| 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 | 57.2 | Low | 60.8 | Low | 196 Ų | 196 | 127.8 Ų | 127.8 | 97% | 0.966 | 64% | 0.635 | S | S | * | * | 0 | -67.5 | 0 | -122.2 | 77.6 | 92.7 | 0 | 0 | 112.8 | M3 F4 | M1-M3 PolarHBondContact O-N 3Å; M1-M3 VanDerWaalsContact O-N 3.11Å; M1-F4 PolarHBondContact O-N 3.33Å | |||
| 2 | N | 57.1 | Low | 60.1 | Low | 122 Ų | 122 | 129.5 Ų | 129.5 | 65% | 0.652 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -59 | -34.4 | -154.4 | -57 | 27.3 | 0 | 0 | 0 | 116.3 | F4 L5 L6 | N2-F4 VanDerWaalsContact C-N 3.26Å; N2-F4 PolarHBondContact O-N 2.74Å; N2-L5 PolarHBondContact O-N 3.12Å; N2-L6 PolarHBondContact O-N 2.82Å; N2-L6 VanDerWaalsContact O-N 3.09Å |
| 3 | M | 59.3 | Low | 59.6 | Low | 149 Ų | 149 | 130.2 Ų | 130.2 | 73% | 0.734 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -61.8 | -32.8 | -177.9 | -163.7 | 177.4 | 83.5 | 0 | 0 | 113.1 | M1 L7 | M1-M3 PolarHBondContact O-N 3Å; M1-M3 VanDerWaalsContact O-N 3.11Å; M3-L7 WeakPolarHBondContact O-CG 3.44Å; M3-L7 PolarHBondContact O-N 3.31Å |
| 4 | F | 67.3 | Low | 58.8 | Low | 151 Ų | 151 | 125.6 Ų | 125.6 | 66% | 0.662 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -74.5 | -35.3 | 179.2 | -149.7 | -89.4 | 0 | 0 | 0 | 111.9 | M1 N2 L7 M8 | M1-F4 PolarHBondContact O-N 3.33Å; N2-F4 VanDerWaalsContact C-N 3.26Å; N2-F4 PolarHBondContact O-N 2.74Å; F4-L7 PolarHBondContact O-N 2.93Å; F4-M8 HydrophobicContact CD1-CG 4.37Å; F4-M8 HydrophobicContact CE1-CE 4.3Å; F4-M8 WeakPolarHBondContact O-CG 3.44Å; F4-M8 PolarHBondContact O-N 3.27Å; F4-M8 VanDerWaalsContact O-N 3.15Å |
| 5 | L | 67.5 | Low | 58.4 | Low | 112 Ų | 112 | 125.3 Ų | 125.3 | 59% | 0.586 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -65.5 | -41.7 | 173.9 | -69.1 | 169.5 | 0 | 0 | 0 | 111.5 | N2 L7 M8 S9 | N2-L5 PolarHBondContact O-N 3.12Å; L5-L7 VanDerWaalsContact C-N 3.34Å; L5-L7 PolarHBondContact O-N 2.98Å; L5-M8 PolarHBondContact O-N 3Å; L5-S9 PolarHBondContact O-N 3.43Å; L5-S9 PolarHBondContact O-OG 3.2Å |
| 6 | L | 66 | Low | 57.7 | Low | 111 Ų | 111 | 123.4 Ų | 123.4 | 58% | 0.581 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -59.8 | -41.9 | 175.3 | -74.7 | 166.6 | 0 | 0 | 0 | 112.4 | N2 S9 L10 | N2-L6 PolarHBondContact O-N 2.82Å; N2-L6 VanDerWaalsContact O-N 3.09Å; L6-S9 PolarHBondContact O-N 2.87Å; L6-L10 WeakPolarHBondContact O-CG 3.31Å; L6-L10 PolarHBondContact O-N 3.19Å |
| 7 | L | 59.2 | Low | 57.4 | Low | 95 Ų | 95 | 131.4 Ų | 131.4 | 50% | 0.497 | 69% | 0.692 | S | S | . | * | H | α-helix | trans | -65.1 | -38.1 | 176.7 | -72.4 | 167 | 0 | 0 | 0 | 112.6 | M3 F4 L5 Y11 | M3-L7 WeakPolarHBondContact O-CG 3.44Å; M3-L7 PolarHBondContact O-N 3.31Å; F4-L7 PolarHBondContact O-N 2.93Å; L5-L7 VanDerWaalsContact C-N 3.34Å; L5-L7 PolarHBondContact O-N 2.98Å; L7-Y11 PolarHBondContact O-N 3.4Å |
| 8 | M | 63.4 | Low | 56.2 | Low | 98 Ų | 98 | 128 Ų | 128 | 48% | 0.483 | 69% | 0.694 | S | S | . | * | H | α-helix | trans | -67.7 | -42.3 | 174.6 | -65.3 | -63.7 | 98.1 | 0 | 0 | 112.1 | F4 L5 L10 Y11 L12 | F4-M8 HydrophobicContact CD1-CG 4.37Å; F4-M8 HydrophobicContact CE1-CE 4.3Å; F4-M8 WeakPolarHBondContact O-CG 3.44Å; F4-M8 PolarHBondContact O-N 3.27Å; F4-M8 VanDerWaalsContact O-N 3.15Å; L5-M8 PolarHBondContact O-N 3Å; M8-L10 PolarHBondContact O-N 3.13Å; M8-Y11 PolarHBondContact O-N 2.74Å; M8-L12 PolarHBondContact O-N 2.88Å |
| 9 | S | 54.7 | Low | 55.1 | Low | 68 Ų | 68 | 128.7 Ų | 128.7 | 48% | 0.476 | 70% | 0.703 | S | S | . | * | H | α-helix | trans | -63.4 | -39.8 | 177.7 | -63.7 | 0 | 0 | 0 | 0 | 112.9 | L5 L6 Y11 L12 | L5-S9 PolarHBondContact O-N 3.43Å; L5-S9 PolarHBondContact O-OG 3.2Å; L6-S9 PolarHBondContact O-N 2.87Å; S9-Y11 VanDerWaalsContact C-N 3.33Å; S9-Y11 PolarHBondContact O-N 3.01Å; S9-L12 PolarHBondContact O-N 3.32Å |
| 10 | L | 55.8 | Low | 54.4 | Low | 121 Ų | 121 | 128.8 Ų | 128.8 | 63% | 0.634 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -65.4 | -35.6 | 176.5 | -74.7 | 166.5 | 0 | 0 | 0 | 112.3 | L6 M8 L12 L13 | L6-L10 WeakPolarHBondContact O-CG 3.31Å; L6-L10 PolarHBondContact O-N 3.19Å; M8-L10 PolarHBondContact O-N 3.13Å; L10-L12 VanDerWaalsContact C-N 3.29Å; L10-L12 PolarHBondContact O-N 3.29Å; L10-L13 PolarHBondContact O-N 3.08Å |
| 11 | Y | 60.8 | Low | 53.5 | Low | 183 Ų | 183 | 125.9 Ų | 125.9 | 72% | 0.718 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -67.5 | -29 | 178.1 | -159.2 | -96.5 | 0 | 0 | 0 | 112.8 | L7 M8 S9 | L7-Y11 PolarHBondContact O-N 3.4Å; M8-Y11 PolarHBondContact O-N 2.74Å; S9-Y11 VanDerWaalsContact C-N 3.33Å; S9-Y11 PolarHBondContact O-N 3.01Å |
| 12 | L | 53.5 | Low | 52.4 | Low | 148 Ų | 148 | 124.4 Ų | 124.4 | 78% | 0.775 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -81.2 | -15.9 | 179.5 | -67.6 | 172.3 | 0 | 0 | 0 | 114.3 | M8 S9 L10 | M8-L12 PolarHBondContact O-N 2.88Å; S9-L12 PolarHBondContact O-N 3.32Å; L10-L12 VanDerWaalsContact C-N 3.29Å; L10-L12 PolarHBondContact O-N 3.29Å |
| 13 | L | 53.2 | Low | 51.2 | Low | 139 Ų | 139 | 124 Ų | 124 | 73% | 0.728 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | -1.5 | 179.9 | -73.5 | 163.7 | 0 | 0 | 0 | 113.7 | L10 S15 | L10-L13 PolarHBondContact O-N 3.08Å; L13-S15 PolarHBondContact O-N 3.11Å |
| 14 | G | 47.6 | Very low | 50.1 | Low | 65 Ų | 65 | 123.4 Ų | 123.4 | 67% | 0.67 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -79.5 | 1.3 | -168.7 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||
| 15 | S | 53.8 | Low | 48.5 | Very low | 122 Ų | 122 | 125.9 Ų | 125.9 | 85% | 0.853 | 72% | 0.724 | S | S | * | * | trans | -133.3 | 54.3 | -166.4 | -57.7 | 0 | 0 | 0 | 0 | 114.7 | L13 | L13-S15 PolarHBondContact O-N 3.11Š| ||
| 16 | A | 47.5 | Very low | 46.9 | Very low | 94 Ų | 94 | 125.3 Ų | 125.3 | 78% | 0.777 | 73% | 0.729 | S | S | * | * | trans | -142.4 | 59.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 17 | R | 51.7 | Low | 45.3 | Very low | 260 Ų | 260 | 125.8 Ų | 125.8 | 98% | 0.981 | 74% | 0.742 | S | S | * | * | trans | -137.9 | 84.7 | 164.1 | -85 | -167.9 | 163.7 | 136.4 | -1.5 | 111.3 | ||||
| 18 | G | 35.7 | Very low | 43.9 | Very low | 70 Ų | 70 | 125.3 Ų | 125.3 | 72% | 0.722 | 76% | 0.76 | S | S | * | * | trans | -119.9 | 113.5 | 170 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 19 | T | 36.6 | Very low | 42.6 | Very low | 141 Ų | 141 | 125.7 Ų | 125.7 | 87% | 0.865 | 77% | 0.773 | S | S | * | * | trans | 8.9 | 109.3 | 160.6 | 53.3 | 0 | 0 | 0 | 0 | 118.4 | G21 | T19-G21 PolarHBondContact O-N 3.34Š| ||
| 20 | S | 40.8 | Very low | 42 | Very low | 130 Ų | 130 | 130.2 Ų | 130.2 | 91% | 0.909 | 79% | 0.79 | S | S | * | * | trans | -77.1 | 101.4 | 149 | -174.2 | 0 | 0 | 0 | 0 | 108 | ||||
| 21 | G | 34.2 | Very low | 41.1 | Very low | 69 Ų | 69 | 131.2 Ų | 131.2 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | -116.7 | 101.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | T19 | T19-G21 PolarHBondContact O-N 3.34Š| ||
| 22 | Q | 35.3 | Very low | 40 | Very low | 164 Ų | 164 | 131.6 Ų | 131.6 | 77% | 0.766 | 80% | 0.804 | S | S | * | * | trans | -85 | 132.2 | -178.2 | -176 | 172.1 | -4.2 | 0 | 0 | 110.2 | D24 | Q22-D24 WeakPolarHBondContact CG-OD2 3.43Å; Q22-D24 PolarHBondContact NE2-OD2 2.87Å | ||
| 23 | S | 31.7 | Very low | 39.2 | Very low | 115 Ų | 115 | 132.5 Ų | 132.5 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -144.7 | 83.5 | 172.5 | 60 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 24 | D | 36.8 | Very low | 38.1 | Very low | 135 Ų | 135 | 131.6 Ų | 131.6 | 72% | 0.722 | 80% | 0.804 | S | S | * | * | trans | -77.4 | 111.5 | 165.1 | -69.7 | -82.9 | 0 | 0 | 0 | 109.2 | Q22 | Q22-D24 WeakPolarHBondContact CG-OD2 3.43Å; Q22-D24 PolarHBondContact NE2-OD2 2.87Å | ||
| 25 | E | 32.3 | Very low | 37.3 | Very low | 203 Ų | 203 | 133 Ų | 133 | 95% | 0.949 | 80% | 0.804 | S | S | * | * | trans | -143.4 | 159.5 | 154.6 | -148.3 | 171.3 | 93.6 | 0 | 0 | 109.9 | ||||
| 26 | S | 34 | Very low | 36.3 | Very low | 100 Ų | 100 | 132.6 Ų | 132.6 | 70% | 0.699 | 80% | 0.796 | S | S | * | * | trans | -138.4 | 151.6 | -145.7 | -179.4 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 27 | S | 33.6 | Very low | 35.6 | Very low | 122 Ų | 122 | 136.1 Ų | 136.1 | 85% | 0.853 | 80% | 0.796 | S | S | * | * | trans | 73.4 | 130.5 | 159.2 | -58.1 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 28 | G | 29.1 | Very low | 34.8 | Very low | 84 Ų | 84 | 131.2 Ų | 131.2 | 87% | 0.866 | 78% | 0.784 | S | S | * | * | trans | 171.3 | 51 | -180 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 29 | S | 36.7 | Very low | 34.6 | Very low | 107 Ų | 107 | 135 Ų | 135 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | trans | -91.9 | 134.6 | 172.5 | -179.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 30 | I | 40.6 | Very low | 34.6 | Very low | 163 Ų | 163 | 134.6 Ų | 134.6 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | trans | -177.7 | 138.1 | 146.2 | -99.4 | 153.7 | 0 | 0 | 0 | 110.1 | ||||
| 31 | D | 38.2 | Very low | 34.1 | Very low | 142 Ų | 142 | 131.7 Ų | 131.7 | 76% | 0.759 | 78% | 0.781 | S | S | * | * | trans | -74.8 | 144.6 | 174.9 | -51.1 | -102.3 | 0 | 0 | 0 | 113.3 | ||||
| 32 | H | 37.4 | Very low | 34.1 | Very low | 191 Ų | 191 | 137 Ų | 137 | 88% | 0.884 | 79% | 0.787 | S | S | * | * | trans | -150.6 | 149.7 | 138.8 | -123.2 | 63 | 0 | 0 | 0 | 114.7 | ||||
| 33 | Q | 37.1 | Very low | 34 | Very low | 166 Ų | 166 | 138.1 Ų | 138.1 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | -131.2 | 139.9 | -174.5 | -172.7 | -172.9 | -3.5 | 0 | 0 | 109.2 | ||||
| 34 | T | 29.9 | Very low | 34.1 | Very low | 121 Ų | 121 | 140.9 Ų | 140.9 | 74% | 0.742 | 79% | 0.788 | S | S | * | * | trans | 71.2 | 132 | 175.7 | -11.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 35 | S | 30.7 | Very low | 33.9 | Very low | 95 Ų | 95 | 139.6 Ų | 139.6 | 66% | 0.664 | 79% | 0.789 | S | S | * | * | -177 | 130.7 | 52.6 | -167.1 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 36 | V | 33.3 | Very low | 33.9 | Very low | 112 Ų | 112 | 137 Ų | 137 | 68% | 0.679 | 78% | 0.781 | S | S | * | * | trans | 65.8 | 141.6 | 138.9 | 174.4 | 0 | 0 | 0 | 0 | 122 | ||||
| 37 | Q | 32.9 | Very low | 33.7 | Very low | 168 Ų | 168 | 140.1 Ų | 140.1 | 79% | 0.785 | 79% | 0.785 | S | S | * | * | trans | 74.6 | 140.2 | 164.5 | -84.5 | 155.1 | 0 | 0 | 0 | 118 | ||||
| 38 | Q | 33.5 | Very low | 34.1 | Very low | 157 Ų | 157 | 141.8 Ų | 141.8 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | cis | -149.3 | 140.8 | 3.4 | -166.1 | 155.8 | -73.4 | 0 | 0 | 115.2 | ||||
| 39 | L | 32.9 | Very low | 35.2 | Very low | 150 Ų | 150 | 142.7 Ų | 142.7 | 79% | 0.785 | 78% | 0.775 | S | S | * | * | trans | 6.1 | 125.3 | 158.4 | -57.4 | 168.3 | 0 | 0 | 0 | 121.6 | ||||
| 40 | S | 35.5 | Very low | 35.2 | Very low | 132 Ų | 132 | 142.2 Ų | 142.2 | 92% | 0.923 | 77% | 0.771 | S | S | * | * | 177.8 | 136.7 | 118.8 | -74.6 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 41 | G | 30.9 | Very low | 35.1 | Very low | 69 Ų | 69 | 141.5 Ų | 141.5 | 71% | 0.711 | 77% | 0.769 | S | S | * | * | cis | -177.5 | 159.3 | -8.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 42 | E | 33.5 | Very low | 35.2 | Very low | 182 Ų | 182 | 139.4 Ų | 139.4 | 85% | 0.85 | 77% | 0.772 | S | S | * | * | trans | 49.5 | 128.8 | 165.3 | -48.2 | -164.9 | 139.2 | 0 | 0 | 118.7 | ||||
| 43 | F | 34 | Very low | 35.2 | Very low | 187 Ų | 187 | 139.8 Ų | 139.8 | 82% | 0.82 | 77% | 0.774 | S | S | * | * | -155.6 | 179.8 | 57.8 | -160 | -106.9 | 0 | 0 | 0 | 113.1 | |||||
| 44 | F | 32.8 | Very low | 35.1 | Very low | 173 Ų | 173 | 136 Ų | 136 | 76% | 0.759 | 77% | 0.771 | S | S | * | * | trans | -78.7 | 167.8 | -166.4 | -81.4 | -101.4 | 0 | 0 | 0 | 117 | ||||
| 45 | S | 32.3 | Very low | 35.3 | Very low | 108 Ų | 108 | 138.2 Ų | 138.2 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | trans | -145.6 | 155.7 | 167.1 | -76.6 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 46 | L | 33.5 | Very low | 35.6 | Very low | 149 Ų | 149 | 143.5 Ų | 143.5 | 78% | 0.78 | 78% | 0.784 | S | S | * | * | trans | 74 | 114.8 | 168.7 | -93 | 72.6 | 0 | 0 | 0 | 120.7 | ||||
