | trans | 79.6 | 144.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 241 | A | 35.8 | Very low | 40.4 | Very low | 110 Ų | 110 | 110.4 Ų | 110.4 | 91% | 0.909 | 80% | 0.797 | S | S | * | * | cis | -158 | 148.6 | -14.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 242 | G | 32.3 | Very low | 39.6 | Very low | 77 Ų | 77 | 113.6 Ų | 113.6 | 79% | 0.794 | 80% | 0.801 | S | S | * | * | trans | 149.8 | 86.5 | 173 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 243 | C | 33.8 | Very low | 39.4 | Very low | 125 Ų | 125 | 115.6 Ų | 115.6 | 85% | 0.845 | 81% | 0.805 | S | S | * | * | trans | -133.9 | 154.3 | 160 | -60.4 | 0 | 0 | 0 | 0 | 106 | ||||
| 244 | P | 53.3 | Low | 39.9 | Very low | 115 Ų | 115 | 117.5 Ų | 117.5 | 75% | 0.747 | 80% | 0.804 | S | S | * | * | cis | -112.4 | -168.1 | 33.9 | 12.4 | 13.6 | 0 | 0 | 0 | 112.2 | ||||
| 245 | Q | 35 | Very low | 40 | Very low | 145 Ų | 145 | 124.5 Ų | 124.5 | 68% | 0.678 | 81% | 0.805 | S | S | * | * | cis | -161.6 | 124.3 | 37.5 | -175.9 | 77.9 | 21 | 0 | 0 | 111.8 | ||||
| 246 | Q | 35.5 | Very low | 40.3 | Very low | 150 Ų | 150 | 132.3 Ų | 132.3 | 70% | 0.701 | 81% | 0.809 | S | S | * | * | trans | 44.9 | 125.2 | 136.7 | -139 | -174.6 | -2.7 | 0 | 0 | 121.3 | ||||
| 247 | Q | 38 | Very low | 40.8 | Very low | 124 Ų | 124 | 134.3 Ų | 134.3 | 58% | 0.579 | 80% | 0.804 | S | S | * | * | 159.6 | 127.1 | 108.3 | -167.3 | 69.4 | -0.6 | 0 | 0 | 113.7 | |||||
| 248 | Q | 39.3 | Very low | 41.2 | Very low | 169 Ų | 169 | 135 Ų | 135 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | 53.1 | 128.1 | 158.8 | -73.4 | 163.9 | -16.9 | 0 | 0 | 121.9 | ||||
| 249 | A | 49.7 | Very low | 41.3 | Very low | 102 Ų | 102 | 136.4 Ų | 136.4 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | trans | -88.9 | 129 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 250 | Q | 42.5 | Very low | 42.3 | Very low | 187 Ų | 187 | 137.7 Ų | 137.7 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | trans | -141.1 | 152 | 159.6 | -95 | -172.3 | -2.6 | 0 | 0 | 110.6 | Q252 | Q250-Q252 PolarHBondContact O-N 3.22Š| ||
| 251 | Q | 51.7 | Low | 42.9 | Very low | 200 Ų | 200 | 139.8 Ų | 139.8 | 94% | 0.935 | 78% | 0.783 | S | S | * | * | trans | -67.2 | 119.3 | -171 | -60.8 | 167.5 | 4.4 | 0 | 0 | 111.3 | S253 | Q251-S253 PolarHBondContact O-N 2.84Š| ||
| 252 | Q | 39.6 | Very low | 43.8 | Very low | 171 Ų | 171 | 141.9 Ų | 141.9 | 80% | 0.799 | 78% | 0.778 | S | S | * | * | trans | -92.9 | 105.8 | 177.4 | -68.7 | -150.8 | -8.2 | 0 | 0 | 113 | Q250 | Q250-Q252 PolarHBondContact O-N 3.22Š| ||
| 253 | S | 39.6 | Very low | 45 | Very low | 101 Ų | 101 | 144.6 Ų | 144.6 | 71% | 0.706 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 160.8 | 160 | -157.7 | 0 | 0 | 0 | 0 | 111 | Q251 R255 | Q251-S253 PolarHBondContact O-N 2.84Å; S253-R255 PolarHBondContact O-N 3.18Å |
| 254 | P | 51.7 | Low | 45.5 | Very low | 120 Ų | 120 | 147 Ų | 147 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -54.5 | 132.8 | -167.2 | -30 | 37.3 | 0 | 0 | 0 | 115.6 | R256 | P254-R256 PolarHBondContact O-N 3.41Š|
| 255 | R | 45 | Very low | 44.9 | Very low | 227 Ų | 227 | 148.2 Ų | 148.2 | 86% | 0.857 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 120.2 | -174.2 | -62.3 | -178.2 | 179.5 | -142.9 | 1.9 | 112.3 | S253 | S253-R255 PolarHBondContact O-N 3.18Š|