| 47 | E | 29.7 | Very low | 35.6 | Very low | 165 Ų | 165 | 145.6 Ų | 145.6 | 77% | 0.771 | 79% | 0.786 | S | S | * | * | 92.2 | 91.9 | 112.4 | -151.1 | 150.6 | 107.5 | 0 | 0 | 122.7 | |||||
| 48 | N | 41.9 | Very low | 35.7 | Very low | 157 Ų | 157 | 143 Ų | 143 | 84% | 0.84 | 78% | 0.782 | S | S | * | * | trans | 63.8 | -179.9 | 137.3 | -113.9 | 7.4 | 0 | 0 | 0 | 119.2 | ||||
| 49 | P | 51.1 | Low | 36.2 | Very low | 102 Ų | 102 | 140.3 Ų | 140.3 | 66% | 0.662 | 79% | 0.787 | S | S | * | * | cis | -131.4 | -165.8 | -9.9 | 41.2 | -23.5 | 0 | 0 | 0 | 115.2 | ||||
| 50 | S | 36.9 | Very low | 36.6 | Very low | 97 Ų | 97 | 139.3 Ų | 139.3 | 68% | 0.678 | 79% | 0.792 | S | S | * | * | trans | 73.2 | 151.9 | 155.7 | -85.5 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 51 | D | 40.3 | Very low | 36.6 | Very low | 149 Ų | 149 | 136.4 Ų | 136.4 | 80% | 0.797 | 78% | 0.784 | S | S | * | * | cis | -155.3 | 163.2 | 10.8 | -118.1 | -11.1 | 0 | 0 | 0 | 115.5 | ||||
| 52 | A | 38.4 | Very low | 37.2 | Very low | 98 Ų | 98 | 140.7 Ų | 140.7 | 81% | 0.81 | 79% | 0.789 | S | S | * | * | trans | 69 | 133.5 | 152.2 | 0 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 53 | E | 37.8 | Very low | 37.5 | Very low | 199 Ų | 199 | 138.5 Ų | 138.5 | 93% | 0.93 | 78% | 0.784 | S | S | * | * | trans | -92.1 | 159.9 | 172.6 | -79.6 | 163.5 | 71.2 | 0 | 0 | 114.4 | ||||
| 54 | A | 34.8 | Very low | 37.6 | Very low | 86 Ų | 86 | 135.4 Ų | 135.4 | 71% | 0.711 | 78% | 0.78 | S | S | * | * | trans | -162.8 | 108.3 | 149 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 55 | L | 35 | Very low | 37.8 | Very low | 168 Ų | 168 | 134.9 Ų | 134.9 | 88% | 0.88 | 78% | 0.784 | S | S | * | * | trans | 68.8 | 146.6 | 151.1 | -50.6 | 174.7 | 0 | 0 | 0 | 117.3 | ||||
| 56 | Y | 37 | Very low | 38 | Very low | 206 Ų | 206 | 134 Ų | 134 | 81% | 0.808 | 78% | 0.778 | S | S | * | * | cis | -155 | 158.2 | 8.1 | 47.3 | -89.7 | 0 | 0 | 0 | 113.2 | ||||
| 57 | E | 33 | Very low | 38.2 | Very low | 155 Ų | 155 | 134.3 Ų | 134.3 | 72% | 0.724 | 78% | 0.776 | S | S | * | * | trans | 39 | 107.3 | 153.2 | -69.8 | -62.8 | 135.6 | 0 | 0 | 122.5 | ||||
| 58 | T | 34 | Very low | 38.6 | Very low | 114 Ų | 114 | 134 Ų | 134 | 70% | 0.699 | 77% | 0.774 | S | S | * | * | 51.2 | 126.2 | 115.7 | -46.6 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 59 | A | 45.8 | Very low | 38.2 | Very low | 101 Ų | 101 | 129.7 Ų | 129.7 | 84% | 0.835 | 77% | 0.767 | S | S | * | * | trans | -105.2 | 128.5 | 162.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 60 | S | 40.3 | Very low | 37.9 | Very low | 128 Ų | 128 | 130 Ų | 130 | 90% | 0.895 | 77% | 0.772 | S | S | * | * | trans | -168.4 | 159.8 | 162.7 | -165.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 61 | G | 35.2 | Very low | 38.1 | Very low | 72 Ų | 72 | 131 Ų | 131 | 74% | 0.742 | 78% | 0.778 | S | S | * | * | trans | 131.7 | 122.5 | 164.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 62 | L | 44.4 | Very low | 38 | Very low | 159 Ų | 159 | 130.3 Ų | 130.3 | 83% | 0.832 | 77% | 0.77 | S | S | * | * | trans | -118.1 | 156.5 | 168 | -82.9 | 169.4 | 0 | 0 | 0 | 110.3 | ||||
| 63 | N | 38.5 | Very low | 37.9 | Very low | 136 Ų | 136 | 133.8 Ų | 133.8 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | trans | 82.4 | 136.5 | 148.5 | -75.4 | -3.5 | 0 | 0 | 0 | 123.8 | ||||
| 64 | T | 36.5 | Very low | 37.6 | Very low | 122 Ų | 122 | 126.8 Ų | 126.8 | 75% | 0.748 | 75% | 0.751 | S | S | * | * | trans | 76.4 | 122.8 | 138.8 | 48.9 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 65 | L | 37.1 | Very low | 38 | Very low | 161 Ų | 161 | 127.3 Ų | 127.3 | 84% | 0.843 | 75% | 0.749 | S | S | * | * | 171.4 | 127.8 | 118.9 | -84.7 | 161.5 | 0 | 0 | 0 | 107.5 | |||||
| 66 | S | 36.8 | Very low | 38.5 | Very low | 90 Ų | 90 | 129 Ų | 129 | 63% | 0.629 | 74% | 0.744 | S | S | * | * | 52.6 | 131.3 | 75.7 | -78 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 67 | E | 37.7 | Very low | 38.4 | Very low | 155 Ų | 155 | 127.2 Ų | 127.2 | 72% | 0.724 | 74% | 0.743 | S | S | * | * | cis | -165.3 | -158.3 | -1.6 | -126 | 167.4 | 85.9 | 0 | 0 | 109.4 | ||||
| 68 | H | 37.2 | Very low | 38.5 | Very low | 158 Ų | 158 | 127 Ų | 127 | 73% | 0.731 | 74% | 0.741 | S | S | * | * | cis | -161.8 | 171.9 | 13.7 | -164.7 | 68.8 | 0 | 0 | 0 | 110.5 | ||||
| 69 | G | 33.8 | Very low | 38.4 | Very low | 67 Ų | 67 | 127 Ų | 127 | 69% | 0.691 | 74% | 0.742 | S | S | * | * | trans | 157.7 | 127.6 | 161.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 70 | S | 44.5 | Very low | 38 | Very low | 110 Ų | 110 | 128.9 Ų | 128.9 | 77% | 0.769 | 74% | 0.742 | S | S | * | * | trans | -90.6 | 177.3 | -172.5 | -43.3 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 71 | S | 42.7 | Very low | 37.8 | Very low | 117 Ų | 117 | 127 Ų | 127 | 82% | 0.818 | 73% | 0.734 | S | S | * | * | cis | -158 | 169.3 | 20.4 | 58 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 72 | E | 38.3 | Very low | 37.5 | Very low | 135 Ų | 135 | 131.2 Ų | 131.2 | 63% | 0.631 | 74% | 0.735 | S | S | * | * | trans | -67.1 | 178.8 | 176.1 | -126.5 | -149.9 | 106.9 | 0 | 0 | 114.2 | G74 | E72-G74 WeakPolarHBondContact OE1-CA 3.2Š| ||
| 73 | H | 34.6 | Very low | 36.9 | Very low | 171 Ų | 171 | 131.4 Ų | 131.4 | 79% | 0.792 | 73% | 0.731 | S | S | * | * | cis | -141.5 | 174 | 30.4 | -73.8 | -69.8 | 0 | 0 | 0 | 113 | ||||
| 74 | G | 32.5 | Very low | 36.7 | Very low | 52 Ų | 52 | 131.1 Ų | 131.1 | 54% | 0.536 | 73% | 0.734 | S | S | . | * | cis | 152.2 | 162.2 | -8.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | E72 | E72-G74 WeakPolarHBondContact OE1-CA 3.2Š| ||
| 75 | S | 43.9 | Very low | 37.8 | Very low | 96 Ų | 96 | 131.5 Ų | 131.5 | 67% | 0.671 | 74% | 0.739 | S | S | * | * | trans | 55.6 | 156.1 | 165.1 | -63 | 0 | 0 | 0 | 0 | 121 | ||||
| 76 | R | 44.5 | Very low | 37.5 | Very low | 204 Ų | 204 | 127.5 Ų | 127.5 | 77% | 0.77 | 74% | 0.737 | S | S | * | * | cis | -163 | 173.6 | -18.8 | -98.2 | 172.1 | 169.8 | 100.3 | -9.7 | 105.1 | ||||
| 77 | E | 35.9 | Very low | 37.3 | Very low | 168 Ų | 168 | 132 Ų | 132 | 79% | 0.785 | 75% | 0.748 | S | S | * | * | cis | -160.2 | 142.1 | 46.2 | -72.4 | -171.1 | 125.7 | 0 | 0 | 109.8 | ||||
| 78 | H | 33.2 | Very low | 37 | Very low | 150 Ų | 150 | 133.3 Ų | 133.3 | 69% | 0.694 | 75% | 0.753 | S | S | * | * | 57.2 | 139.6 | 109.6 | -61.6 | -75.7 | 0 | 0 | 0 | 117.8 | |||||
| 79 | T | 33.6 | Very low | 36.8 | Very low | 116 Ų | 116 | 129.5 Ų | 129.5 | 71% | 0.712 | 75% | 0.749 | S | S | * | * | cis | -162.7 | 149.2 | 17.3 | 23 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 80 | V | 37.1 | Very low | 36.6 | Very low | 139 Ų | 139 | 135.4 Ų | 135.4 | 84% | 0.842 | 76% | 0.759 | S | S | * | * | trans | 61.1 | 145.7 | 133.8 | 172.8 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 81 | A | 34.7 | Very low | 36 | Very low | 88 Ų | 88 | 135.3 Ų | 135.3 | 73% | 0.727 | 76% | 0.758 | S | S | * | * | cis | -168 | -162.5 | -23.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 82 | E | 30.8 | Very low | 35.6 | Very low | 161 Ų | 161 | 137 Ų | 137 | 75% | 0.752 | 75% | 0.753 | S | S | * | * | trans | -83.7 | 177.8 | -158 | -53.9 | 174.9 | 64.6 | 0 | 0 | 118.9 | ||||
| 83 | H | 30 | Very low | 35.2 | Very low | 163 Ų | 163 | 138.5 Ų | 138.5 | 76% | 0.755 | 76% | 0.76 | S | S | * | * | trans | 115.9 | 145 | 141.9 | -59.4 | -40.3 | 0 | 0 | 0 | 119.5 | ||||
| 84 | T | 34.3 | Very low | 35.2 | Very low | 130 Ų | 130 | 134.8 Ų | 134.8 | 80% | 0.798 | 76% | 0.759 | S | S | * | * | trans | -118 | -175.7 | 174.5 | 54.1 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 85 | P | 60 | Low | 35.4 | Very low | 131 Ų | 131 | 138.6 Ų | 138.6 | 85% | 0.851 | 78% | 0.777 | S | S | * | * | cis | -112.3 | -172.3 | -46.8 | 36.1 | -22.1 | 0 | 0 | 0 | 110.9 | ||||
| 86 | G | 32 | Very low | 35 | Very low | 77 Ų | 77 | 137.7 Ų | 137.7 | 79% | 0.794 | 78% | 0.783 | S | S | * | * | trans | -157.8 | 160.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 87 | E | 31.4 | Very low | 34.6 | Very low | 185 Ų | 185 | 135.8 Ų | 135.8 | 86% | 0.864 | 78% | 0.783 | S | S | * | * | trans | -115.7 | 152 | -162 | -64.4 | 178.3 | 107.2 | 0 | 0 | 115.2 | ||||
| 88 | H | 32 | Very low | 35.2 | Very low | 181 Ų | 181 | 133.6 Ų | 133.6 | 84% | 0.838 | 78% | 0.783 | S | S | * | * | trans | 42.8 | 137.8 | 144.8 | -80.4 | -85.4 | 0 | 0 | 0 | 124.7 | ||||
| 89 | A | 32.1 | Very low | 35.4 | Very low | 78 Ų | 78 | 129.7 Ų | 129.7 | 65% | 0.645 | 78% | 0.777 | S | S | * | * | trans | 102.7 | 131.5 | 136.1 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 90 | E | 30.9 | Very low | 35.7 | Very low | 191 Ų | 191 | 128.3 Ų | 128.3 | 89% | 0.893 | 78% | 0.777 | S | S | * | * | trans | 63.2 | 147.4 | 147.2 | -68.1 | 163.5 | -151.6 | 0 | 0 | 120.3 | ||||
| 91 | S | 32.2 | Very low | 35.6 | Very low | 108 Ų | 108 | 128 Ų | 128 | 76% | 0.755 | 78% | 0.776 | S | S | * | * | cis | -124.5 | -128.9 | 4.4 | 43.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 92 | E | 32.7 | Very low | 35.5 | Very low | 152 Ų | 152 | 126.8 Ų | 126.8 | 71% | 0.71 | 77% | 0.772 | S | S | * | * | cis | -158.1 | -177.7 | 4.1 | -138.7 | -91.1 | 84.3 | 0 | 0 | 108.9 | ||||
| 93 | H | 31.2 | Very low | 35.6 | Very low | 168 Ų | 168 | 127.9 Ų | 127.9 | 78% | 0.778 | 78% | 0.777 | S | S | * | * | trans | -90.8 | -179.1 | -178 | -59.9 | -94.1 | 0 | 0 | 0 | 112.4 | ||||
| 94 | A | 34.3 | Very low | 35.8 | Very low | 93 Ų | 93 | 124.9 Ų | 124.9 | 77% | 0.769 | 78% | 0.78 | S | S | * | * | cis | -166.2 | 168 | 24 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 95 | S | 37.4 | Very low | 35.8 | Very low | 132 Ų | 132 | 128.1 Ų | 128.1 | 92% | 0.923 | 79% | 0.786 | S | S | * | * | trans | 80.8 | 128.2 | 149.4 | -151.4 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 96 | G | 33.9 | Very low | 34.4 | Very low | 77 Ų | 77 | 125.4 Ų | 125.4 | 79% | 0.794 | 78% | 0.782 | S | S | * | * | trans | 151 | 30.9 | 165.3 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 97 | E | 38 | Very low | 34.4 | Very low | 164 Ų | 164 | 129.3 Ų | 129.3 | 77% | 0.766 | 78% | 0.779 | S | S | * | * | trans | -73.9 | 161.4 | 171.7 | -121.3 | -160.5 | 143.9 | 0 | 0 | 112.4 | A99 | E97-A99 WeakPolarHBondContact OE1-CA 3.37Å; E97-A99 VanDerWaalsContact OE1-CB 3.25Å; E97-A99 WeakPolarHBondContact OE1-CB 3.35Å; E97-A99 PolarHBondContact OE1-N 2.03Å | ||
| 98 | P | 48.1 | Very low | 34.3 | Very low | 122 Ų | 122 | 128 Ų | 128 | 79% | 0.792 | 77% | 0.773 | S | S | * | * | -115.4 | 151 | 51.1 | 5 | 19.2 | 0 | 0 | 0 | 114.5 | |||||
| 99 | A | 36.9 | Very low | 34.4 | Very low | 68 Ų | 68 | 125.8 Ų | 125.8 | 56% | 0.562 | 77% | 0.772 | S | S | * | * | 72.3 | 138 | 60.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | E97 | E97-A99 WeakPolarHBondContact OE1-CA 3.37Å; E97-A99 VanDerWaalsContact OE1-CB 3.25Å; E97-A99 WeakPolarHBondContact OE1-CB 3.35Å; E97-A99 PolarHBondContact OE1-N 2.03Å | |||
| 100 | A | 39.2 | Very low | 34.8 | Very low | 86 Ų | 86 | 129.2 Ų | 129.2 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | cis | -166.6 | 166.3 | 10.6 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 101 | T | 36.1 | Very low | 34.8 | Very low | 133 Ų | 133 | 123.7 Ų | 123.7 | 82% | 0.816 | 78% | 0.779 | S | S | * | * | cis | -169.9 | 159.8 | -9.3 | 26.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 102 | G | 32.2 | Very low | 34.7 | Very low | 62 Ų | 62 | 126.6 Ų | 126.6 | 64% | 0.639 | 78% | 0.78 | S | S | * | * | trans | 130.1 | 99.9 | 168.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 103 | H | 32.5 | Very low | 34.8 | Very low | 185 Ų | 185 | 126.5 Ų | 126.5 | 86% | 0.856 | 78% | 0.78 | S | S | * | * | 60.2 | 129.9 | 55.8 | -55.8 | -70.4 | 0 | 0 | 0 | 113 | |||||
| 104 | A | 34.1 | Very low | 35.7 | Very low | 99 Ų | 99 | 124 Ų | 124 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | cis | -144.8 | -174.1 | 6.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 105 | E | 33.7 | Very low | 35.8 | Very low | 199 Ų | 199 | 125.7 Ų | 125.7 | 93% | 0.93 | 79% | 0.785 | S | S | * | * | trans | -96.3 | 168.3 | -169.7 | -55.3 | 178 | 105.5 | 0 | 0 | 115.1 | ||||
| 106 | G | 31.8 | Very low | 35.6 | Very low | 74 Ų | 74 | 122.2 Ų | 122.2 | 76% | 0.763 | 77% | 0.769 | S | S | * | * | trans | 89.6 | 156.4 | 155.5 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 107 | E | 32 | Very low | 35.4 | Very low | 159 Ų | 159 | 126.9 Ų | 126.9 | 74% | 0.743 | 77% | 0.771 | S | S | * | * | cis | -163.1 | 154.1 | -19.2 | -148.6 | -177.3 | 152.3 | 0 | 0 | 110.2 | ||||
| 108 | H | 30.2 | Very low | 35.3 | Very low | 158 Ų | 158 | 126 Ų | 126 | 73% | 0.731 | 77% | 0.767 | S | S | * | * | trans | 63.4 | 169.2 | 175.7 | -38.1 | -57.4 | 0 | 0 | 0 | 115.7 | ||||
| 109 | T | 34.2 | Very low | 35.1 | Very low | 133 Ų | 133 | 125.5 Ų | 125.5 | 82% | 0.816 | 76% | 0.763 | S | S | * | * | cis | -133.4 | 170.5 | 6.1 | 46.8 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 110 | V | 40.3 | Very low | 35.1 | Very low | 151 Ų | 151 | 128.4 Ų | 128.4 | 92% | 0.915 | 78% | 0.779 | S | S | * | * | trans | -96.2 | 138.6 | 167.4 | 174.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 111 | G | 29.6 | Very low | 34.8 | Very low | 74 Ų | 74 | 127.7 Ų | 127.7 | 76% | 0.763 | 78% | 0.78 | S | S | * | * | trans | -168.8 | 140.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 112 | E | 31.4 | Very low | 34.7 | Very low | 169 Ų | 169 | 130.8 Ų | 130.8 | 79% | 0.79 | 79% | 0.785 | S | S | * | * | trans | -84.7 | 149.4 | -169.1 | -56.5 | 165.6 | 51.2 | 0 | 0 | 115.4 | ||||
| 113 | Q | 34.5 | Very low | 34.8 | Very low | 151 Ų | 151 | 136.4 Ų | 136.4 | 71% | 0.706 | 80% | 0.795 | S | S | * | * | 146.3 | 137.5 | 119.9 | -80.5 | -62.7 | -49.5 | 0 | 0 | 111.9 | |||||
| 114 | P | 48.7 | Very low | 34.9 | Very low | 115 Ų | 115 | 135.3 Ų | 135.3 | 75% | 0.747 | 80% | 0.795 | S | S | * | * | trans | -81.6 | 151.7 | 166.1 | 35 | -33.1 | 0 | 0 | 0 | 111.2 | ||||
| 115 | S | 37.5 | Very low | 34.9 | Very low | 129 Ų | 129 | 135.5 Ų | 135.5 | 90% | 0.902 | 79% | 0.79 | S | S | * | * | trans | -137.7 | 140 | 164.8 | -165 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 116 | G | 31.8 | Very low | 34.7 | Very low | 58 Ų | 58 | 129.1 Ų | 129.1 | 60% | 0.598 | 78% | 0.778 | S | S | * | * | trans | -128 | -171.3 | -171.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 117 | E | 31 | Very low | 34.7 | Very low | 175 Ų | 175 | 133.9 Ų | 133.9 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | 67 | 144.2 | 177.8 | -48.4 | -177.6 | 56.9 | 0 | 0 | 113.7 | ||||
| 118 | Q | 35.3 | Very low | 34.8 | Very low | 147 Ų | 147 | 134.5 Ų | 134.5 | 69% | 0.687 | 78% | 0.783 | S | S | * | * | cis | -140.8 | 154.6 | 30 | -80.4 | -91.3 | -65.4 | 0 | 0 | 112.4 | ||||
| 119 | P | 44.3 | Very low | 34.8 | Very low | 110 Ų | 110 | 132.3 Ų | 132.3 | 71% | 0.714 | 79% | 0.785 | S | S | * | * | trans | -88.2 | 115.2 | 157.5 | 33.4 | -26.4 | 0 | 0 | 0 | 110.4 | G121 | P119-G121 PolarHBondContact O-N 3.46Š| ||
| 120 | S | 37.4 | Very low | 34.9 | Very low | 129 Ų | 129 | 133.9 Ų | 133.9 | 90% | 0.902 | 79% | 0.788 | S | S | * | * | trans | -70.9 | 103.1 | 173.4 | -62.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 121 | G | 31.3 | Very low | 34.8 | Very low | 71 Ų | 71 | 130 Ų | 130 | 73% | 0.732 | 78% | 0.779 | S | S | * | * | trans | -90.1 | 148.4 | 163.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | P119 | P119-G121 PolarHBondContact O-N 3.46Š| ||
| 122 | E | 34 | Very low | 34.9 | Very low | 198 Ų | 198 | 134.7 Ų | 134.7 | 93% | 0.925 | 78% | 0.781 | S | S | * | * | trans | -96.1 | 138.8 | 162.4 | -67.2 | -174.8 | 117.1 | 0 | 0 | 109.2 | ||||
| 123 | H | 35.2 | Very low | 35 | Very low | 181 Ų | 181 | 134.3 Ų | 134.3 | 84% | 0.838 | 78% | 0.779 | S | S | * | * | trans | -153.9 | 178.3 | -176.1 | -130.9 | -99.5 | 0 | 0 | 0 | 109.4 | ||||
| 124 | L | 34.8 | Very low | 35.4 | Very low | 162 Ų | 162 | 132 Ų | 132 | 85% | 0.848 | 79% | 0.786 | S | S | * | * | trans | 79.1 | 130.7 | -172.3 | -48 | 175 | 0 | 0 | 0 | 112.6 | ||||
| 125 | S | 33.8 | Very low | 34.9 | Very low | 103 Ų | 103 | 132 Ų | 132 | 72% | 0.72 | 79% | 0.788 | S | S | * | * | cis | -144.6 | 166.6 | -8.9 | -78.4 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 126 | G | 30.6 | Very low | 34.9 | Very low | 65 Ų | 65 | 129 Ų | 129 | 67% | 0.67 | 78% | 0.778 | S | S | * | * | 65.7 | 125.6 | 62.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 127 | E | 30.1 | Very low | 34.9 | Very low | 174 Ų | 174 | 135.2 Ų | 135.2 | 81% | 0.813 | 79% | 0.791 | S | S | * | * | cis | -154.5 | 169.3 | 11.3 | -94.6 | 153.7 | 82.6 | 0 | 0 | 112.7 | ||||
| 128 | Q | 34 | Very low | 35.2 | Very low | 172 Ų | 172 | 135 Ų | 135 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | trans | 5.7 | 138.1 | 160.5 | -52.7 | -177.7 | -59.2 | 0 | 0 | 121.6 | ||||
| 129 | S | 30.9 | Very low | 35.6 | Very low | 112 Ų | 112 | 132.8 Ų | 132.8 | 78% | 0.783 | 79% | 0.789 | S | S | * | * | -172.3 | 154.1 | 116.8 | -85 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 130 | L | 35.3 | Very low | 35.2 | Very low | 165 Ų | 165 | 133.5 Ų | 133.5 | 86% | 0.864 | 80% | 0.796 | S | S | * | * | trans | 17.6 | 136.7 | 150.8 | -55.5 | 165.8 | 0 | 0 | 0 | 119.3 | ||||
| 131 | G | 38.2 | Very low | 35.1 | Very low | 71 Ų | 71 | 133.8 Ų | 133.8 | 73% | 0.732 | 79% | 0.787 | S | S | * | * | cis | 108.8 | 64.4 | 9.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 132 | E | 32.7 | Very low | 35.2 | Very low | 172 Ų | 172 | 140.1 Ų | 140.1 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | trans | -121.1 | 119 | 179.7 | -73.8 | -167.1 | 74.7 | 0 | 0 | 113.6 | ||||
| 133 | H | 34.4 | Very low | 35.2 | Very low | 161 Ų | 161 | 137.8 Ų | 137.8 | 75% | 0.745 | 79% | 0.787 | S | S | * | * | trans | 48.5 | 108.3 | 144.5 | -61.9 | -70.2 | 0 | 0 | 0 | 121.1 | ||||
| 134 | A | 41.9 | Very low | 35 | Very low | 103 Ų | 103 | 136.6 Ų | 136.6 | 85% | 0.851 | 79% | 0.786 | S | S | * | * | trans | -69 | 135.6 | 140.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 135 | S | 38.9 | Very low | 35.1 | Very low | 114 Ų | 114 | 133.9 Ų | 133.9 | 80% | 0.797 | 78% | 0.781 | S | S | * | * | trans | -128.5 | 130.5 | 158.8 | -74.2 | 0 | 0 | 0 | 0 | 108 | ||||
| 136 | G | 36.8 | Very low | 35.1 | Very low | 67 Ų | 67 | 131.9 Ų | 131.9 | 69% | 0.691 | 78% | 0.777 | S | S | * | * | trans | -128 | 119.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 137 | E | 31.9 | Very low | 35.2 | Very low | 188 Ų | 188 | 137.3 Ų | 137.3 | 88% | 0.879 | 79% | 0.785 | S | S | * | * | trans | -119.2 | 97.4 | 166.2 | -66.2 | 173.6 | 96.6 | 0 | 0 | 104.1 | ||||
| 138 | Q | 36.5 | Very low | 35.3 | Very low | 170 Ų | 170 | 138 Ų | 138 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | 63.4 | 135.6 | 82.5 | -70.7 | -60.2 | -67.4 | 0 | 0 | 113.3 | |||||
| 139 | P | 44 | Very low | 35.6 | Very low | 101 Ų | 101 | 134.4 Ų | 134.4 | 66% | 0.656 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 153.1 | -174.9 | 33.9 | -35.4 | 0 | 0 | 0 | 111.5 | ||
| 140 | S | 35.6 | Very low | 35.9 | Very low | 125 Ų | 125 | 135.2 Ų | 135.2 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -95.2 | 120 | 158.6 | -63.1 | 0 | 0 | 0 | 0 | 108.9 | ||
| 141 | D | 35.2 | Very low | 35.9 | Very low | 134 Ų | 134 | 130.2 Ų | 130.2 | 72% | 0.717 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 137.3 | 166.4 | -63 | -85.5 | 0 | 0 | 0 | 111 | ||
| 142 | E | 35 | Very low | 35.6 | Very low | 204 Ų | 204 | 135.9 Ų | 135.9 | 95% | 0.953 | 79% | 0.789 | S | S | * | * | trans | -121.5 | 137.3 | 140.8 | -79.1 | -161.3 | 114.9 | 0 | 0 | 107.9 | ||||
| 143 | Q | 32.6 | Very low | 35.7 | Very low | 150 Ų | 150 | 135.8 Ų | 135.8 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | trans | -135.3 | 141.2 | -155.8 | -155.3 | -162 | -30.8 | 0 | 0 | 111 | ||||
| 144 | L | 32.5 | Very low | 36.4 | Very low | 155 Ų | 155 | 133.3 Ų | 133.3 | 81% | 0.812 | 79% | 0.787 | S | S | * | * | trans | 69.9 | 149.9 | 175.6 | -43.3 | 170.6 | 0 | 0 | 0 | 113.7 | ||||
| 145 | S | 36 | Very low | 36.1 | Very low | 105 Ų | 105 | 134.6 Ų | 134.6 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | cis | -136.6 | 160.6 | -1.7 | -145.2 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 146 | G | 33.3 | Very low | 35.8 | Very low | 62 Ų | 62 | 132 Ų | 132 | 64% | 0.639 | 78% | 0.781 | S | S | * | * | cis | 98.7 | 73.7 | 12 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 147 | E | 32.4 | Very low | 35.6 | Very low | 179 Ų | 179 | 136.4 Ų | 136.4 | 84% | 0.836 | 78% | 0.783 | S | S | * | * | trans | -155.1 | 115.8 | 168.5 | -120 | 165.2 | 129.2 | 0 | 0 | 113.8 | ||||
| 148 | H | 33.5 | Very low | 35.7 | Very low | 188 Ų | 188 | 135.6 Ų | 135.6 | 87% | 0.87 | 78% | 0.779 | S | S | * | * | trans | 28.1 | 141.7 | 155.5 | -66.7 | -76.5 | 0 | 0 | 0 | 124.9 | ||||
| 149 | A | 40.6 | Very low | 35.5 | Very low | 97 Ų | 97 | 130.2 Ų | 130.2 | 80% | 0.802 | 76% | 0.764 | S | S | * | * | trans | -100.8 | 143.8 | 161.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 150 | S | 37.5 | Very low | 35.1 | Very low | 129 Ų | 129 | 131.5 Ų | 131.5 | 90% | 0.902 | 78% | 0.775 | S | S | * | * | trans | -156 | 155.5 | 158.4 | -80 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 151 | G | 34.5 | Very low | 34.9 | Very low | 60 Ų | 60 | 128.6 Ų | 128.6 | 62% | 0.619 | 77% | 0.765 | S | S | * | * | cis | 126.4 | 115.8 | 4.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 152 | E | 31.1 | Very low | 34.7 | Very low | 190 Ų | 190 | 131.2 Ų | 131.2 | 89% | 0.888 | 77% | 0.773 | S | S | * | * | trans | 64.7 | 164.4 | 172.7 | -58.1 | 173.9 | 85.2 | 0 | 0 | 116.4 | ||||
| 153 | Q | 34.9 | Very low | 34.7 | Very low | 169 Ų | 169 | 129.8 Ų | 129.8 | 79% | 0.79 | 77% | 0.766 | S | S | * | * | cis | -156.5 | 168.5 | -41.1 | -103.5 | -61.4 | -82.4 | 0 | 0 | 106.4 | ||||
| 154 | P | 50 | Low | 35.5 | Very low | 110 Ų | 110 | 127.4 Ų | 127.4 | 71% | 0.714 | 76% | 0.763 | S | S | * | * | trans | -88.3 | 158.4 | -171 | 36 | -35.3 | 0 | 0 | 0 | 115 | ||||
| 155 | S | 35.9 | Very low | 35.6 | Very low | 129 Ų | 129 | 126.3 Ų | 126.3 | 90% | 0.902 | 77% | 0.769 | S | S | * | * | trans | -159.5 | 148.9 | 166 | -165 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 156 | G | 31.5 | Very low | 35.3 | Very low | 60 Ų | 60 | 124.4 Ų | 124.4 | 62% | 0.619 | 77% | 0.766 | S | S | * | * | cis | 158.1 | 141.9 | 0.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 157 | E | 32.9 | Very low | 35.3 | Very low | 159 Ų | 159 | 130.7 Ų | 130.7 | 74% | 0.743 | 78% | 0.779 | S | S | * | * | trans | 61.2 | 163.3 | -168.7 | -66.1 | -80.1 | 35.5 | 0 | 0 | 113.5 | ||||
| 158 | H | 33.7 | Very low | 35.4 | Very low | 172 Ų | 172 | 130.4 Ų | 130.4 | 80% | 0.796 | 78% | 0.777 | S | S | * | * | cis | -152.8 | -173.5 | 1.7 | -150 | 50.8 | 0 | 0 | 0 | 109.1 | ||||
| 159 | A | 32.3 | Very low | 35.9 | Very low | 57 Ų | 57 | 127.2 Ų | 127.2 | 47% | 0.471 | 77% | 0.773 | S | S | . | * | -157.6 | 173 | -83.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 160 | S | 36.2 | Very low | 35.8 | Very low | 127 Ų | 127 | 128.2 Ų | 128.2 | 89% | 0.888 | 78% | 0.775 | S | S | * | * | trans | 65.5 | 137.1 | 172.2 | -54.4 | 0 | 0 | 0 | 0 | 117 | ||||
| 161 | G | 31 | Very low | 35.5 | Very low | 64 Ų | 64 | 125.8 Ų | 125.8 | 66% | 0.66 | 77% | 0.77 | S | S | * | * | cis | 179.6 | 165.9 | -5.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 162 | E | 32.1 | Very low | 35.5 | Very low | 190 Ų | 190 | 131.6 Ų | 131.6 | 89% | 0.888 | 78% | 0.781 | S | S | * | * | trans | 63.1 | 148.1 | 159.7 | -62.5 | 167.4 | 85.4 | 0 | 0 | 120.4 | ||||
| 163 | Q | 34.3 | Very low | 35.6 | Very low | 173 Ų | 173 | 132.2 Ų | 132.2 | 81% | 0.808 | 78% | 0.783 | S | S | * | * | cis | -162.4 | 166.3 | -32.9 | -107.2 | -56.2 | -87.7 | 0 | 0 | 106.6 | ||||
| 164 | P | 49.7 | Very low | 35.4 | Very low | 100 Ų | 100 | 128.2 Ų | 128.2 | 65% | 0.649 | 78% | 0.779 | S | S | * | * | trans | -102.9 | 163.2 | -163.5 | 39.6 | -36.6 | 0 | 0 | 0 | 116.7 | ||||