| 256 | R | 45.3 | Very low | 44.9 | Very low | 245 Ų | 245 | 145.2 Ų | 145.2 | 93% | 0.925 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 129.4 | 161.2 | -83.6 | -172.8 | 172.1 | -107.7 | 2.2 | 109.7 | P254 A258 | P254-R256 PolarHBondContact O-N 3.41Å; R256-A258 PolarHBondContact O-N 3.22Å |
| 257 | V | 45.9 | Very low | 45.1 | Very low | 127 Ų | 127 | 147.9 Ų | 147.9 | 77% | 0.77 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 119.7 | 168.2 | 177.5 | 0 | 0 | 0 | 0 | 108.5 | V259 | V257-V259 HydrophobicContact CG1-CG2 4.33Š|
| 258 | A | 43.8 | Very low | 45.4 | Very low | 94 Ų | 94 | 147.5 Ų | 147.5 | 78% | 0.777 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 120.2 | 165.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | R256 P260 | R256-A258 PolarHBondContact O-N 3.22Å; A258-P260 WeakPolarHBondContact O-CD 3.35Å |
| 259 | V | 37.8 | Very low | 45.1 | Very low | 116 Ų | 116 | 145.7 Ų | 145.7 | 70% | 0.703 | 81% | 0.806 | S | S | * | * | trans | -95.4 | 113.6 | 173.8 | 178.9 | 0 | 0 | 0 | 0 | 107.8 | V257 V261 | V257-V259 HydrophobicContact CG1-CG2 4.33Å; V259-V261 PolarHBondContact O-N 3.16Å | ||
| 260 | P | 54.7 | Low | 44.6 | Very low | 105 Ų | 105 | 150.2 Ų | 150.2 | 68% | 0.682 | 81% | 0.81 | S | S | * | * | trans | -68.6 | 119.6 | 174.1 | 27.7 | -32.5 | 0 | 0 | 0 | 109.5 | A258 L262 | A258-P260 WeakPolarHBondContact O-CD 3.35Å; P260-L262 PolarHBondContact O-N 2.94Å | ||
| 261 | V | 49.8 | Very low | 44.1 | Very low | 125 Ų | 125 | 146.5 Ų | 146.5 | 76% | 0.758 | 81% | 0.81 | S | S | * | * | trans | -77.9 | 102.7 | 174.5 | 179.3 | 0 | 0 | 0 | 0 | 108.4 | V259 V263 | V259-V261 PolarHBondContact O-N 3.16Å; V261-V263 VanDerWaalsContact C-N 3.35Å; V261-V263 HydrophobicContact CG1-CG2 4.21Å; V261-V263 PolarHBondContact O-N 3.07Å | ||
| 262 | L | 54.5 | Low | 43.3 | Very low | 154 Ų | 154 | 141 Ų | 141 | 81% | 0.806 | 81% | 0.808 | S | S | * | * | trans | -69.3 | 93.7 | 166.6 | -88.3 | 71.7 | 0 | 0 | 0 | 109 | P260 | P260-L262 PolarHBondContact O-N 2.94Š| ||
| 263 | V | 57.8 | Low | 43.4 | Very low | 134 Ų | 134 | 137.4 Ų | 137.4 | 81% | 0.812 | 81% | 0.808 | S | S | * | * | trans | -68.7 | 127.1 | 160 | 178.5 | 0 | 0 | 0 | 0 | 107.4 | V261 | V261-V263 VanDerWaalsContact C-N 3.35Å; V261-V263 HydrophobicContact CG1-CG2 4.21Å; V261-V263 PolarHBondContact O-N 3.07Å | ||
| 264 | K | 45.5 | Very low | 43.7 | Very low | 175 Ų | 175 | 138.1 Ų | 138.1 | 76% | 0.761 | 81% | 0.809 | S | S | * | * | trans | -103.9 | 122.4 | -171.3 | -173.4 | 175.9 | 179.3 | 179.3 | 0 | 112.1 | ||||
| 265 | D | 41 | Very low | 43.2 | Very low | 141 Ų | 141 | 136.7 Ų | 136.7 | 75% | 0.754 | 81% | 0.808 | S | S | * | * | trans | 44 | 100.3 | 158.2 | -62.3 | -59.8 | 0 | 0 | 0 | 118.8 | ||||
| 266 | G | 34.9 | Very low | 43.2 | Very low | 82 Ų | 82 | 132.3 Ų | 132.3 | 85% | 0.845 | 81% | 0.809 | S | S | * | * | trans | -127 | 122.7 | 153.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 267 | K | 39.8 | Very low | 42.6 | Very low | 207 Ų | 207 | 124.5 Ų | 124.5 | 90% | 0.9 | 80% | 0.804 | S | S | * | * | trans | -84.4 | 159.1 | -173.7 | -98.5 | -176.4 | 175.2 | 179.6 | 0 | 113.2 | ||||
| 268 | P | 44.4 | Very low | 42 | Very low | 115 Ų | 115 | 123.1 Ų | 123.1 | 75% | 0.747 | 81% | 0.806 | S | S | * | * | trans | -91.3 | 168.1 | -159.2 | 36.7 | -38.6 | 0 | 0 | 0 | 114.9 | ||||
| 269 | C | 32 | Very low | 41.5 | Very low | 132 Ų | 132 | 123.3 Ų | 123.3 | 89% | 0.892 | 81% | 0.808 | S | S | * | * | trans | -125.5 | 132.8 | 162.9 | -55.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 270 | Q | 39.3 | Very low | 41.2 | Very low | 197 Ų | 197 | 122.7 Ų | 122.7 | 92% | 0.921 | 81% | 0.809 | S | S | * | * | trans | -101.6 | 144.6 | 171.9 | -71.2 | -174.1 | 3 | 0 | 0 | 110.7 | ||||