| 165 | S | 34.1 | Very low | 34.7 | Very low | 132 Ų | 132 | 128.9 Ų | 128.9 | 92% | 0.923 | 79% | 0.786 | S | S | * | * | trans | -166.8 | 145.2 | 153.9 | -74.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 166 | G | 30.6 | Very low | 34.3 | Very low | 66 Ų | 66 | 126 Ų | 126 | 68% | 0.68 | 78% | 0.777 | S | S | * | * | cis | -174.3 | 176.8 | -4.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 167 | E | 32.7 | Very low | 34.3 | Very low | 194 Ų | 194 | 130.7 Ų | 130.7 | 91% | 0.907 | 78% | 0.783 | S | S | * | * | trans | 58.1 | 107.9 | 153.9 | -65.8 | 169.5 | 113 | 0 | 0 | 121.4 | ||||
| 168 | Q | 34.8 | Very low | 34.2 | Very low | 172 Ų | 172 | 130.8 Ų | 130.8 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | -76.9 | 162.4 | 143.8 | -77 | -73.8 | -72 | 0 | 0 | 109 | ||||
| 169 | P | 43 | Very low | 34.1 | Very low | 121 Ų | 121 | 127 Ų | 127 | 79% | 0.786 | 78% | 0.776 | S | S | * | * | cis | -151.2 | -164.7 | 46.5 | 43.8 | -21.5 | 0 | 0 | 0 | 117.4 | ||||
| 170 | S | 39.8 | Very low | 34.2 | Very low | 119 Ų | 119 | 132.3 Ų | 132.3 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | trans | -54.2 | 155.2 | -178.4 | -46 | 0 | 0 | 0 | 0 | 117 | ||||
| 171 | G | 31 | Very low | 33.9 | Very low | 78 Ų | 78 | 129.1 Ų | 129.1 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | -147.8 | 130.6 | 157.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 172 | E | 33.7 | Very low | 33.9 | Very low | 182 Ų | 182 | 134.2 Ų | 134.2 | 85% | 0.85 | 79% | 0.79 | S | S | * | * | trans | -78.4 | 158.6 | 172.4 | -63.8 | 156.2 | 89.4 | 0 | 0 | 111 | ||||
| 173 | H | 33.8 | Very low | 33.9 | Very low | 202 Ų | 202 | 134.6 Ų | 134.6 | 94% | 0.935 | 79% | 0.791 | S | S | * | * | trans | -173.8 | 166.6 | 131.4 | -93.4 | -50.1 | 0 | 0 | 0 | 110.5 | ||||
| 174 | A | 31.2 | Very low | 33.8 | Very low | 85 Ų | 85 | 130.3 Ų | 130.3 | 70% | 0.702 | 79% | 0.785 | S | S | * | * | trans | -144.6 | 168.2 | -163.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 175 | S | 33.6 | Very low | 33.2 | Very low | 124 Ų | 124 | 133.4 Ų | 133.4 | 87% | 0.867 | 80% | 0.796 | S | S | * | * | trans | 77.1 | 131.8 | 156.6 | -57 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 176 | G | 28 | Very low | 32.9 | Very low | 69 Ų | 69 | 131.7 Ų | 131.7 | 71% | 0.711 | 78% | 0.784 | S | S | * | * | trans | 85.4 | 161.6 | 152 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 177 | E | 31 | Very low | 32.9 | Very low | 158 Ų | 158 | 137.1 Ų | 137.1 | 74% | 0.738 | 79% | 0.791 | S | S | * | * | cis | -167.8 | 143.9 | -18.5 | -130 | -169.7 | 110.5 | 0 | 0 | 111.1 | ||||
| 178 | Q | 31.1 | Very low | 33 | Very low | 161 Ų | 161 | 136.4 Ų | 136.4 | 75% | 0.752 | 79% | 0.785 | S | S | * | * | trans | 60.9 | 176.9 | 164.5 | -49.1 | -176.7 | 12.4 | 0 | 0 | 114.9 | ||||
| 179 | S | 32.8 | Very low | 33.4 | Very low | 92 Ų | 92 | 134.1 Ų | 134.1 | 64% | 0.643 | 79% | 0.785 | S | S | * | * | cis | -147.5 | 130.4 | 1.7 | -152 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 180 | L | 34.6 | Very low | 33.1 | Very low | 169 Ų | 169 | 133.5 Ų | 133.5 | 89% | 0.885 | 78% | 0.784 | S | S | * | * | 62.3 | 128.5 | 89 | -154.6 | 82 | 0 | 0 | 0 | 116.2 | |||||
| 181 | G | 29.2 | Very low | 32.7 | Very low | 60 Ų | 60 | 131.2 Ų | 131.2 | 62% | 0.619 | 78% | 0.779 | S | S | * | * | trans | 76.1 | 161.7 | 167.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 182 | E | 29.9 | Very low | 33 | Very low | 172 Ų | 172 | 136.4 Ų | 136.4 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | cis | -161.4 | 146.4 | -12 | -157.4 | 93 | 116.1 | 0 | 0 | 107 | ||||
| 183 | H | 32.4 | Very low | 33.1 | Very low | 197 Ų | 197 | 136.4 Ų | 136.4 | 91% | 0.912 | 78% | 0.782 | S | S | * | * | trans | -178.1 | 127 | 145.3 | -104.1 | -65.4 | 0 | 0 | 0 | 110.8 | ||||
| 184 | A | 32.8 | Very low | 33.7 | Very low | 83 Ų | 83 | 132.3 Ų | 132.3 | 69% | 0.686 | 77% | 0.774 | S | S | * | * | trans | -139.3 | 168.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 185 | L | 36.3 | Very low | 34.1 | Very low | 166 Ų | 166 | 134.4 Ų | 134.4 | 87% | 0.869 | 78% | 0.783 | S | S | * | * | trans | 81.5 | 149.2 | 161.9 | -64.8 | 165.1 | 0 | 0 | 0 | 120.3 | ||||
| 186 | S | 28.8 | Very low | 34 | Very low | 96 Ų | 96 | 131.6 Ų | 131.6 | 67% | 0.671 | 77% | 0.774 | S | S | * | * | trans | 65.6 | 141.5 | 164.8 | -74.8 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 187 | E | 31.3 | Very low | 34.9 | Very low | 180 Ų | 180 | 132.6 Ų | 132.6 | 84% | 0.841 | 78% | 0.775 | S | S | * | * | cis | -160.3 | 177.5 | -14 | -129.6 | 168.4 | 118.5 | 0 | 0 | 110.7 | ||||
| 188 | K | 34.6 | Very low | 35.5 | Very low | 179 Ų | 179 | 130.9 Ų | 130.9 | 78% | 0.778 | 78% | 0.778 | S | S | * | * | trans | -125.1 | 136.8 | 175.9 | -176.8 | -172 | 178.1 | -171.3 | 0 | 111.5 | ||||
| 189 | P | 42.2 | Very low | 36.3 | Very low | 123 Ų | 123 | 131 Ų | 131 | 80% | 0.799 | 78% | 0.782 | S | S | * | * | trans | -125 | -175.7 | 138 | 11.2 | 10.5 | 0 | 0 | 0 | 113.2 | ||||
| 190 | S | 37.6 | Very low | 37.4 | Very low | 108 Ų | 108 | 132 Ų | 132 | 76% | 0.755 | 79% | 0.789 | S | S | * | * | trans | -93.7 | 165.3 | -170.8 | -155.1 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 191 | G | 30.2 | Very low | 37.9 | Very low | 71 Ų | 71 | 127.9 Ų | 127.9 | 73% | 0.732 | 77% | 0.774 | S | S | * | * | trans | -171.7 | 135 | 169.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 192 | E | 37.4 | Very low | 39 | Very low | 187 Ų | 187 | 133.3 Ų | 133.3 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | trans | -101.5 | 164.5 | -172.1 | -92.6 | 151.1 | 79.5 | 0 | 0 | 114.6 | ||||
| 193 | Q | 36.7 | Very low | 40.2 | Very low | 183 Ų | 183 | 127.9 Ų | 127.9 | 86% | 0.855 | 77% | 0.768 | S | S | * | * | trans | -51.6 | 156.1 | 178.6 | -142 | 159.7 | -124.3 | 0 | 0 | 111.9 | ||||
| 194 | P | 47 | Very low | 41.4 | Very low | 116 Ų | 116 | 124.7 Ų | 124.7 | 75% | 0.753 | 76% | 0.763 | S | S | * | * | cis | -153.9 | 175.8 | 35.9 | 44.7 | -23.7 | 0 | 0 | 0 | 121.7 | ||||
| 195 | S | 39.1 | Very low | 42.9 | Very low | 128 Ų | 128 | 122.7 Ų | 122.7 | 90% | 0.895 | 75% | 0.75 | S | S | * | * | trans | 81.5 | 150.8 | 159 | -151.3 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 196 | G | 31.2 | Very low | 45 | Very low | 65 Ų | 65 | 118.8 Ų | 118.8 | 67% | 0.67 | 73% | 0.734 | S | S | * | * | trans | 108.9 | 85.5 | -167.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 197 | A | 47 | Very low | 48 | Very low | 90 Ų | 90 | 120.3 Ų | 120.3 | 74% | 0.744 | 73% | 0.733 | S | S | * | * | trans | -62.6 | 129.9 | 164.2 | 0 | 0 | 0 | 0 | 0 | 108.2 | I199 | A197-I199 PolarHBondContact O-N 3.23Š| ||
| 198 | P | 44.3 | Very low | 51.1 | Low | 122 Ų | 122 | 112.2 Ų | 112.2 | 79% | 0.792 | 70% | 0.695 | S | S | * | * | trans | -65 | 104.2 | 177.9 | 25.3 | -32.4 | 0 | 0 | 0 | 109 | S200 | P198-S200 PolarHBondContact O-N 3.36Š| ||
| 199 | I | 47.5 | Very low | 54.1 | Low | 164 Ų | 164 | 106.5 Ų | 106.5 | 84% | 0.841 | 67% | 0.673 | S | S | * | * | trans | -49.4 | 126.8 | 174.2 | -57.8 | 169.2 | 0 | 0 | 0 | 107.2 | A197 S201 | A197-I199 PolarHBondContact O-N 3.23Å; I199-S201 PolarHBondContact O-N 2.91Å | ||
| 200 | S | 54.4 | Low | 56.8 | Low | 113 Ų | 113 | 100.6 Ų | 100.6 | 79% | 0.79 | 64% | 0.635 | S | S | * | * | trans | -21 | 93.6 | -172.9 | -62.2 | 0 | 0 | 0 | 0 | 113.3 | P198 I202 | P198-S200 PolarHBondContact O-N 3.36Å; S200-I202 PolarHBondContact O-N 3.2Å | ||
| 201 | S | 45.1 | Very low | 59.7 | Low | 83 Ų | 83 | 99.4 Ų | 99.4 | 58% | 0.58 | 62% | 0.615 | S | S | * | * | trans | -55.8 | 131.3 | 171.9 | 48.6 | 0 | 0 | 0 | 0 | 107.4 | I199 S203 | I199-S201 PolarHBondContact O-N 2.91Å; S201-S203 PolarHBondContact O-N 3.26Å | ||
| 202 | I | 54 | Low | 62.9 | Low | 174 Ų | 174 | 97.7 Ų | 97.7 | 89% | 0.892 | 59% | 0.59 | S | S | * | * | trans | -70 | 77.9 | 164.3 | -58.1 | 176 | 0 | 0 | 0 | 104.9 | S200 T204 | S200-I202 PolarHBondContact O-N 3.2Å; I202-T204 PolarHBondContact O-N 3.46Å; I202-T204 VanDerWaalsContact O-N 3.1Å | ||
| 203 | S | 54.3 | Low | 65.8 | Low | 58 Ų | 58 | 88.9 Ų | 88.9 | 41% | 0.406 | 55% | 0.549 | S | S | . | . | trans | -60.5 | 118.1 | 176.8 | -165.6 | 0 | 0 | 0 | 0 | 105.9 | S201 G205 | S201-S203 PolarHBondContact O-N 3.26Å; S203-G205 PolarHBondContact O-N 2.91Å | ||
| 204 | T | 57.4 | Low | 68.8 | Low | 130 Ų | 130 | 83 Ų | 83 | 80% | 0.798 | 53% | 0.531 | S | S | * | . | trans | -44.9 | 117.2 | 147 | 38.9 | 0 | 0 | 0 | 0 | 105.9 | I202 T206 | I202-T204 PolarHBondContact O-N 3.46Å; I202-T204 VanDerWaalsContact O-N 3.1Å; T204-T206 PolarHBondContact O-N 3.2Å | ||
| 205 | G | 65.4 | Low | 71.2 | Confident | 41 Ų | 41 | 82.4 Ų | 82.4 | 42% | 0.423 | 52% | 0.515 | S | S | . | . | trans | -63.1 | 114.3 | -163.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | S203 I207 | S203-G205 PolarHBondContact O-N 2.91Å; G205-I207 PolarHBondContact O-N 3.01Å | ||
| 206 | T | 79.3 | Confident | 74 | Confident | 84 Ų | 84 | 76.4 Ų | 76.4 | 52% | 0.515 | 47% | 0.473 | S | S | . | . | trans | -60 | 115.5 | 176.9 | -48.4 | 0 | 0 | 0 | 0 | 107.8 | T204 L208 T231 | T204-T206 PolarHBondContact O-N 3.2Å; T206-L208 HydrophobicContact CG2-CD2 3.68Å; T206-L208 HydrophobicContact CG2-CG 4.14Å; T206-L208 PolarHBondContact O-N 3.27Å; T206-T231 PolarHBondContact O-OG1 2.93Å | ||
| 207 | I | 91.5 | Very high | 77.2 | Confident | 127 Ų | 127 | 74.3 Ų | 74.3 | 65% | 0.651 | 45% | 0.446 | S | S | * | . | trans | -73.5 | 111.2 | 178.2 | -59.2 | -179.3 | 0 | 0 | 0 | 106.9 | G205 I230 | G205-I207 PolarHBondContact O-N 3.01Å; I207-I230 HydrophobicContact CG2-CG2 3.36Å | ||
| 208 | L | 96.1 | Very high | 79.6 | Confident | 11 Ų | 11 | 73.2 Ų | 73.2 | 6% | 0.058 | 43% | 0.428 | C | S | . | . | trans | -119.9 | 138.7 | -177.5 | -61.1 | 179.2 | 0 | 0 | 0 | 109 | T206 I230 T231 R277 | T206-L208 HydrophobicContact CG2-CD2 3.68Å; T206-L208 HydrophobicContact CG2-CG 4.14Å; T206-L208 PolarHBondContact O-N 3.27Å; L208-I230 CarbonylContact O-C 3.5Å; L208-I230 WeakPolarHBondContact O-CA 3.28Å; L208-T231 HydrophobicContact CB-CG2 4.15Å; L208-T231 PolarHBondContact N-OG1 3Å; L208-T231 PolarHBondContact O-N 3.39Å; L208-T231 PolarHBondContact O-OG1 2.92Å; L208-R277 HydrophobicContact CD1-CB 4.34Å | ||
| 209 | N | 98 | Very high | 82.1 | Confident | 58 Ų | 58 | 74.8 Ų | 74.8 | 31% | 0.31 | 42% | 0.424 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.9 | 139.3 | 161.8 | -61.6 | -92 | 0 | 0 | 0 | 108 | C229 S280 F281 | N209-C229 CarbonylContact C-O 3.58Å; N209-C229 WeakPolarHBondContact CA-O 3.02Å; N209-S280 PolarHBondContact N-OG 2.91Å; N209-S280 CarbonylContact O-C 3.51Å; N209-S280 VanDerWaalsContact O-CA 3.24Å; N209-S280 WeakPolarHBondContact O-CA 3.24Å; N209-S280 WeakPolarHBondContact O-CB 3.47Å; N209-F281 HydrophobicContact CB-CD1 4.4Å; N209-F281 HydrophobicContact CB-CE1 3.67Å; N209-F281 HydrophobicContact CB-CE2 3.87Å; N209-F281 HydrophobicContact CB-CZ 3.36Å; N209-F281 PolarHBondContact O-N 3.13Å |
| 210 | C | 98.4 | Very high | 84.4 | Confident | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 40% | 0.395 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128 | 154.7 | 174.4 | -46.8 | 0 | 0 | 0 | 0 | 109.1 | T228 C229 C237 | C210-T228 CarbonylContact O-C 3.53Å; C210-T228 WeakPolarHBondContact O-CA 3.48Å; C210-T228 WeakPolarHBondContact O-CB 3.07Å; C210-C229 PolarHBondContact N-O 3.41Å; C210-C229 PolarHBondContact O-N 2.84Å; C210-C237 HydrophobicContact CB-CB 3.66Å; C210-C237 WeakPolarHBondContact CB-SG 3.26Å; C210-C237 WeakPolarHBondContact SG-CA 3.41Å; C210-C237 WeakPolarHBondContact SG-CB 3.25Å; C210-C237 CovalentContact SG-SG 2.03Å; C210-C237 PolarHBondContact SG-SG 2.97Å |