| 271 | A | 32.8 | Very low | 40.6 | Very low | 108 Ų | 108 | 125.1 Ų | 125.1 | 89% | 0.893 | 82% | 0.815 | S | S | * | * | trans | -155.8 | 134.6 | 156 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 272 | G | 34.6 | Very low | 39.8 | Very low | 86 Ų | 86 | 128 Ų | 128 | 89% | 0.887 | 82% | 0.821 | S | S | * | * | trans | 115.7 | 112.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 273 | A | 41.3 | Very low | 38.6 | Very low | 95 Ų | 95 | 123.6 Ų | 123.6 | 79% | 0.785 | 81% | 0.812 | S | S | * | * | trans | -131.3 | -176.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 274 | P | 46.7 | Very low | 37.7 | Very low | 115 Ų | 115 | 126.8 Ų | 126.8 | 75% | 0.747 | 82% | 0.817 | S | S | * | * | cis | -139.6 | 166.5 | 0.2 | 41.8 | -24.5 | 0 | 0 | 0 | 117.2 | ||||
| 275 | A | 40.8 | Very low | 37.2 | Very low | 91 Ų | 91 | 122.4 Ų | 122.4 | 75% | 0.752 | 81% | 0.814 | S | S | * | * | trans | 67.3 | 173.7 | 146 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 276 | P | 44.3 | Very low | 36.8 | Very low | 135 Ų | 135 | 124.6 Ų | 124.6 | 88% | 0.877 | 82% | 0.82 | S | S | * | * | -132.1 | 158 | -67.7 | 38.4 | -25.3 | 0 | 0 | 0 | 114.4 | |||||
| 277 | G | 32.8 | Very low | 37.1 | Very low | 80 Ų | 80 | 128.8 Ų | 128.8 | 83% | 0.825 | 82% | 0.818 | S | S | * | * | trans | -150.2 | 134.4 | 172 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 278 | A | 32.8 | Very low | 37.2 | Very low | 98 Ų | 98 | 125.5 Ų | 125.5 | 81% | 0.81 | 81% | 0.805 | S | S | * | * | trans | -87.4 | 156.7 | -164.7 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 279 | A | 34 | Very low | 36.8 | Very low | 99 Ų | 99 | 124.6 Ų | 124.6 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | trans | 62.2 | 153.5 | 130.3 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 280 | S | 30.8 | Very low | 37.2 | Very low | 103 Ų | 103 | 126.7 Ų | 126.7 | 72% | 0.72 | 81% | 0.805 | S | S | * | * | cis | -168.7 | 177.9 | -19.1 | -173.5 | 0 | 0 | 0 | 0 | 108 | ||||
| 281 | L | 42 | Very low | 37.6 | Very low | 155 Ų | 155 | 126.8 Ų | 126.8 | 81% | 0.812 | 81% | 0.805 | S | S | * | * | trans | 68.2 | 126 | 170.5 | -57.3 | 153.6 | 0 | 0 | 0 | 114.9 | ||||
| 282 | Q | 33.2 | Very low | 37.8 | Very low | 187 Ų | 187 | 130.4 Ų | 130.4 | 87% | 0.874 | 80% | 0.803 | S | S | * | * | cis | 81.6 | 114.4 | 20.5 | -162.6 | 175.6 | -20.5 | 0 | 0 | 116.4 | ||||
| 283 | G | 29.1 | Very low | 37.9 | Very low | 60 Ų | 60 | 130.4 Ų | 130.4 | 62% | 0.619 | 80% | 0.795 | S | S | * | * | trans | 92.8 | 119.9 | 161 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 284 | H | 40.3 | Very low | 37.9 | Very low | 201 Ų | 201 | 135.2 Ų | 135.2 | 93% | 0.931 | 80% | 0.801 | S | S | * | * | -161 | 154.2 | 92.5 | -94.5 | 77.6 | 0 | 0 | 0 | 109.5 | |||||
| 285 | A | 33.5 | Very low | 37.5 | Very low | 84 Ų | 84 | 134.8 Ų | 134.8 | 69% | 0.694 | 81% | 0.807 | S | S | * | * | trans | -128 | 159.3 | -178.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 286 | Q | 33.9 | Very low | 37.3 | Very low | 186 Ų | 186 | 134.8 Ų | 134.8 | 87% | 0.869 | 81% | 0.808 | S | S | * | * | trans | 56.7 | 103.6 | 143.8 | -177.3 | -176 | -21.1 | 0 | 0 | 117.8 | ||||