| 211 | Y | 98.6 | Very high | 86.5 | Confident | 83 Ų | 83 | 70.3 Ų | 70.3 | 33% | 0.325 | 39% | 0.386 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.7 | 145.9 | 166.3 | -68.4 | -66.3 | 0 | 0 | 0 | 110.1 | G254 F281 N283 K284 | Y211-G254 WeakPolarHBondContact O-CA 3.46Å; Y211-G254 PolarHBondContact O-N 3.16Å; Y211-F281 HydrophobicContact CD1-CD1 4.09Å; Y211-F281 HydrophobicContact CD2-CB 4.12Å; Y211-F281 HydrophobicContact CD2-CD1 4.08Å; Y211-F281 AromaticContact CE1-CD1 3.95Å; Y211-F281 HydrophobicContact CE1-CD1 3.95Å; Y211-F281 HydrophobicContact CE1-CE1 4.4Å; Y211-F281 HydrophobicContact CE2-CB 3.61Å; Y211-F281 AromaticContact CE2-CD1 3.95Å; Y211-F281 HydrophobicContact CE2-CD1 3.95Å; Y211-F281 HydrophobicContact CE2-CG 4.1Å; Y211-F281 HydrophobicContact CG-CD1 4.15Å; Y211-F281 AromaticContact CZ-CD1 3.87Å; Y211-N283 PolarHBondContact N-OD1 2.04Å; Y211-N283 PolarHBondContact O-ND2 3.48Å; Y211-K284 HydrophobicContact CD2-CB 4.14Å; Y211-K284 HydrophobicContact CD2-CG 4.39Å; Y211-K284 HydrophobicContact CE2-CB 3.87Å; Y211-K284 HydrophobicContact CE2-CD 4.25Å; Y211-K284 HydrophobicContact CE2-CG 3.87Å |
| 212 | T | 98.6 | Very high | 89 | Confident | 35 Ų | 35 | 67.5 Ų | 67.5 | 22% | 0.215 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.8 | 136.3 | 165.1 | 58.7 | 0 | 0 | 0 | 0 | 110.1 | G225 E226 G227 T228 C229 Q253 | T212-G225 CarbonylContact C-O 3.46Å; T212-E226 WeakPolarHBondContact O-CA 3.08Å; T212-G227 PolarHBondContact N-O 3.49Å; T212-G227 PolarHBondContact O-N 3.27Å; T212-G227 VanDerWaalsContact O-N 3.12Å; T212-G227 VanDerWaalsContact OG1-CA 3.31Å; T212-G227 WeakPolarHBondContact OG1-CA 3.07Å; T212-G227 PolarHBondContact OG1-N 3.34Å; T212-G227 PolarHBondContact OG1-O 3.48Å; T212-T228 PolarHBondContact OG1-N 2.83Å; T212-C229 HydrophobicContact CG2-CB 3.59Å; T212-C229 VanDerWaalsContact CG2-SG 3.52Å; T212-Q253 WeakPolarHBondContact CA-O 3.05Å |
| 213 | C | 98.7 | Very high | 91.2 | Very high | 1 Ų | 1 | 63.1 Ų | 63.1 | 1% | 0.007 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.9 | 122.2 | 160.5 | -175.4 | 0 | 0 | 0 | 0 | 108.8 | Y215 M216 C222 R224 G225 V252 Q253 | C213-Y215 VanDerWaalsContact C-N 3.31Å; C213-Y215 PolarHBondContact SG-O 2.92Å; C213-M216 HydrophobicContact CB-CE 4.19Å; C213-M216 HydrophobicContact CB-CG 3.72Å; C213-M216 HydrophobicContact CB-SD 4.27Å; C213-M216 WeakPolarHBondContact SG-CG 3.33Å; C213-C222 HydrophobicContact CB-CB 3.89Å; C213-C222 WeakPolarHBondContact CB-SG 3.47Å; C213-C222 WeakPolarHBondContact SG-CA 3.35Å; C213-C222 WeakPolarHBondContact SG-CB 3.47Å; C213-C222 CovalentContact SG-SG 2.03Å; C213-C222 PolarHBondContact SG-SG 2.67Å; C213-R224 PolarHBondContact SG-O 2.82Å; C213-R224 VanDerWaalsContact SG-O 3.36Å; C213-G225 WeakPolarHBondContact CA-O 3.47Å; C213-V252 WeakPolarHBondContact O-CA 3.26Å; C213-V252 WeakPolarHBondContact O-CG1 3.29Å; C213-Q253 HydrophobicContact CB-CB 4.37Å; C213-Q253 PolarHBondContact N-O 2.79Å; C213-Q253 PolarHBondContact O-N 3.42Å |
| 214 | A | 98.4 | Very high | 93.3 | Very high | 59 Ų | 59 | 69.6 Ų | 69.6 | 49% | 0.488 | 36% | 0.36 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.3 | -25.9 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | R224 | A214-R224 WeakPolarHBondContact CB-O 3.41Å; A214-R224 PolarHBondContact N-O 2.86Å |
| 215 | Y | 98.3 | Very high | 95.2 | Very high | 104 Ų | 104 | 65.5 Ų | 65.5 | 41% | 0.408 | 34% | 0.344 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -155.3 | 109.8 | 176.9 | -175.9 | -110.7 | 0 | 0 | 0 | 111.5 | C213 L223 R224 F250 | C213-Y215 VanDerWaalsContact C-N 3.31Å; C213-Y215 PolarHBondContact SG-O 2.92Å; Y215-L223 HydrophobicContact CD1-CB 3.98Å; Y215-L223 HydrophobicContact CD1-CD1 4.11Å; Y215-L223 HydrophobicContact CE1-CB 4.5Å; Y215-L223 HydrophobicContact CE1-CD1 3.81Å; Y215-L223 PolarHBondContact O-N 2.85Å; Y215-R224 PolarHBondContact N-O 3.17Å; Y215-R224 PolarHBondContact O-N 2.9Å; Y215-F250 HydrophobicContact CD2-CB 3.8Å; Y215-F250 AromaticContact CD2-CD2 3.73Å; Y215-F250 HydrophobicContact CD2-CD2 3.73Å; Y215-F250 HydrophobicContact CD2-CE2 4.47Å; Y215-F250 AromaticContact CD2-CG 3.9Å; Y215-F250 HydrophobicContact CD2-CG 3.9Å; Y215-F250 HydrophobicContact CE2-CB 3.34Å; Y215-F250 HydrophobicContact CE2-CD1 4.14Å; Y215-F250 AromaticContact CE2-CD2 3.9Å; Y215-F250 HydrophobicContact CE2-CD2 3.9Å; Y215-F250 AromaticContact CE2-CG 3.57Å; Y215-F250 HydrophobicContact CE2-CG 3.57Å |
| 216 | M | 98.3 | Very high | 96.8 | Very high | 2 Ų | 2 | 71.3 Ų | 71.3 | 1% | 0.01 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.8 | 147.9 | 168.4 | -64.9 | 170.8 | -87.6 | 0 | 0 | 110.7 | C213 R221 C222 L239 F250 M251 Q253 I285 | C213-M216 HydrophobicContact CB-CE 4.19Å; C213-M216 HydrophobicContact CB-CG 3.72Å; C213-M216 HydrophobicContact CB-SD 4.27Å; C213-M216 WeakPolarHBondContact SG-CG 3.33Å; M216-R221 VanDerWaalsContact CA-O 3.28Å; M216-R221 WeakPolarHBondContact CA-O 3.39Å; M216-C222 HydrophobicContact CG-CB 4.29Å; M216-L239 HydrophobicContact CE-CD1 4.23Å; M216-F250 VanDerWaalsContact O-CA 3.26Å; M216-F250 WeakPolarHBondContact O-CA 3.28Å; M216-F250 VanDerWaalsContact O-CB 3.25Å; M216-F250 WeakPolarHBondContact O-CB 3.06Å; M216-M251 HydrophobicContact CB-CB 4.16Å; M216-M251 HydrophobicContact CE-CB 3.61Å; M216-M251 PolarHBondContact N-O 2.03Å; M216-M251 PolarHBondContact O-N 3.04Å; M216-M251 HydrophobicContact SD-CB 4.37Å; M216-Q253 HydrophobicContact CE-CB 3.84Å; M216-Q253 HydrophobicContact CE-CG 3.5Å; M216-Q253 HydrophobicContact SD-CG 4.39Å; M216-I285 HydrophobicContact CE-CD1 4.06Å; M216-I285 HydrophobicContact SD-CD1 3.8Å; M216-I285 HydrophobicContact SD-CG1 3.77Å |
| 217 | N | 97.9 | Very high | 97.7 | Very high | 21 Ų | 21 | 68.8 Ų | 68.8 | 11% | 0.112 | 35% | 0.35 | C | S | . | . | trans | -74.4 | 177.6 | 170.2 | 72.4 | -12.7 | 0 | 0 | 0 | 112.8 | Q219 G220 R221 L223 M251 | N217-Q219 PolarHBondContact ND2-OE1 3.03Å; N217-Q219 VanDerWaalsContact ND2-OE1 3.08Å; N217-Q219 PolarHBondContact O-N 3.49Å; N217-Q219 WeakPolarHBondContact OD1-CB 3.38Å; N217-Q219 PolarHBondContact OD1-N 3.4Å; N217-G220 PolarHBondContact O-N 3.03Å; N217-G220 PolarHBondContact OD1-N 3.03Å; N217-R221 PolarHBondContact N-O 2.9Å; N217-R221 VanDerWaalsContact N-O 3.11Å; N217-R221 PolarHBondContact OD1-N 3.1Å; N217-R221 PolarHBondContact OD1-O 3.26Å; N217-L223 HydrophobicContact CB-CD1 3.98Å; N217-M251 WeakPolarHBondContact O-CE 3.03Å | ||
| 218 | D | 97.2 | Very high | 98 | Very high | 67 Ų | 67 | 66.9 Ų | 66.9 | 36% | 0.358 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -20.8 | 174.6 | 56.1 | -6.1 | 0 | 0 | 0 | 114.1 | G220 K247 L248 | D218-G220 VanDerWaalsContact C-N 3.34Å; D218-K247 WeakPolarHBondContact OD2-CE 3.41Å; D218-K247 IonicContact OD2-NZ 2.67Å; D218-K247 PolarHBondContact OD2-NZ 2.04Å; D218-L248 HydrophobicContact CB-CB 4.4Å; D218-L248 HydrophobicContact CB-CD2 4.24Å; D218-L248 HydrophobicContact CB-CG 4.23Å |
| 219 | Q | 96.9 | Very high | 98.1 | Very high | 155 Ų | 155 | 67.8 Ų | 67.8 | 72% | 0.724 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.1 | -2.6 | 171.9 | -54.6 | 175.1 | -41.2 | 0 | 0 | 114.1 | N217 R221 | N217-Q219 PolarHBondContact ND2-OE1 3.03Å; N217-Q219 VanDerWaalsContact ND2-OE1 3.08Å; N217-Q219 PolarHBondContact O-N 3.49Å; N217-Q219 WeakPolarHBondContact OD1-CB 3.38Å; N217-Q219 PolarHBondContact OD1-N 3.4Å; Q219-R221 VanDerWaalsContact C-N 3.33Å; Q219-R221 PolarHBondContact O-N 2.73Å |
| 220 | G | 96.5 | Very high | 98.1 | Very high | 21 Ų | 21 | 69.4 Ų | 69.4 | 22% | 0.216 | 36% | 0.359 | C | S | . | . | trans | 78.4 | 7.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | N217 D218 | N217-G220 PolarHBondContact O-N 3.03Å; N217-G220 PolarHBondContact OD1-N 3.03Å; D218-G220 VanDerWaalsContact C-N 3.34Å | ||
| 221 | R | 98 | Very high | 98 | Very high | 163 Ų | 163 | 69.9 Ų | 69.9 | 62% | 0.615 | 36% | 0.362 | S | S | * | . | trans | -77.6 | 128.1 | 172.5 | -167 | 179.6 | 75.3 | -164.6 | 3.9 | 109.3 | M216 N217 Q219 | M216-R221 VanDerWaalsContact CA-O 3.28Å; M216-R221 WeakPolarHBondContact CA-O 3.39Å; N217-R221 PolarHBondContact N-O 2.9Å; N217-R221 VanDerWaalsContact N-O 3.11Å; N217-R221 PolarHBondContact OD1-N 3.1Å; N217-R221 PolarHBondContact OD1-O 3.26Å; Q219-R221 VanDerWaalsContact C-N 3.33Å; Q219-R221 PolarHBondContact O-N 2.73Å | ||
| 222 | C | 98.4 | Very high | 97.7 | Very high | 23 Ų | 23 | 72.2 Ų | 72.2 | 16% | 0.155 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.4 | 135.9 | 170.6 | -167.6 | 0 | 0 | 0 | 0 | 110.5 | C213 M216 E226 | C213-C222 HydrophobicContact CB-CB 3.89Å; C213-C222 WeakPolarHBondContact CB-SG 3.47Å; C213-C222 WeakPolarHBondContact SG-CA 3.35Å; C213-C222 WeakPolarHBondContact SG-CB 3.47Å; C213-C222 CovalentContact SG-SG 2.03Å; C213-C222 PolarHBondContact SG-SG 2.67Å; M216-C222 HydrophobicContact CG-CB 4.29Å; C222-E226 HydrophobicContact CB-CB 4.12Å; C222-E226 HydrophobicContact CB-CG 4.27Å; C222-E226 VanDerWaalsContact SG-CA 3.58Å; C222-E226 VanDerWaalsContact SG-CB 3.59Å; C222-E226 PolarHBondContact SG-N 3.04Å |
| 223 | L | 98.3 | Very high | 97.1 | Very high | 82 Ų | 82 | 77.2 Ų | 77.2 | 43% | 0.429 | 40% | 0.402 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.8 | -18 | 177.2 | -59.5 | -178.3 | 0 | 0 | 0 | 112.2 | Y215 N217 | Y215-L223 HydrophobicContact CD1-CB 3.98Å; Y215-L223 HydrophobicContact CD1-CD1 4.11Å; Y215-L223 HydrophobicContact CE1-CB 4.5Å; Y215-L223 HydrophobicContact CE1-CD1 3.81Å; Y215-L223 PolarHBondContact O-N 2.85Å; N217-L223 HydrophobicContact CB-CD1 3.98Å |
| 224 | R | 98.4 | Very high | 96.6 | Very high | 194 Ų | 194 | 80.2 Ų | 80.2 | 73% | 0.732 | 42% | 0.422 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -155.9 | 135.3 | 175.3 | -175.6 | 175.7 | 176.1 | 166 | 0 | 112 | C213 A214 Y215 | C213-R224 PolarHBondContact SG-O 2.82Å; C213-R224 VanDerWaalsContact SG-O 3.36Å; A214-R224 WeakPolarHBondContact CB-O 3.41Å; A214-R224 PolarHBondContact N-O 2.86Å; Y215-R224 PolarHBondContact N-O 3.17Å; Y215-R224 PolarHBondContact O-N 2.9Å |
| 225 | G | 97.8 | Very high | 96.5 | Very high | 45 Ų | 45 | 79.4 Ų | 79.4 | 46% | 0.464 | 41% | 0.408 | S | S | . | . | trans | 76 | 32.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | T212 C213 | T212-G225 CarbonylContact C-O 3.46Å; C213-G225 WeakPolarHBondContact CA-O 3.47Å | ||
| 226 | E | 98.6 | Very high | 96.4 | Very high | 163 Ų | 163 | 76.3 Ų | 76.3 | 76% | 0.762 | 40% | 0.398 | S | S | * | . | trans | -61 | 142.5 | 172.7 | -170.7 | 162.1 | -142.3 | 0 | 0 | 111 | T212 C222 | T212-E226 WeakPolarHBondContact O-CA 3.08Å; C222-E226 HydrophobicContact CB-CB 4.12Å; C222-E226 HydrophobicContact CB-CG 4.27Å; C222-E226 VanDerWaalsContact SG-CA 3.58Å; C222-E226 VanDerWaalsContact SG-CB 3.59Å; C222-E226 PolarHBondContact SG-N 3.04Å | ||
| 227 | G | 98.3 | Very high | 96.4 | Very high | 31 Ų | 31 | 76.2 Ų | 76.2 | 32% | 0.32 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 159.2 | -154 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | T212 | T212-G227 PolarHBondContact N-O 3.49Å; T212-G227 PolarHBondContact O-N 3.27Å; T212-G227 VanDerWaalsContact O-N 3.12Å; T212-G227 VanDerWaalsContact OG1-CA 3.31Å; T212-G227 WeakPolarHBondContact OG1-CA 3.07Å; T212-G227 PolarHBondContact OG1-N 3.34Å; T212-G227 PolarHBondContact OG1-O 3.48Å |
| 228 | T | 98.5 | Very high | 96.4 | Very high | 87 Ų | 87 | 75.9 Ų | 75.9 | 53% | 0.534 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.8 | 156.7 | 176.3 | 61.5 | 0 | 0 | 0 | 0 | 111.1 | C210 T212 F281 | C210-T228 CarbonylContact O-C 3.53Å; C210-T228 WeakPolarHBondContact O-CA 3.48Å; C210-T228 WeakPolarHBondContact O-CB 3.07Å; T212-T228 PolarHBondContact OG1-N 2.83Å; T228-F281 HydrophobicContact CG2-CE1 3.71Å; T228-F281 HydrophobicContact CG2-CZ 4.35Å |
| 229 | C | 97.8 | Very high | 96.4 | Very high | 29 Ų | 29 | 73.1 Ų | 73.1 | 20% | 0.196 | 38% | 0.381 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132 | 157.1 | 169.6 | 60.8 | 0 | 0 | 0 | 0 | 110 | N209 C210 T212 C255 | N209-C229 CarbonylContact C-O 3.58Å; N209-C229 WeakPolarHBondContact CA-O 3.02Å; C210-C229 PolarHBondContact N-O 3.41Å; C210-C229 PolarHBondContact O-N 2.84Å; T212-C229 HydrophobicContact CG2-CB 3.59Å; T212-C229 VanDerWaalsContact CG2-SG 3.52Å; C229-C255 VanDerWaalsContact C-SG 3.52Å; C229-C255 HydrophobicContact CB-CB 4.05Å; C229-C255 WeakPolarHBondContact CB-SG 3.31Å; C229-C255 WeakPolarHBondContact SG-CB 3.06Å; C229-C255 PolarHBondContact SG-N 3.06Å; C229-C255 CovalentContact SG-SG 2.04Å; C229-C255 PolarHBondContact SG-SG 3.38Å |