| 287 | Q | 41.7 | Very low | 37 | Very low | 171 Ų | 171 | 138 Ų | 138 | 80% | 0.799 | 81% | 0.811 | S | S | * | * | trans | -147.6 | 158.3 | 141.6 | -133.1 | 174.7 | -41.4 | 0 | 0 | 114.3 | ||||
| 288 | Q | 40.8 | Very low | 37.1 | Very low | 137 Ų | 137 | 138.8 Ų | 138.8 | 64% | 0.64 | 81% | 0.81 | S | S | * | * | trans | -26.1 | 147.5 | -177.4 | -70.1 | 138.2 | -29.2 | 0 | 0 | 118 | ||||
| 289 | A | 36 | Very low | 37.1 | Very low | 97 Ų | 97 | 138.9 Ų | 138.9 | 80% | 0.802 | 81% | 0.81 | S | S | * | * | cis | 67.5 | 63.3 | 17.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 290 | Q | 41.4 | Very low | 37 | Very low | 176 Ų | 176 | 138.8 Ų | 138.8 | 82% | 0.822 | 81% | 0.809 | S | S | * | * | trans | -167.4 | 112.8 | 154.5 | -117.1 | 174.3 | -5.8 | 0 | 0 | 113.4 | ||||
| 291 | Q | 46 | Very low | 37.1 | Very low | 198 Ų | 198 | 138.8 Ų | 138.8 | 93% | 0.925 | 82% | 0.816 | S | S | * | * | trans | -168.7 | 142.7 | 136.4 | -151.1 | 95.7 | 81.1 | 0 | 0 | 108.7 | ||||
| 292 | Q | 38.8 | Very low | 36.7 | Very low | 184 Ų | 184 | 135.9 Ų | 135.9 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | trans | -146.5 | 150.3 | 177.3 | -172.8 | -179.5 | 4.3 | 0 | 0 | 110.3 | ||||
| 293 | A | 36.7 | Very low | 36.6 | Very low | 86 Ų | 86 | 134.9 Ų | 134.9 | 71% | 0.711 | 81% | 0.813 | S | S | * | * | trans | 65.6 | 125 | 166.1 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 294 | Q | 39.7 | Very low | 36.9 | Very low | 196 Ų | 196 | 136.9 Ų | 136.9 | 92% | 0.916 | 82% | 0.817 | S | S | * | * | -164.5 | 168.3 | 125.7 | -107.3 | 169.2 | 26.3 | 0 | 0 | 111.1 | |||||
| 295 | A | 38.3 | Very low | 36.6 | Very low | 106 Ų | 106 | 133.8 Ų | 133.8 | 88% | 0.876 | 81% | 0.812 | S | S | * | * | trans | 63.6 | 87.9 | 169.3 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 296 | A | 36.9 | Very low | 36.5 | Very low | 92 Ų | 92 | 133 Ų | 133 | 76% | 0.76 | 81% | 0.813 | S | S | * | * | trans | -138.1 | 116.2 | 144 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 297 | Q | 37.9 | Very low | 36.5 | Very low | 203 Ų | 203 | 130.3 Ų | 130.3 | 95% | 0.949 | 82% | 0.815 | S | S | * | * | trans | -179.5 | 117.3 | 164.2 | -106.3 | 157.9 | 43 | 0 | 0 | 113 | ||||
| 298 | A | 35.5 | Very low | 36.1 | Very low | 96 Ų | 96 | 126 Ų | 126 | 79% | 0.793 | 82% | 0.815 | S | S | * | * | trans | 160.7 | 118.5 | 159.9 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 299 | A | 32.6 | Very low | 35.6 | Very low | 100 Ų | 100 | 123.5 Ų | 123.5 | 83% | 0.826 | 83% | 0.826 | S | S | * | * | cis | 67.8 | 130.7 | 16.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 300 | A | 31.4 | Very low | 35.8 | Very low | 96 Ų | 96 | 124.3 Ų | 124.3 | 79% | 0.793 | 83% | 0.833 | S | S | * | * | cis | -165.6 | -178.8 | -12.6 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 301 | A | 33.4 | Very low | 35.4 | Very low | 104 Ų | 104 | 119.7 Ų | 119.7 | 86% | 0.86 | 83% | 0.833 | S | S | * | * | trans | 75.1 | 156.2 | 172 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 302 | A | 32.6 | Very low | 35.2 | Very low | 94 Ų | 94 | 119.2 Ų | 119.2 | 78% | 0.777 | 84% | 0.836 | S | S | * | * | cis | -145.3 | 178.9 | 9.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 303 | I | 31.7 | Very low | 35 | Very low | 166 Ų | 166 | 114.4 Ų | 114.4 | 85% | 0.851 | 84% | 0.836 | S | S | * | * | trans | -147.3 | 166.6 | 179.1 | 47.9 | 168.2 | 0 | 0 | 0 | 109 | ||||
| 304 | S | 35.2 | Very low | 34.9 | Very low | 101 Ų | 101 | 114.5 Ų | 114.5 | 71% | 0.706 | 84% | 0.836 | S | S | * | * | cis | -143.5 | -163.1 | 10 | -137.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 305 | V | 35.1 | Very low | 34.8 | Very low | 136 Ų | 136 | 113.2 Ų | 113.2 | 82% | 0.824 | 83% | 0.83 | S | S | * | * | cis | -132.2 | -148.2 | 16.3 | -138.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 306 | G | 30.5 | Very low | 35.6 | Very low | 69 Ų | 69 | 114.2 Ų | 114.2 | 71% | 0.711 | 83% | 0.827 | S | S | * | * | cis | 102.3 | 149.6 | 11.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 307 | S | 34.1 | Very low | 35.5 | Very low | 129 Ų | 129 | 112.8 Ų | 112.8 | 90% | 0.902 | 82% | 0.822 | S | S | * | * | cis | -169.2 | 156.9 | -2.2 | -168.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 308 | G | 32.5 | Very low | 35.3 | Very low | 79 Ų | 79 | 112.9 Ų | 112.9 | 81% | 0.814 | 82% | 0.822 | S | S | * | * | trans | 80.1 | 161.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 309 | G | 31.9 | Very low | 35.4 | Very low | 85 Ų | 85 | 116.8 Ų | 116.8 | 88% | 0.876 | 82% | 0.824 | S | S | * | * | cis | -169.5 | 159.9 | -3.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 310 | A | 39.9 | Very low | 36.4 | Very low | 114 Ų | 114 | 118 Ų | 118 | 94% | 0.942 | 82% | 0.823 | S | S | * | * | trans | -92 | 159.2 | -172.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 311 | G | 33.1 | Very low | 36.5 | Very low | 79 Ų | 79 | 116.2 Ų | 116.2 | 81% | 0.814 | 81% | 0.814 | S | S | * | * | trans | -156.7 | 134.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 312 | L | 41.6 | Very low | 36.8 | Very low | 189 Ų | 189 | 117.5 Ų | 117.5 | 99% | 0.99 | 82% | 0.817 | S | S | * | * | trans | -106.9 | 152.3 | 175.2 | -65.2 | 164.6 | 0 | 0 | 0 | 109.4 | ||||
| 313 | G | 33.5 | Very low | 37 | Very low | 83 Ų | 83 | 117.9 Ų | 117.9 | 86% | 0.856 | 82% | 0.82 | S | S | * | * | trans | -172 | 155.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 314 | A | 35.6 | Very low | 37.1 | Very low | 88 Ų | 88 | 113.4 Ų | 113.4 | 73% | 0.727 | 82% | 0.815 | S | S | * | * | trans | -129.9 | 172 | -169.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 315 | H | 38.4 | Very low | 37.1 | Very low | 168 Ų | 168 | 117.9 Ų | 117.9 | 78% | 0.778 | 82% | 0.824 | S | S | * | * | trans | -55.7 | 173.9 | 165.8 | 46.3 | -115.7 | 0 | 0 | 0 | 113.3 | ||||
| 316 | P | 55.1 | Low | 37.2 | Very low | 127 Ų | 127 | 116.8 Ų | 116.8 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | cis | -141.6 | -171.9 | 15.9 | 43.9 | -25.4 | 0 | 0 | 0 | 116.6 | ||||
| 317 | G | 33.6 | Very low | 38.6 | Very low | 63 Ų | 63 | 118.9 Ų | 118.9 | 65% | 0.649 | 82% | 0.824 | S | S | * | * | trans | 149.7 | 108.1 | 143.8 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 318 | H | 34.5 | Very low | 38.7 | Very low | 205 Ų | 205 | 119 Ų | 119 | 95% | 0.949 | 82% | 0.815 | S | S | * | * | trans | 76.6 | 160 | 140.9 | -76.7 | 87.6 | 0 | 0 | 0 | 124.4 | ||||
| 319 | Q | 37.9 | Very low | 39 | Very low | 178 Ų | 178 | 122.5 Ų | 122.5 | 83% | 0.832 | 81% | 0.814 | S | S | * | * | trans | -127.5 | -163.8 | -166.6 | -134.7 | -168.3 | 18.7 | 0 | 0 | 108.6 | ||||
| 320 | P | 53.8 | Low | 39.3 | Very low | 125 Ų | 125 | 121.6 Ų | 121.6 | 81% | 0.812 | 80% | 0.798 | S | S | * | * | cis | -148.3 | -172.1 | 33.5 | 43.3 | -20.6 | 0 | 0 | 0 | 118 | ||||