| 230 | I | 97.4 | Very high | 96.5 | Very high | 93 Ų | 93 | 68.9 Ų | 68.9 | 48% | 0.477 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.6 | 129.9 | 174.8 | -61.3 | 176.1 | 0 | 0 | 0 | 107.6 | I207 L208 Q232 | I207-I230 HydrophobicContact CG2-CG2 3.36Å; L208-I230 CarbonylContact O-C 3.5Å; L208-I230 WeakPolarHBondContact O-CA 3.28Å; I230-Q232 PolarHBondContact O-N 2.95Å |
| 231 | T | 96.5 | Very high | 96.6 | Very high | 9 Ų | 9 | 70 Ų | 70 | 6% | 0.055 | 36% | 0.358 | C | S | . | . | trans | -65 | 132.5 | 178.8 | 52.2 | 0 | 0 | 0 | 0 | 111.6 | T206 L208 Q235 C255 | T206-T231 PolarHBondContact O-OG1 2.93Å; L208-T231 HydrophobicContact CB-CG2 4.15Å; L208-T231 PolarHBondContact N-OG1 3Å; L208-T231 PolarHBondContact O-N 3.39Å; L208-T231 PolarHBondContact O-OG1 2.92Å; T231-Q235 HydrophobicContact CG2-CB 4.1Å; T231-C255 HydrophobicContact CG2-CB 4.45Å | ||
| 232 | Q | 92.1 | Very high | 96.6 | Very high | 132 Ų | 132 | 63 Ų | 63 | 62% | 0.617 | 33% | 0.333 | S | S | * | . | trans | -114.1 | 146.8 | 174.1 | -58.4 | -178.2 | 6.7 | 0 | 0 | 110.4 | I230 S234 Q235 | I230-Q232 PolarHBondContact O-N 2.95Å; Q232-S234 PolarHBondContact O-N 3Å; Q232-Q235 VanDerWaalsContact O-CB 3.27Å; Q232-Q235 WeakPolarHBondContact O-CB 3.03Å; Q232-Q235 VanDerWaalsContact O-CG 3.29Å; Q232-Q235 WeakPolarHBondContact O-CG 3.38Å; Q232-Q235 PolarHBondContact O-N 2.89Å | ||
| 233 | N | 87.9 | Confident | 96.6 | Very high | 141 Ų | 141 | 63.7 Ų | 63.7 | 75% | 0.754 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.8 | -105.5 | 174.6 | -54.4 | -44.2 | 0 | 0 | 0 | 113.5 | ||
| 234 | S | 88.1 | Confident | 96.6 | Very high | 63 Ų | 63 | 65.2 Ų | 65.2 | 44% | 0.441 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.4 | 13.4 | 179.6 | 60.9 | 0 | 0 | 0 | 0 | 113.4 | Q232 | Q232-S234 PolarHBondContact O-N 3Š|
| 235 | Q | 95.1 | Very high | 96.4 | Very high | 42 Ų | 42 | 59.7 Ų | 59.7 | 20% | 0.196 | 34% | 0.342 | C | S | . | . | trans | -63.7 | 148.7 | 177 | -73.2 | -178.7 | -35.5 | 0 | 0 | 112.3 | T231 Q232 C255 E256 N257 | T231-Q235 HydrophobicContact CG2-CB 4.1Å; Q232-Q235 VanDerWaalsContact O-CB 3.27Å; Q232-Q235 WeakPolarHBondContact O-CB 3.03Å; Q232-Q235 VanDerWaalsContact O-CG 3.29Å; Q232-Q235 WeakPolarHBondContact O-CG 3.38Å; Q232-Q235 PolarHBondContact O-N 2.89Å; Q235-C255 HydrophobicContact CB-CB 4.46Å; Q235-C255 PolarHBondContact NE2-O 3.26Å; Q235-E256 VanDerWaalsContact CA-O 3.26Å; Q235-E256 WeakPolarHBondContact CA-O 3.45Å; Q235-N257 VanDerWaalsContact CG-OD1 3.31Å; Q235-N257 WeakPolarHBondContact CG-OD1 3.43Å; Q235-N257 PolarHBondContact NE2-ND2 3.32Å | ||
| 236 | Q | 96.3 | Very high | 96.1 | Very high | 40 Ų | 40 | 60.7 Ų | 60.7 | 19% | 0.187 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.1 | 158.2 | 172.6 | -64.7 | 178.9 | 88.4 | 0 | 0 | 109.7 | M238 E256 C259 R277 | Q236-M238 PolarHBondContact O-N 3.23Å; Q236-E256 PolarHBondContact N-O 3.09Å; Q236-E256 PolarHBondContact O-N 3.37Å; Q236-C259 HydrophobicContact CB-CB 4.41Å; Q236-C259 PolarHBondContact NE2-O 2.93Å; Q236-R277 HydrophobicContact CG-CB 4.12Å |
| 237 | C | 98 | Very high | 96 | Very high | 0 Ų | 0 | 58.2 Ų | 58.2 | 0% | 0 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.1 | 129.8 | 170.4 | -58.7 | 0 | 0 | 0 | 0 | 109.1 | C210 C275 C276 N283 | C210-C237 HydrophobicContact CB-CB 3.66Å; C210-C237 WeakPolarHBondContact CB-SG 3.26Å; C210-C237 WeakPolarHBondContact SG-CA 3.41Å; C210-C237 WeakPolarHBondContact SG-CB 3.25Å; C210-C237 CovalentContact SG-SG 2.03Å; C210-C237 PolarHBondContact SG-SG 2.97Å; C237-C275 WeakPolarHBondContact O-CA 3.3Å; C237-C276 PolarHBondContact N-O 2.03Å; C237-C276 PolarHBondContact O-N 3.2Å; C237-N283 HydrophobicContact CB-CB 3.87Å |
| 238 | M | 98.1 | Very high | 96 | Very high | 13 Ų | 13 | 58.3 Ų | 58.3 | 6% | 0.064 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.8 | 140.7 | -171.6 | 178.8 | -85.3 | -72.6 | 0 | 0 | 111.1 | Q236 K240 Q253 G254 E256 I273 I274 N283 | Q236-M238 PolarHBondContact O-N 3.23Å; M238-K240 HydrophobicContact SD-CB 3.56Å; M238-K240 VanDerWaalsContact SD-CB 3.56Å; M238-K240 PolarHBondContact SD-N 2.89Å; M238-Q253 WeakPolarHBondContact O-CA 3.27Å; M238-G254 PolarHBondContact N-O 3.49Å; M238-G254 PolarHBondContact O-N 3.34Å; M238-E256 HydrophobicContact CB-CB 3.53Å; M238-E256 HydrophobicContact CB-CG 4.48Å; M238-E256 HydrophobicContact CE-CB 4.18Å; M238-E256 HydrophobicContact CE-CG 4.45Å; M238-E256 HydrophobicContact CG-CB 3.79Å; M238-E256 HydrophobicContact CG-CG 4.22Å; M238-I273 HydrophobicContact CG-CG2 4.3Å; M238-I274 WeakPolarHBondContact CA-O 3.22Å; M238-N283 WeakPolarHBondContact O-CB 3.37Å; M238-N283 PolarHBondContact O-ND2 3.07Å |
| 239 | L | 98.4 | Very high | 95.9 | Very high | 10 Ų | 10 | 57.4 Ų | 57.4 | 5% | 0.052 | 32% | 0.322 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.1 | 116.7 | 168.2 | 169.2 | 56.3 | 0 | 0 | 0 | 108.8 | M216 K241 M251 V252 Q253 I274 N283 I285 | M216-L239 HydrophobicContact CE-CD1 4.23Å; L239-K241 HydrophobicContact CD1-CG 4.33Å; L239-K241 HydrophobicContact CG-CG 4.33Å; L239-M251 HydrophobicContact CD1-CB 4.22Å; L239-M251 HydrophobicContact CD1-SD 4.46Å; L239-V252 WeakPolarHBondContact CA-O 3.31Å; L239-Q253 HydrophobicContact CD1-CG 4.17Å; L239-I274 HydrophobicContact CB-CB 4.35Å; L239-I274 HydrophobicContact CD2-CD1 4.41Å; L239-I274 PolarHBondContact N-O 2.87Å; L239-I274 WeakPolarHBondContact O-CB 3.38Å; L239-I274 PolarHBondContact O-N 3.26Å; L239-N283 HydrophobicContact CB-CB 4.3Å; L239-I285 HydrophobicContact CD1-CD1 3.36Å; L239-I285 HydrophobicContact CD2-CD1 3.72Å; L239-I285 HydrophobicContact CG-CD1 4.19Å |
| 240 | K | 98.3 | Very high | 96 | Very high | 65 Ų | 65 | 59.1 Ų | 59.1 | 28% | 0.283 | 33% | 0.326 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.7 | 125.2 | 178.9 | 176.5 | -176.5 | -179.4 | 170.1 | 0 | 109.2 | M238 I242 M251 V252 M271 Q272 I273 | M238-K240 HydrophobicContact SD-CB 3.56Å; M238-K240 VanDerWaalsContact SD-CB 3.56Å; M238-K240 PolarHBondContact SD-N 2.89Å; K240-I242 HydrophobicContact CD-CD1 4.33Å; K240-I242 HydrophobicContact CG-CD1 3.87Å; K240-M251 CarbonylContact O-C 3.47Å; K240-M251 WeakPolarHBondContact O-CA 3.44Å; K240-V252 HydrophobicContact CB-CB 4.31Å; K240-V252 PolarHBondContact N-O 3.41Å; K240-V252 PolarHBondContact O-N 3.28Å; K240-M271 WeakPolarHBondContact CE-SD 3.43Å; K240-M271 HydrophobicContact CG-CG 4.23Å; K240-Q272 CarbonylContact C-O 3.53Å; K240-Q272 WeakPolarHBondContact CA-O 3.43Å; K240-I273 HydrophobicContact CG-CG1 4.46Å |
| 241 | K | 98.4 | Very high | 96 | Very high | 45 Ų | 45 | 54.8 Ų | 54.8 | 20% | 0.196 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.2 | 128.4 | 178.3 | -52.6 | -162.5 | 176.9 | -165.4 | 0 | 109.8 | L239 F243 L248 M251 Q272 | L239-K241 HydrophobicContact CD1-CG 4.33Å; L239-K241 HydrophobicContact CG-CG 4.33Å; K241-F243 HydrophobicContact CB-CD2 4.42Å; K241-F243 HydrophobicContact CB-CE2 3.62Å; K241-F243 HydrophobicContact CB-CZ 4Å; K241-F243 HydrophobicContact CD-CZ 4.42Å; K241-L248 HydrophobicContact CB-CD1 3.97Å; K241-M251 HydrophobicContact CB-CG 4.17Å; K241-M251 HydrophobicContact CD-CG 4.32Å; K241-M251 HydrophobicContact CD-SD 3.7Å; K241-M251 VanDerWaalsContact CE-SD 3.58Å; K241-M251 HydrophobicContact CG-CG 3.86Å; K241-M251 HydrophobicContact CG-SD 3.85Å; K241-Q272 HydrophobicContact CB-CB 4.42Å; K241-Q272 PolarHBondContact N-O 3.45Å; K241-Q272 PolarHBondContact O-N 3.42Å |
| 242 | I | 98.1 | Very high | 96.1 | Very high | 16 Ų | 16 | 55.8 Ų | 55.8 | 8% | 0.082 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.8 | 119.4 | -177.9 | -57.9 | 78.6 | 0 | 0 | 0 | 108.1 | K240 Q249 F250 V252 T269 | K240-I242 HydrophobicContact CD-CD1 4.33Å; K240-I242 HydrophobicContact CG-CD1 3.87Å; I242-Q249 PolarHBondContact O-N 3.22Å; I242-F250 HydrophobicContact CB-CD1 4.01Å; I242-F250 HydrophobicContact CB-CE1 3.77Å; I242-F250 HydrophobicContact CB-CE2 4.37Å; I242-F250 HydrophobicContact CB-CG 4.41Å; I242-F250 HydrophobicContact CB-CZ 3.96Å; I242-F250 HydrophobicContact CD1-CD2 3.7Å; I242-F250 HydrophobicContact CD1-CE1 4.4Å; I242-F250 HydrophobicContact CD1-CE2 3.43Å; I242-F250 VanDerWaalsContact CD1-CE2 3.43Å; I242-F250 HydrophobicContact CD1-CG 4.31Å; I242-F250 HydrophobicContact CD1-CZ 3.82Å; I242-F250 HydrophobicContact CG1-CD2 4.36Å; I242-F250 HydrophobicContact CG1-CE1 4.02Å; I242-F250 HydrophobicContact CG1-CE2 3.84Å; I242-F250 HydrophobicContact CG1-CZ 3.65Å; I242-F250 HydrophobicContact CG2-CD1 4.31Å; I242-F250 HydrophobicContact CG2-CE1 3.74Å; I242-F250 HydrophobicContact CG2-CZ 4.13Å; I242-F250 PolarHBondContact N-O 3.33Å; I242-F250 PolarHBondContact O-N 3.48Å; I242-V252 HydrophobicContact CD1-CG2 4.27Å; I242-T269 HydrophobicContact CG2-CG2 4.08Å |
| 243 | F | 98.2 | Very high | 96.4 | Very high | 38 Ų | 38 | 50.6 Ų | 50.6 | 17% | 0.167 | 29% | 0.285 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.9 | 144.1 | 178.3 | -50.2 | -106.1 | 0 | 0 | 0 | 109.9 | K241 K247 L248 T269 R270 Q272 | K241-F243 HydrophobicContact CB-CD2 4.42Å; K241-F243 HydrophobicContact CB-CE2 3.62Å; K241-F243 HydrophobicContact CB-CZ 4Å; K241-F243 HydrophobicContact CD-CZ 4.42Å; F243-K247 CarbonylContact C-O 3.58Å; F243-K247 WeakPolarHBondContact CA-O 3.41Å; F243-K247 WeakPolarHBondContact CB-O 3.43Å; F243-L248 HydrophobicContact CD1-CB 3.87Å; F243-L248 HydrophobicContact CD1-CD1 4.08Å; F243-L248 HydrophobicContact CE1-CB 3.94Å; F243-L248 HydrophobicContact CE1-CD1 3.89Å; F243-L248 HydrophobicContact CE1-CG 4.46Å; F243-L248 HydrophobicContact CE2-CD1 4.4Å; F243-L248 HydrophobicContact CG-CD1 4.4Å; F243-L248 HydrophobicContact CZ-CD1 4.06Å; F243-T269 CarbonylContact O-C 3.5Å; F243-T269 VanDerWaalsContact O-CA 3.3Å; F243-T269 WeakPolarHBondContact O-CA 3.48Å; F243-R270 HydrophobicContact CB-CB 4.25Å; F243-R270 HydrophobicContact CD2-CB 4.44Å; F243-R270 HydrophobicContact CD2-CG 4.27Å; F243-R270 PolarHBondContact N-O 2.88Å; F243-R270 PolarHBondContact O-N 2.95Å; F243-Q272 HydrophobicContact CE2-CB 4.12Å |
| 244 | E | 97.3 | Very high | 96.9 | Very high | 113 Ų | 113 | 44.3 Ų | 44.3 | 53% | 0.528 | 25% | 0.254 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.7 | 131.3 | 177.1 | -175.3 | 179.1 | -168.2 | 0 | 0 | 108.3 | G246 K247 Q249 | E244-G246 PolarHBondContact O-N 2.82Å; E244-G246 VanDerWaalsContact O-N 3.16Å; E244-K247 PolarHBondContact N-O 2.87Å; E244-K247 PolarHBondContact O-N 3.39Å; E244-K247 VanDerWaalsContact O-N 3.09Å; E244-Q249 HydrophobicContact CB-CG 3.65Å; E244-Q249 PolarHBondContact O-NE2 3.32Å |
| 245 | G | 94.4 | Very high | 97.4 | Very high | 79 Ų | 79 | 42.3 Ų | 42.3 | 81% | 0.814 | 24% | 0.24 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 61 | 20.2 | -170.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | K247 G268 | G245-K247 VanDerWaalsContact C-N 3.26Å; G245-K247 PolarHBondContact O-N 2.93Å; G245-G268 PolarHBondContact N-O 2.89Å |
| 246 | G | 92.6 | Very high | 97.5 | Very high | 65 Ų | 65 | 43.5 Ų | 43.5 | 67% | 0.67 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 83 | -17.5 | -172.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | E244 | E244-G246 PolarHBondContact O-N 2.82Å; E244-G246 VanDerWaalsContact O-N 3.16Å |
| 247 | K | 96.6 | Very high | 97.4 | Very high | 112 Ų | 112 | 45.1 Ų | 45.1 | 49% | 0.487 | 26% | 0.255 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.3 | 138.1 | 175 | -161 | -146.9 | 171.6 | -150.4 | 0 | 110.3 | D218 F243 E244 G245 Q249 | D218-K247 WeakPolarHBondContact OD2-CE 3.41Å; D218-K247 IonicContact OD2-NZ 2.67Å; D218-K247 PolarHBondContact OD2-NZ 2.04Å; F243-K247 CarbonylContact C-O 3.58Å; F243-K247 WeakPolarHBondContact CA-O 3.41Å; F243-K247 WeakPolarHBondContact CB-O 3.43Å; E244-K247 PolarHBondContact N-O 2.87Å; E244-K247 PolarHBondContact O-N 3.39Å; E244-K247 VanDerWaalsContact O-N 3.09Å; G245-K247 VanDerWaalsContact C-N 3.26Å; G245-K247 PolarHBondContact O-N 2.93Å; K247-Q249 PolarHBondContact O-N 3.18Å |