| 321 | G | 32.8 | Very low | 39.4 | Very low | 59 Ų | 59 | 124.5 Ų | 124.5 | 61% | 0.608 | 79% | 0.792 | S | S | * | * | trans | 130.9 | 96.9 | 164.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 322 | S | 38.5 | Very low | 39.9 | Very low | 131 Ų | 131 | 130.4 Ų | 130.4 | 92% | 0.916 | 80% | 0.798 | S | S | * | * | 80.4 | 131 | 80.2 | -70.1 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 323 | A | 37.2 | Very low | 39.8 | Very low | 101 Ų | 101 | 126.1 Ų | 126.1 | 84% | 0.835 | 79% | 0.79 | S | S | * | * | cis | -163.6 | 159.6 | -1 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 324 | G | 34.1 | Very low | 39.8 | Very low | 72 Ų | 72 | 127.2 Ų | 127.2 | 74% | 0.742 | 79% | 0.791 | S | S | * | * | trans | 80.6 | 152.7 | 151.2 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 325 | Q | 36.2 | Very low | 39.8 | Very low | 195 Ų | 195 | 129 Ų | 129 | 91% | 0.911 | 80% | 0.798 | S | S | * | * | cis | -147.2 | 167.1 | -6.8 | -65.1 | -177.7 | 4.4 | 0 | 0 | 110.7 | ||||
| 326 | S | 36.4 | Very low | 41.2 | Very low | 114 Ų | 114 | 126.8 Ų | 126.8 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | trans | -127.4 | -177.1 | -177.8 | -54.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 327 | P | 59.8 | Low | 40.3 | Very low | 113 Ų | 113 | 125.5 Ų | 125.5 | 73% | 0.734 | 80% | 0.799 | S | S | * | * | cis | -115.8 | -133.7 | 1.2 | 27.7 | -1.8 | 0 | 0 | 0 | 111.3 | ||||
| 328 | D | 36.4 | Very low | 40.4 | Very low | 131 Ų | 131 | 126.6 Ų | 126.6 | 70% | 0.701 | 80% | 0.802 | S | S | * | * | cis | -163.1 | -172.7 | 6.8 | -140.9 | 177 | 0 | 0 | 0 | 108.5 | ||||
| 329 | L | 39.6 | Very low | 40.5 | Very low | 152 Ų | 152 | 124.7 Ų | 124.7 | 80% | 0.796 | 80% | 0.798 | S | S | * | * | cis | -149.3 | -163.7 | 10.4 | -174.2 | 40.9 | 0 | 0 | 0 | 110.6 | ||||
| 330 | A | 37.4 | Very low | 40.7 | Very low | 67 Ų | 67 | 125.9 Ų | 125.9 | 55% | 0.554 | 80% | 0.803 | S | S | * | * | trans | -95.5 | 149.3 | -164.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 331 | H | 42.7 | Very low | 39.8 | Very low | 174 Ų | 174 | 123.1 Ų | 123.1 | 81% | 0.806 | 80% | 0.797 | S | S | * | * | trans | 31.2 | 140 | 133.3 | -58.5 | 90.6 | 0 | 0 | 0 | 123 | ||||
| 332 | H | 42.9 | Very low | 40 | Very low | 203 Ų | 203 | 129.8 Ų | 129.8 | 94% | 0.94 | 81% | 0.812 | S | S | * | * | -160.3 | 161 | 121.9 | -102.7 | -71.1 | 0 | 0 | 0 | 111 | |||||
| 333 | A | 38.4 | Very low | 39.8 | Very low | 100 Ų | 100 | 130.2 Ų | 130.2 | 83% | 0.826 | 81% | 0.809 | S | S | * | * | trans | -143 | 151.3 | -175.5 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 334 | A | 34.7 | Very low | 40 | Very low | 106 Ų | 106 | 130.8 Ų | 130.8 | 88% | 0.876 | 81% | 0.807 | S | S | * | * | trans | -160.2 | 164.9 | 168 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 335 | S | 35.8 | Very low | 40 | Very low | 124 Ų | 124 | 132.8 Ų | 132.8 | 87% | 0.867 | 81% | 0.81 | S | S | * | * | trans | -130.2 | 173.6 | -170.6 | -116 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 336 | P | 68.4 | Low | 40 | Very low | 123 Ų | 123 | 131.9 Ų | 131.9 | 80% | 0.799 | 81% | 0.81 | S | S | * | * | trans | -105.7 | 169.6 | -152.3 | 40.5 | -39.2 | 0 | 0 | 0 | 117.8 | ||||
| 337 | A | 35.6 | Very low | 40.2 | Very low | 100 Ų | 100 | 130.4 Ų | 130.4 | 83% | 0.826 | 80% | 0.8 | S | S | * | * | trans | -163.1 | 159.7 | 164 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 338 | A | 35.6 | Very low | 39.1 | Very low | 86 Ų | 86 | 133.1 Ų | 133.1 | 71% | 0.711 | 80% | 0.803 | S | S | * | * | cis | -167.7 | 160.9 | -25.9 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 339 | L | 36.4 | Very low | 39.3 | Very low | 165 Ų | 165 | 134.5 Ų | 134.5 | 86% | 0.864 | 81% | 0.809 | S | S | * | * | trans | 46.3 | 113.5 | 151.1 | -74.7 | 164.8 | 0 | 0 | 0 | 122.6 | ||||
| 340 | Q | 41.2 | Very low | 39.1 | Very low | 203 Ų | 203 | 134 Ų | 134 | 95% | 0.949 | 81% | 0.807 | S | S | * | * | 174.7 | 144.7 | 124.2 | -96.2 | 170.7 | 9.8 | 0 | 0 | 109.2 | |||||
| 341 | G | 34.9 | Very low | 38.8 | Very low | 66 Ų | 66 | 136.5 Ų | 136.5 | 68% | 0.68 | 82% | 0.821 | S | S | * | * | cis | -179.1 | 171.6 | -7.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 342 | Q | 38.2 | Very low | 38.5 | Very low | 199 Ų | 199 | 133.5 Ų | 133.5 | 93% | 0.93 | 82% | 0.819 | S | S | * | * | trans | 72 | 114.7 | 173.7 | -53.1 | -156.2 | -70.8 | 0 | 0 | 119.5 | ||||
| 343 | V | 34.7 | Very low | 38.1 | Very low | 140 Ų | 140 | 127.6 Ų | 127.6 | 85% | 0.848 | 81% | 0.813 | S | S | * | * | trans | -116.8 | 147.1 | 153.7 | -69.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 344 | S | 39.6 | Very low | 38.2 | Very low | 113 Ų | 113 | 128.3 Ų | 128.3 | 79% | 0.79 | 81% | 0.812 | S | S | * | * | trans | -158.7 | 98.9 | 167 | -73.2 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 345 | S | 35.5 | Very low | 38.1 | Very low | 115 Ų | 115 | 130.1 Ų | 130.1 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | 71.6 | 91.5 | 70.8 | -165.7 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 346 | L | 36.6 | Very low | 38.1 | Very low | 176 Ų | 176 | 134.7 Ų | 134.7 | 92% | 0.921 | 81% | 0.807 | S | S | * | * | trans | -155.1 | 145 | 145.1 | -140.4 | 76.9 | 0 | 0 | 0 | 109.1 | ||||
| 347 | S | 38.7 | Very low | 36.4 | Very low | 83 Ų | 83 | 132.6 Ų | 132.6 | 58% | 0.58 | 81% | 0.808 | S | S | * | * | trans | -142.3 | 168.6 | -178.6 | 53.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 348 | H | 37.8 | Very low | 36.7 | Very low | 170 Ų | 170 | 131.9 Ų | 131.9 | 79% | 0.787 | 80% | 0.801 | S | S | * | * | trans | 70.1 | 148.1 | -176.6 | -38.5 | -75.3 | 0 | 0 | 0 | 112.9 | ||||
| 349 | L | 40.2 | Very low | 36.9 | Very low | 160 Ų | 160 | 136.5 Ų | 136.5 | 84% | 0.838 | 81% | 0.81 | S | S | * | * | cis | -120.8 | 138.9 | 12.2 | -59.4 | 149 | 0 | 0 | 0 | 108.9 | ||||
| 350 | N | 35.4 | Very low | 36.9 | Very low | 141 Ų | 141 | 132.9 Ų | 132.9 | 75% | 0.754 | 80% | 0.799 | S | S | * | * | 40.2 | 107.4 | 78.9 | -167.4 | 29.2 | 0 | 0 | 0 | 116.5 | |||||
| 351 | S | 31.6 | Very low | 36.7 | Very low | 120 Ų | 120 | 129.3 Ų | 129.3 | 84% | 0.839 | 80% | 0.795 | S | S | * | * | trans | -158.1 | 145.1 | 144.6 | -161.7 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 352 | S | 36.6 | Very low | 36.8 | Very low | 111 Ų | 111 | 131.4 Ų | 131.4 | 78% | 0.776 | 80% | 0.8 | S | S | * | * | trans | -105.8 | 154.5 | -173.5 | -56.5 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 353 | G | 34 | Very low | 36.8 | Very low | 78 Ų | 78 | 127.4 Ų | 127.4 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | trans | -178.6 | 106.9 | 170.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 354 | S | 39.7 | Very low | 37.2 | Very low | 116 Ų | 116 | 128.5 Ų | 128.5 | 81% | 0.811 | 79% | 0.789 | S | S | * | * | trans | -67.8 | 164.3 | 166 | -44.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 355 | D | 33.6 | Very low | 37.2 | Very low | 144 Ų | 144 | 131.7 Ų | 131.7 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | -166.7 | -163.4 | 60.6 | -152.7 | -103.7 | 0 | 0 | 0 | 114.8 | |||||