| 248 | L | 97.5 | Very high | 97 | Very high | 33 Ų | 33 | 52.6 Ų | 52.6 | 17% | 0.173 | 29% | 0.292 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.4 | 128 | 166.1 | -177.4 | 64.8 | 0 | 0 | 0 | 109.1 | D218 K241 F243 M251 | D218-L248 HydrophobicContact CB-CB 4.4Å; D218-L248 HydrophobicContact CB-CD2 4.24Å; D218-L248 HydrophobicContact CB-CG 4.23Å; K241-L248 HydrophobicContact CB-CD1 3.97Å; F243-L248 HydrophobicContact CD1-CB 3.87Å; F243-L248 HydrophobicContact CD1-CD1 4.08Å; F243-L248 HydrophobicContact CE1-CB 3.94Å; F243-L248 HydrophobicContact CE1-CD1 3.89Å; F243-L248 HydrophobicContact CE1-CG 4.46Å; F243-L248 HydrophobicContact CE2-CD1 4.4Å; F243-L248 HydrophobicContact CG-CD1 4.4Å; F243-L248 HydrophobicContact CZ-CD1 4.06Å; L248-M251 HydrophobicContact CD1-CG 3.92Å; L248-M251 HydrophobicContact CD1-SD 4.49Å; L248-M251 HydrophobicContact CD2-CE 4.11Å; L248-M251 HydrophobicContact CD2-CG 4.24Å; L248-M251 HydrophobicContact CD2-SD 3.98Å |
| 249 | Q | 97.8 | Very high | 96.8 | Very high | 68 Ų | 68 | 52.4 Ų | 52.4 | 32% | 0.318 | 29% | 0.292 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.2 | -51.3 | 178.7 | -60 | -60.1 | -12.5 | 0 | 0 | 111 | I242 E244 K247 | I242-Q249 PolarHBondContact O-N 3.22Å; E244-Q249 HydrophobicContact CB-CG 3.65Å; E244-Q249 PolarHBondContact O-NE2 3.32Å; K247-Q249 PolarHBondContact O-N 3.18Å |
| 250 | F | 98.2 | Very high | 96.6 | Very high | 65 Ų | 65 | 55.5 Ų | 55.5 | 29% | 0.285 | 31% | 0.313 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -157.3 | 167.5 | 178.1 | 67 | -82.6 | 0 | 0 | 0 | 112.1 | Y215 M216 I242 V252 | Y215-F250 HydrophobicContact CD2-CB 3.8Å; Y215-F250 AromaticContact CD2-CD2 3.73Å; Y215-F250 HydrophobicContact CD2-CD2 3.73Å; Y215-F250 HydrophobicContact CD2-CE2 4.47Å; Y215-F250 AromaticContact CD2-CG 3.9Å; Y215-F250 HydrophobicContact CD2-CG 3.9Å; Y215-F250 HydrophobicContact CE2-CB 3.34Å; Y215-F250 HydrophobicContact CE2-CD1 4.14Å; Y215-F250 AromaticContact CE2-CD2 3.9Å; Y215-F250 HydrophobicContact CE2-CD2 3.9Å; Y215-F250 AromaticContact CE2-CG 3.57Å; Y215-F250 HydrophobicContact CE2-CG 3.57Å; M216-F250 VanDerWaalsContact O-CA 3.26Å; M216-F250 WeakPolarHBondContact O-CA 3.28Å; M216-F250 VanDerWaalsContact O-CB 3.25Å; M216-F250 WeakPolarHBondContact O-CB 3.06Å; I242-F250 HydrophobicContact CB-CD1 4.01Å; I242-F250 HydrophobicContact CB-CE1 3.77Å; I242-F250 HydrophobicContact CB-CE2 4.37Å; I242-F250 HydrophobicContact CB-CG 4.41Å; I242-F250 HydrophobicContact CB-CZ 3.96Å; I242-F250 HydrophobicContact CD1-CD2 3.7Å; I242-F250 HydrophobicContact CD1-CE1 4.4Å; I242-F250 HydrophobicContact CD1-CE2 3.43Å; I242-F250 VanDerWaalsContact CD1-CE2 3.43Å; I242-F250 HydrophobicContact CD1-CG 4.31Å; I242-F250 HydrophobicContact CD1-CZ 3.82Å; I242-F250 HydrophobicContact CG1-CD2 4.36Å; I242-F250 HydrophobicContact CG1-CE1 4.02Å; I242-F250 HydrophobicContact CG1-CE2 3.84Å; I242-F250 HydrophobicContact CG1-CZ 3.65Å; I242-F250 HydrophobicContact CG2-CD1 4.31Å; I242-F250 HydrophobicContact CG2-CE1 3.74Å; I242-F250 HydrophobicContact CG2-CZ 4.13Å; I242-F250 PolarHBondContact N-O 3.33Å; I242-F250 PolarHBondContact O-N 3.48Å; F250-V252 HydrophobicContact CD2-CG2 4.06Å; F250-V252 HydrophobicContact CE2-CG2 3.98Å |
| 251 | M | 98.6 | Very high | 96.5 | Very high | 2 Ų | 2 | 56.1 Ų | 56.1 | 1% | 0.01 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.8 | 158.8 | 174.3 | -57.9 | 179.9 | -77.2 | 0 | 0 | 111.1 | M216 N217 L239 K240 K241 L248 I285 | M216-M251 HydrophobicContact CB-CB 4.16Å; M216-M251 HydrophobicContact CE-CB 3.61Å; M216-M251 PolarHBondContact N-O 2.03Å; M216-M251 PolarHBondContact O-N 3.04Å; M216-M251 HydrophobicContact SD-CB 4.37Å; N217-M251 WeakPolarHBondContact O-CE 3.03Å; L239-M251 HydrophobicContact CD1-CB 4.22Å; L239-M251 HydrophobicContact CD1-SD 4.46Å; K240-M251 CarbonylContact O-C 3.47Å; K240-M251 WeakPolarHBondContact O-CA 3.44Å; K241-M251 HydrophobicContact CB-CG 4.17Å; K241-M251 HydrophobicContact CD-CG 4.32Å; K241-M251 HydrophobicContact CD-SD 3.7Å; K241-M251 VanDerWaalsContact CE-SD 3.58Å; K241-M251 HydrophobicContact CG-CG 3.86Å; K241-M251 HydrophobicContact CG-SD 3.85Å; L248-M251 HydrophobicContact CD1-CG 3.92Å; L248-M251 HydrophobicContact CD1-SD 4.49Å; L248-M251 HydrophobicContact CD2-CE 4.11Å; L248-M251 HydrophobicContact CD2-CG 4.24Å; L248-M251 HydrophobicContact CD2-SD 3.98Å; M251-I285 HydrophobicContact CE-CD1 4.24Å; M251-I285 HydrophobicContact CE-CG1 4.39Å; M251-I285 HydrophobicContact CE-CG2 3.99Å; M251-I285 HydrophobicContact SD-CD1 4.08Å; M251-I285 HydrophobicContact SD-CG2 4.42Å |
| 252 | V | 98.6 | Very high | 96.4 | Very high | 30 Ų | 30 | 57.4 Ų | 57.4 | 18% | 0.182 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.3 | 141.9 | 176.8 | -173.9 | 0 | 0 | 0 | 0 | 109 | C213 L239 K240 I242 F250 | C213-V252 WeakPolarHBondContact O-CA 3.26Å; C213-V252 WeakPolarHBondContact O-CG1 3.29Å; L239-V252 WeakPolarHBondContact CA-O 3.31Å; K240-V252 HydrophobicContact CB-CB 4.31Å; K240-V252 PolarHBondContact N-O 3.41Å; K240-V252 PolarHBondContact O-N 3.28Å; I242-V252 HydrophobicContact CD1-CG2 4.27Å; F250-V252 HydrophobicContact CD2-CG2 4.06Å; F250-V252 HydrophobicContact CE2-CG2 3.98Å |
| 253 | Q | 98.6 | Very high | 96.3 | Very high | 22 Ų | 22 | 59.9 Ų | 59.9 | 10% | 0.103 | 35% | 0.346 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.3 | 143.4 | 178.8 | -93.7 | 168.6 | -14.1 | 0 | 0 | 110.4 | T212 C213 M216 M238 L239 N283 | T212-Q253 WeakPolarHBondContact CA-O 3.05Å; C213-Q253 HydrophobicContact CB-CB 4.37Å; C213-Q253 PolarHBondContact N-O 2.79Å; C213-Q253 PolarHBondContact O-N 3.42Å; M216-Q253 HydrophobicContact CE-CB 3.84Å; M216-Q253 HydrophobicContact CE-CG 3.5Å; M216-Q253 HydrophobicContact SD-CG 4.39Å; M238-Q253 WeakPolarHBondContact O-CA 3.27Å; L239-Q253 HydrophobicContact CD1-CG 4.17Å; Q253-N283 PolarHBondContact NE2-O 3.11Å |
| 254 | G | 98 | Very high | 96.2 | Very high | 9 Ų | 9 | 61.7 Ų | 61.7 | 9% | 0.093 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 176.1 | -162 | 169.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y211 M238 | Y211-G254 WeakPolarHBondContact O-CA 3.46Å; Y211-G254 PolarHBondContact O-N 3.16Å; M238-G254 PolarHBondContact N-O 3.49Å; M238-G254 PolarHBondContact O-N 3.34Å |
| 255 | C | 97.9 | Very high | 96.1 | Very high | 22 Ų | 22 | 63.2 Ų | 63.2 | 15% | 0.149 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.5 | 113.5 | 175.6 | -64.3 | 0 | 0 | 0 | 0 | 108.3 | C229 T231 Q235 | C229-C255 VanDerWaalsContact C-SG 3.52Å; C229-C255 HydrophobicContact CB-CB 4.05Å; C229-C255 WeakPolarHBondContact CB-SG 3.31Å; C229-C255 WeakPolarHBondContact SG-CB 3.06Å; C229-C255 PolarHBondContact SG-N 3.06Å; C229-C255 CovalentContact SG-SG 2.04Å; C229-C255 PolarHBondContact SG-SG 3.38Å; T231-C255 HydrophobicContact CG2-CB 4.45Å; Q235-C255 HydrophobicContact CB-CB 4.46Å; Q235-C255 PolarHBondContact NE2-O 3.26Å |
| 256 | E | 96.8 | Very high | 96.1 | Very high | 66 Ų | 66 | 63 Ų | 63 | 31% | 0.308 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.8 | 136.3 | -168.7 | -173.2 | 59.3 | -83.2 | 0 | 0 | 112.4 | Q235 Q236 M238 C259 | Q235-E256 VanDerWaalsContact CA-O 3.26Å; Q235-E256 WeakPolarHBondContact CA-O 3.45Å; Q236-E256 PolarHBondContact N-O 3.09Å; Q236-E256 PolarHBondContact O-N 3.37Å; M238-E256 HydrophobicContact CB-CB 3.53Å; M238-E256 HydrophobicContact CB-CG 4.48Å; M238-E256 HydrophobicContact CE-CB 4.18Å; M238-E256 HydrophobicContact CE-CG 4.45Å; M238-E256 HydrophobicContact CG-CB 3.79Å; M238-E256 HydrophobicContact CG-CG 4.22Å; E256-C259 HydrophobicContact CB-CB 4.06Å; E256-C259 HydrophobicContact CG-CB 4.07Å |
| 257 | N | 94.1 | Very high | 96.1 | Very high | 75 Ų | 75 | 69 Ų | 69 | 40% | 0.401 | 36% | 0.358 | S | S | . | . | S | Bend | trans | -84.2 | 143.6 | 175.3 | -74.2 | -75.2 | 0 | 0 | 0 | 110 | Q235 C259 | Q235-N257 VanDerWaalsContact CG-OD1 3.31Å; Q235-N257 WeakPolarHBondContact CG-OD1 3.43Å; Q235-N257 PolarHBondContact NE2-ND2 3.32Å; N257-C259 PolarHBondContact O-N 3.16Å |
| 258 | M | 90.4 | Very high | 95.8 | Very high | 156 Ų | 156 | 66.6 Ų | 66.6 | 77% | 0.768 | 37% | 0.366 | S | S | * | . | S | Bend | trans | 49.8 | 55.4 | 179.8 | -60.1 | -61 | 159 | 0 | 0 | 112.1 | P260 | M258-P260 VanDerWaalsContact C-CD 3.49Å; M258-P260 WeakPolarHBondContact O-CD 3.33Å |
| 259 | C | 93.9 | Very high | 95.8 | Very high | 9 Ų | 9 | 67.4 Ų | 67.4 | 6% | 0.061 | 37% | 0.372 | C | S | . | . | trans | -96.4 | 94.8 | -176.3 | -163 | 0 | 0 | 0 | 0 | 111.4 | Q236 E256 N257 C275 | Q236-C259 HydrophobicContact CB-CB 4.41Å; Q236-C259 PolarHBondContact NE2-O 2.93Å; E256-C259 HydrophobicContact CB-CB 4.06Å; E256-C259 HydrophobicContact CG-CB 4.07Å; N257-C259 PolarHBondContact O-N 3.16Å; C259-C275 WeakPolarHBondContact CA-SG 3.41Å; C259-C275 HydrophobicContact CB-CB 3.76Å; C259-C275 WeakPolarHBondContact CB-SG 3.42Å; C259-C275 VanDerWaalsContact O-CB 3.31Å; C259-C275 WeakPolarHBondContact O-CB 3.39Å; C259-C275 PolarHBondContact O-SG 3.28Å; C259-C275 WeakPolarHBondContact SG-CB 3.39Å; C259-C275 CovalentContact SG-SG 2.03Å; C259-C275 PolarHBondContact SG-SG 2.9Å | ||
| 260 | P | 94.3 | Very high | 95.8 | Very high | 75 Ų | 75 | 68.6 Ų | 68.6 | 49% | 0.487 | 37% | 0.374 | S | S | . | . | trans | -87.1 | 136.5 | 162.7 | 34.4 | -34.3 | 0 | 0 | 0 | 110.8 | M258 M262 | M258-P260 VanDerWaalsContact C-CD 3.49Å; M258-P260 WeakPolarHBondContact O-CD 3.33Å; P260-M262 HydrophobicContact CG-SD 4.05Å; P260-M262 PolarHBondContact O-N 2.82Å | ||
| 261 | S | 96.1 | Very high | 95.7 | Very high | 78 Ų | 78 | 68.1 Ų | 68.1 | 55% | 0.545 | 37% | 0.373 | S | S | . | . | trans | -68 | 115 | 169.4 | -65.8 | 0 | 0 | 0 | 0 | 109.7 | I273 C275 | S261-I273 CarbonylContact C-O 3.49Å; S261-I273 VanDerWaalsContact CA-O 3.28Å; S261-I273 WeakPolarHBondContact CA-O 3.11Å; S261-C275 PolarHBondContact OG-N 3.05Å; S261-C275 PolarHBondContact OG-O 3.15Å | ||
| 262 | M | 96.4 | Very high | 95.7 | Very high | 72 Ų | 72 | 70.4 Ų | 70.4 | 36% | 0.355 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.2 | 167.5 | -172 | 71.5 | -177.1 | -52.7 | 0 | 0 | 113.3 | P260 L264 I273 | P260-M262 HydrophobicContact CG-SD 4.05Å; P260-M262 PolarHBondContact O-N 2.82Å; M262-L264 HydrophobicContact CE-CD1 4.36Å; M262-L264 HydrophobicContact CE-CD2 3.67Å; M262-L264 HydrophobicContact CE-CG 3.92Å; M262-L264 HydrophobicContact CG-CG 4.5Å; M262-L264 HydrophobicContact SD-CD1 4.19Å; M262-L264 HydrophobicContact SD-CG 4.3Å; M262-I273 HydrophobicContact CG-CB 4.26Å; M262-I273 HydrophobicContact CG-CD1 4.29Å; M262-I273 PolarHBondContact N-O 3.43Å; M262-I273 PolarHBondContact O-N 3.24Å |
| 263 | N | 96.6 | Very high | 95.7 | Very high | 69 Ų | 69 | 70.5 Ų | 70.5 | 37% | 0.369 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.1 | 128.5 | 171 | -69.6 | -101.4 | 0 | 0 | 0 | 109.4 | F265 R270 | N263-F265 HydrophobicContact CB-CE2 3.74Å; N263-F265 HydrophobicContact CB-CZ 4.37Å; N263-R270 PolarHBondContact OD1-NE 3.23Å; N263-R270 VanDerWaalsContact OD1-NE 3.11Å; N263-R270 PolarHBondContact OD1-NH2 2.83Å |
| 264 | L | 95.4 | Very high | 95.7 | Very high | 76 Ų | 76 | 72.1 Ų | 72.1 | 40% | 0.398 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 141 | 177.1 | -68.5 | 159.3 | 0 | 0 | 0 | 108.5 | M262 R270 M271 I273 | M262-L264 HydrophobicContact CE-CD1 4.36Å; M262-L264 HydrophobicContact CE-CD2 3.67Å; M262-L264 HydrophobicContact CE-CG 3.92Å; M262-L264 HydrophobicContact CG-CG 4.5Å; M262-L264 HydrophobicContact SD-CD1 4.19Å; M262-L264 HydrophobicContact SD-CG 4.3Å; L264-R270 CarbonylContact O-C 3.57Å; L264-R270 WeakPolarHBondContact O-CA 2.9Å; L264-M271 HydrophobicContact CB-CB 4.24Å; L264-M271 HydrophobicContact CD1-SD 4.05Å; L264-M271 PolarHBondContact N-O 3.39Å; L264-M271 PolarHBondContact O-N 2.97Å; L264-I273 HydrophobicContact CD1-CD1 4.25Å |
| 265 | F | 95.8 | Very high | 95.6 | Very high | 145 Ų | 145 | 72.5 Ų | 72.5 | 64% | 0.636 | 39% | 0.393 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -132.7 | 130.9 | -179 | -64.3 | -99.8 | 0 | 0 | 0 | 109.5 | N263 T269 R270 | N263-F265 HydrophobicContact CB-CE2 3.74Å; N263-F265 HydrophobicContact CB-CZ 4.37Å; F265-T269 WeakPolarHBondContact CA-O 3.49Å; F265-R270 HydrophobicContact CD1-CB 3.83Å; F265-R270 HydrophobicContact CD1-CG 3.89Å; F265-R270 HydrophobicContact CE1-CB 3.87Å; F265-R270 HydrophobicContact CE1-CG 3.54Å; F265-R270 HydrophobicContact CZ-CG 3.88Å |