| 356 | Y | 35.8 | Very low | 37.7 | Very low | 220 Ų | 220 | 134.7 Ų | 134.7 | 86% | 0.863 | 79% | 0.791 | S | S | * | * | trans | -77.2 | 154.4 | -169.1 | -82.5 | -113.6 | 0 | 0 | 0 | 114.2 | ||||
| 357 | G | 33.2 | Very low | 37.3 | Very low | 79 Ų | 79 | 129.7 Ų | 129.7 | 81% | 0.814 | 78% | 0.783 | S | S | * | * | trans | -162.8 | 27 | -179.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 358 | A | 41.3 | Very low | 37.8 | Very low | 84 Ų | 84 | 135 Ų | 135 | 69% | 0.694 | 79% | 0.79 | S | S | * | * | trans | -78.3 | 121.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 359 | M | 39.3 | Very low | 37.8 | Very low | 183 Ų | 183 | 133 Ų | 133 | 90% | 0.901 | 79% | 0.789 | S | S | * | * | trans | -160.3 | 144.6 | 154.3 | -103.1 | -45 | 115.9 | 0 | 0 | 115 | ||||
| 360 | S | 36.9 | Very low | 38 | Very low | 89 Ų | 89 | 138.6 Ų | 138.6 | 62% | 0.622 | 80% | 0.8 | S | S | * | * | trans | 56.4 | 92.7 | 157.1 | -159.5 | 0 | 0 | 0 | 0 | 120.6 | S362 | S360-S362 PolarHBondContact O-N 3.14Å; S360-S362 PolarHBondContact OG-OG 3.47Å | ||
| 361 | C | 36.8 | Very low | 38.2 | Very low | 128 Ų | 128 | 138.5 Ų | 138.5 | 87% | 0.865 | 80% | 0.802 | S | S | * | * | trans | -69.4 | 99.3 | 152.1 | -68 | 0 | 0 | 0 | 0 | 110.6 | T363 | C361-T363 PolarHBondContact O-N 3.29Š| ||
| 362 | S | 36.3 | Very low | 38.5 | Very low | 111 Ų | 111 | 139.5 Ų | 139.5 | 78% | 0.776 | 80% | 0.8 | S | S | * | * | trans | -90 | 96.7 | 173 | -69.9 | 0 | 0 | 0 | 0 | 111.2 | S360 | S360-S362 PolarHBondContact O-N 3.14Å; S360-S362 PolarHBondContact OG-OG 3.47Å | ||
| 363 | T | 38.6 | Very low | 38.6 | Very low | 115 Ų | 115 | 141.1 Ų | 141.1 | 71% | 0.706 | 80% | 0.802 | S | S | * | * | trans | -89.4 | 148 | 178.4 | -34.3 | 0 | 0 | 0 | 0 | 110.6 | C361 | C361-T363 PolarHBondContact O-N 3.29Š| ||
| 364 | L | 44.6 | Very low | 38.9 | Very low | 163 Ų | 163 | 144.8 Ų | 144.8 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | trans | 66.5 | 108.8 | 170.1 | -53.2 | 173.3 | 0 | 0 | 0 | 117.1 | ||||
| 365 | L | 39.4 | Very low | 38.9 | Very low | 179 Ų | 179 | 146.6 Ų | 146.6 | 94% | 0.937 | 80% | 0.801 | S | S | * | * | -147.2 | 159.1 | 116.6 | -111.6 | 174.7 | 0 | 0 | 0 | 111.1 | |||||
| 366 | Y | 44.5 | Very low | 39.2 | Very low | 178 Ų | 178 | 146.7 Ų | 146.7 | 70% | 0.698 | 80% | 0.803 | S | S | * | * | trans | -103.8 | 89.8 | -151.6 | -171.2 | -99.9 | 0 | 0 | 0 | 112.8 | R368 | Y366-R368 PolarHBondContact OH-NH1 3.06Š| ||
| 367 | G | 28.3 | Very low | 39.4 | Very low | 72 Ų | 72 | 141.5 Ų | 141.5 | 74% | 0.742 | 80% | 0.799 | S | S | * | * | trans | -104.6 | 76.5 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | T369 | G367-T369 PolarHBondContact O-N 3.19Š| ||
| 368 | R | 49 | Very low | 39.9 | Very low | 193 Ų | 193 | 146.3 Ų | 146.3 | 73% | 0.728 | 80% | 0.797 | S | S | * | * | trans | -85.2 | 97 | 177.2 | -94.3 | 177.4 | 154.2 | 165.8 | -11 | 112.5 | Y366 | Y366-R368 PolarHBondContact OH-NH1 3.06Š| ||
| 369 | T | 37.7 | Very low | 39.8 | Very low | 128 Ų | 128 | 151.5 Ų | 151.5 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | trans | -130.7 | 74.9 | 174.3 | 45.4 | 0 | 0 | 0 | 0 | 114.1 | G367 | G367-T369 PolarHBondContact O-N 3.19Š| ||
| 370 | W | 46.3 | Very low | 39.9 | Very low | 279 Ų | 279 | 148.6 Ų | 148.6 | 100% | 1.057 | 80% | 0.797 | S | S | * | * | trans | 48.7 | 0 | 151.5 | -62.9 | 101.6 | 0 | 0 | 0 | 120.4 |
Retrieved 370 of 370 residues in 40.8 ms
(Link to these results)