| 266 | S | 93.6 | Very high | 95.6 | Very high | 74 Ų | 74 | 72.6 Ų | 72.6 | 52% | 0.517 | 39% | 0.393 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -158.9 | 129.7 | 179.7 | -167.9 | 0 | 0 | 0 | 0 | 110.4 | G268 T269 | S266-G268 VanDerWaalsContact C-N 3.33Å; S266-G268 PolarHBondContact O-N 2.82Å; S266-G268 VanDerWaalsContact O-N 3.13Å; S266-T269 PolarHBondContact N-O 2.83Å; S266-T269 WeakPolarHBondContact O-CA 3.28Å; S266-T269 WeakPolarHBondContact O-CB 3.07Å; S266-T269 PolarHBondContact O-N 3.11Å; S266-T269 VanDerWaalsContact O-O 3.13Å |
| 267 | H | 92.3 | Very high | 95.4 | Very high | 190 Ų | 190 | 76.6 Ų | 76.6 | 88% | 0.88 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 43.7 | 48 | 174.1 | -57.4 | -74 | 0 | 0 | 0 | 115.4 | T269 | H267-T269 PolarHBondContact O-N 2.78Š|
| 268 | G | 91.9 | Very high | 95.3 | Very high | 63 Ų | 63 | 79.9 Ų | 79.9 | 65% | 0.649 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.9 | -8.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | G245 S266 | G245-G268 PolarHBondContact N-O 2.89Å; S266-G268 VanDerWaalsContact C-N 3.33Å; S266-G268 PolarHBondContact O-N 2.82Å; S266-G268 VanDerWaalsContact O-N 3.13Å |
| 269 | T | 96.7 | Very high | 95.5 | Very high | 49 Ų | 49 | 78.7 Ų | 78.7 | 30% | 0.301 | 42% | 0.416 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.6 | 135 | 169.6 | -60.7 | 0 | 0 | 0 | 0 | 110.6 | I242 F243 F265 S266 H267 | I242-T269 HydrophobicContact CG2-CG2 4.08Å; F243-T269 CarbonylContact O-C 3.5Å; F243-T269 VanDerWaalsContact O-CA 3.3Å; F243-T269 WeakPolarHBondContact O-CA 3.48Å; F265-T269 WeakPolarHBondContact CA-O 3.49Å; S266-T269 PolarHBondContact N-O 2.83Å; S266-T269 WeakPolarHBondContact O-CA 3.28Å; S266-T269 WeakPolarHBondContact O-CB 3.07Å; S266-T269 PolarHBondContact O-N 3.11Å; S266-T269 VanDerWaalsContact O-O 3.13Å; H267-T269 PolarHBondContact O-N 2.78Å |
| 270 | R | 97.2 | Very high | 95.6 | Very high | 93 Ų | 93 | 80.1 Ų | 80.1 | 35% | 0.351 | 43% | 0.426 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.6 | 129.4 | 166.3 | 173.5 | -170.6 | -177.2 | 170.9 | -0.9 | 108.9 | F243 N263 L264 F265 | F243-R270 HydrophobicContact CB-CB 4.25Å; F243-R270 HydrophobicContact CD2-CB 4.44Å; F243-R270 HydrophobicContact CD2-CG 4.27Å; F243-R270 PolarHBondContact N-O 2.88Å; F243-R270 PolarHBondContact O-N 2.95Å; N263-R270 PolarHBondContact OD1-NE 3.23Å; N263-R270 VanDerWaalsContact OD1-NE 3.11Å; N263-R270 PolarHBondContact OD1-NH2 2.83Å; L264-R270 CarbonylContact O-C 3.57Å; L264-R270 WeakPolarHBondContact O-CA 2.9Å; F265-R270 HydrophobicContact CD1-CB 3.83Å; F265-R270 HydrophobicContact CD1-CG 3.89Å; F265-R270 HydrophobicContact CE1-CB 3.87Å; F265-R270 HydrophobicContact CE1-CG 3.54Å; F265-R270 HydrophobicContact CZ-CG 3.88Å |
| 271 | M | 97.4 | Very high | 95.8 | Very high | 56 Ų | 56 | 80.1 Ų | 80.1 | 28% | 0.276 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 114.3 | 173.4 | 178.5 | -171.8 | -55.6 | 0 | 0 | 108.5 | K240 L264 I273 | K240-M271 WeakPolarHBondContact CE-SD 3.43Å; K240-M271 HydrophobicContact CG-CG 4.23Å; L264-M271 HydrophobicContact CB-CB 4.24Å; L264-M271 HydrophobicContact CD1-SD 4.05Å; L264-M271 PolarHBondContact N-O 3.39Å; L264-M271 PolarHBondContact O-N 2.97Å; M271-I273 HydrophobicContact CG-CG1 4.33Å; M271-I273 HydrophobicContact SD-CD1 4.4Å |
| 272 | Q | 98 | Very high | 95.9 | Very high | 50 Ų | 50 | 78.1 Ų | 78.1 | 23% | 0.234 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.7 | 125 | 173.4 | -176.1 | 179.8 | 13.5 | 0 | 0 | 108.6 | K240 K241 F243 I274 | K240-Q272 CarbonylContact C-O 3.53Å; K240-Q272 WeakPolarHBondContact CA-O 3.43Å; K241-Q272 HydrophobicContact CB-CB 4.42Å; K241-Q272 PolarHBondContact N-O 3.45Å; K241-Q272 PolarHBondContact O-N 3.42Å; F243-Q272 HydrophobicContact CE2-CB 4.12Å; Q272-I274 HydrophobicContact CG-CD1 4.38Å; Q272-I274 HydrophobicContact CG-CG1 4.03Å |
| 273 | I | 98.1 | Very high | 95.9 | Very high | 32 Ų | 32 | 74.9 Ų | 74.9 | 16% | 0.164 | 39% | 0.388 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.9 | 130.3 | 173.5 | -54.9 | 177.5 | 0 | 0 | 0 | 107.2 | M238 K240 S261 M262 L264 M271 | M238-I273 HydrophobicContact CG-CG2 4.3Å; K240-I273 HydrophobicContact CG-CG1 4.46Å; S261-I273 CarbonylContact C-O 3.49Å; S261-I273 VanDerWaalsContact CA-O 3.28Å; S261-I273 WeakPolarHBondContact CA-O 3.11Å; M262-I273 HydrophobicContact CG-CB 4.26Å; M262-I273 HydrophobicContact CG-CD1 4.29Å; M262-I273 PolarHBondContact N-O 3.43Å; M262-I273 PolarHBondContact O-N 3.24Å; L264-I273 HydrophobicContact CD1-CD1 4.25Å; M271-I273 HydrophobicContact CG-CG1 4.33Å; M271-I273 HydrophobicContact SD-CD1 4.4Å |
| 274 | I | 97.9 | Very high | 95.9 | Very high | 56 Ų | 56 | 78.4 Ų | 78.4 | 29% | 0.287 | 40% | 0.4 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 123.5 | 179.7 | -53.4 | 173 | 0 | 0 | 0 | 106.8 | M238 L239 Q272 | M238-I274 WeakPolarHBondContact CA-O 3.22Å; L239-I274 HydrophobicContact CB-CB 4.35Å; L239-I274 HydrophobicContact CD2-CD1 4.41Å; L239-I274 PolarHBondContact N-O 2.87Å; L239-I274 WeakPolarHBondContact O-CB 3.38Å; L239-I274 PolarHBondContact O-N 3.26Å; Q272-I274 HydrophobicContact CG-CD1 4.38Å; Q272-I274 HydrophobicContact CG-CG1 4.03Å |
| 275 | C | 97.5 | Very high | 95.8 | Very high | 17 Ų | 17 | 79.8 Ų | 79.8 | 12% | 0.115 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.8 | 136.3 | -175.8 | -50.9 | 0 | 0 | 0 | 0 | 109.4 | C237 C259 S261 | C237-C275 WeakPolarHBondContact O-CA 3.3Å; C259-C275 WeakPolarHBondContact CA-SG 3.41Å; C259-C275 HydrophobicContact CB-CB 3.76Å; C259-C275 WeakPolarHBondContact CB-SG 3.42Å; C259-C275 VanDerWaalsContact O-CB 3.31Å; C259-C275 WeakPolarHBondContact O-CB 3.39Å; C259-C275 PolarHBondContact O-SG 3.28Å; C259-C275 WeakPolarHBondContact SG-CB 3.39Å; C259-C275 CovalentContact SG-SG 2.03Å; C259-C275 PolarHBondContact SG-SG 2.9Å; S261-C275 PolarHBondContact OG-N 3.05Å; S261-C275 PolarHBondContact OG-O 3.15Å |
| 276 | C | 96.1 | Very high | 95.8 | Very high | 23 Ų | 23 | 76.5 Ų | 76.5 | 16% | 0.155 | 40% | 0.395 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.4 | 147.1 | -179.1 | 64.2 | 0 | 0 | 0 | 0 | 111.9 | C237 C282 | C237-C276 PolarHBondContact N-O 2.03Å; C237-C276 PolarHBondContact O-N 3.2Å; C276-C282 VanDerWaalsContact C-SG 3.51Å; C276-C282 HydrophobicContact CB-CB 3.91Å; C276-C282 WeakPolarHBondContact CB-SG 3.25Å; C276-C282 PolarHBondContact O-SG 3.19Å; C276-C282 WeakPolarHBondContact SG-CB 3.34Å; C276-C282 PolarHBondContact SG-O 3.41Å; C276-C282 VanDerWaalsContact SG-O 3.4Å; C276-C282 CovalentContact SG-SG 2.04Å; C276-C282 PolarHBondContact SG-SG 3.25Å |
| 277 | R | 93.9 | Very high | 95.9 | Very high | 151 Ų | 151 | 76.6 Ų | 76.6 | 57% | 0.57 | 39% | 0.389 | S | S | * | . | trans | -140 | 17.8 | -176.1 | 64.3 | 176.7 | -177.9 | 172.9 | 2.1 | 113.7 | L208 Q236 | L208-R277 HydrophobicContact CD1-CB 4.34Å; Q236-R277 HydrophobicContact CG-CB 4.12Å | ||
| 278 | N | 90.8 | Very high | 96.1 | Very high | 143 Ų | 143 | 70.3 Ų | 70.3 | 77% | 0.765 | 36% | 0.361 | S | S | * | . | S | Bend | trans | -91.6 | -26.3 | -165.9 | -58 | 19 | 0 | 0 | 0 | 112.5 | ||
| 279 | Q | 95.1 | Very high | 96.3 | Very high | 131 Ų | 131 | 70.8 Ų | 70.8 | 61% | 0.612 | 35% | 0.345 | S | S | * | . | S | Bend | trans | -162.5 | 162.9 | -179 | 59.6 | 178.4 | 86.5 | 0 | 0 | 109.5 | C282 | Q279-C282 HydrophobicContact CG-CB 3.78Å; Q279-C282 WeakPolarHBondContact O-CB 3.44Å; Q279-C282 PolarHBondContact O-SG 2.84Å; Q279-C282 VanDerWaalsContact O-SG 3.4Å |
| 280 | S | 97.4 | Very high | 96.3 | Very high | 39 Ų | 39 | 72.1 Ų | 72.1 | 27% | 0.273 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.3 | 149.7 | 168.6 | -71.8 | 0 | 0 | 0 | 0 | 110.7 | N209 C282 | N209-S280 PolarHBondContact N-OG 2.91Å; N209-S280 CarbonylContact O-C 3.51Å; N209-S280 VanDerWaalsContact O-CA 3.24Å; N209-S280 WeakPolarHBondContact O-CA 3.24Å; N209-S280 WeakPolarHBondContact O-CB 3.47Å; S280-C282 PolarHBondContact O-N 3.27Å |
| 281 | F | 97.9 | Very high | 96.2 | Very high | 75 Ų | 75 | 70.7 Ų | 70.7 | 33% | 0.329 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 60.9 | 19.4 | 178.3 | -54.2 | -64.1 | 0 | 0 | 0 | 115 | N209 Y211 T228 N283 K284 | N209-F281 HydrophobicContact CB-CD1 4.4Å; N209-F281 HydrophobicContact CB-CE1 3.67Å; N209-F281 HydrophobicContact CB-CE2 3.87Å; N209-F281 HydrophobicContact CB-CZ 3.36Å; N209-F281 PolarHBondContact O-N 3.13Å; Y211-F281 HydrophobicContact CD1-CD1 4.09Å; Y211-F281 HydrophobicContact CD2-CB 4.12Å; Y211-F281 HydrophobicContact CD2-CD1 4.08Å; Y211-F281 AromaticContact CE1-CD1 3.95Å; Y211-F281 HydrophobicContact CE1-CD1 3.95Å; Y211-F281 HydrophobicContact CE1-CE1 4.4Å; Y211-F281 HydrophobicContact CE2-CB 3.61Å; Y211-F281 AromaticContact CE2-CD1 3.95Å; Y211-F281 HydrophobicContact CE2-CD1 3.95Å; Y211-F281 HydrophobicContact CE2-CG 4.1Å; Y211-F281 HydrophobicContact CG-CD1 4.15Å; Y211-F281 AromaticContact CZ-CD1 3.87Å; T228-F281 HydrophobicContact CG2-CE1 3.71Å; T228-F281 HydrophobicContact CG2-CZ 4.35Å; F281-N283 PolarHBondContact O-N 3.09Å; F281-N283 VanDerWaalsContact O-N 3.13Å; F281-K284 PolarHBondContact O-N 3.21Å |
| 282 | C | 97.6 | Very high | 96.1 | Very high | 37 Ų | 37 | 71.8 Ų | 71.8 | 25% | 0.25 | 35% | 0.352 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -13.5 | -179 | 65.8 | 0 | 0 | 0 | 0 | 114.6 | C276 Q279 S280 K284 | C276-C282 VanDerWaalsContact C-SG 3.51Å; C276-C282 HydrophobicContact CB-CB 3.91Å; C276-C282 WeakPolarHBondContact CB-SG 3.25Å; C276-C282 PolarHBondContact O-SG 3.19Å; C276-C282 WeakPolarHBondContact SG-CB 3.34Å; C276-C282 PolarHBondContact SG-O 3.41Å; C276-C282 VanDerWaalsContact SG-O 3.4Å; C276-C282 CovalentContact SG-SG 2.04Å; C276-C282 PolarHBondContact SG-SG 3.25Å; Q279-C282 HydrophobicContact CG-CB 3.78Å; Q279-C282 WeakPolarHBondContact O-CB 3.44Å; Q279-C282 PolarHBondContact O-SG 2.84Å; Q279-C282 VanDerWaalsContact O-SG 3.4Å; S280-C282 PolarHBondContact O-N 3.27Å; C282-K284 VanDerWaalsContact C-N 3.29Å; C282-K284 PolarHBondContact O-N 3.26Å |
| 283 | N | 97.3 | Very high | 96 | Very high | 4 Ų | 4 | 73.5 Ų | 73.5 | 2% | 0.021 | 36% | 0.361 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.7 | 12.7 | 177.6 | 67.6 | -29 | 0 | 0 | 0 | 114.1 | Y211 C237 M238 L239 Q253 F281 | Y211-N283 PolarHBondContact N-OD1 2.04Å; Y211-N283 PolarHBondContact O-ND2 3.48Å; C237-N283 HydrophobicContact CB-CB 3.87Å; M238-N283 WeakPolarHBondContact O-CB 3.37Å; M238-N283 PolarHBondContact O-ND2 3.07Å; L239-N283 HydrophobicContact CB-CB 4.3Å; Q253-N283 PolarHBondContact NE2-O 3.11Å; F281-N283 PolarHBondContact O-N 3.09Å; F281-N283 VanDerWaalsContact O-N 3.13Å |
| 284 | K | 96.3 | Very high | 95.8 | Very high | 143 Ų | 143 | 76.9 Ų | 76.9 | 62% | 0.622 | 38% | 0.378 | S | S | * | . | trans | -55.1 | 150.5 | 173.6 | -161.4 | 179.7 | 173.8 | -179.9 | 0 | 111.7 | Y211 F281 C282 | Y211-K284 HydrophobicContact CD2-CB 4.14Å; Y211-K284 HydrophobicContact CD2-CG 4.39Å; Y211-K284 HydrophobicContact CE2-CB 3.87Å; Y211-K284 HydrophobicContact CE2-CD 4.25Å; Y211-K284 HydrophobicContact CE2-CG 3.87Å; F281-K284 PolarHBondContact O-N 3.21Å; C282-K284 VanDerWaalsContact C-N 3.29Å; C282-K284 PolarHBondContact O-N 3.26Å | ||
| 285 | I | 92.3 | Very high | 95.6 | Very high | 104 Ų | 104 | 78.8 Ų | 78.8 | 53% | 0.533 | 39% | 0.386 | S | S | . | . | trans | -82.4 | 0 | 171.4 | -42.3 | -55.7 | 0 | 0 | 0 | 110 | M216 L239 M251 | M216-I285 HydrophobicContact CE-CD1 4.06Å; M216-I285 HydrophobicContact SD-CD1 3.8Å; M216-I285 HydrophobicContact SD-CG1 3.77Å; L239-I285 HydrophobicContact CD1-CD1 3.36Å; L239-I285 HydrophobicContact CD2-CD1 3.72Å; L239-I285 HydrophobicContact CG-CD1 4.19Å; M251-I285 HydrophobicContact CE-CD1 4.24Å; M251-I285 HydrophobicContact CE-CG1 4.39Å; M251-I285 HydrophobicContact CE-CG2 3.99Å; M251-I285 HydrophobicContact SD-CD1 4.08Å; M251-I285 HydrophobicContact SD-CG2 4.42Å |
Retrieved 285 of 285 residues in 61.4 ms
(Link to these results)