| 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 | 45.3 | Very low | 43.9 | Very low | 252 Ų | 252 | 147.1 Ų | 147.1 | 100% | 1.241 | 87% | 0.866 | S | S | * | * | 0 | 129.5 | 0 | -68.6 | -179.8 | -170.2 | 0 | 0 | 107.8 | |||||
| 2 | G | 51 | Low | 43.2 | Very low | 83 Ų | 83 | 149.3 Ų | 149.3 | 86% | 0.856 | 86% | 0.862 | S | S | * | * | trans | 94.4 | 69.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 3 | N | 37.4 | Very low | 43 | Very low | 154 Ų | 154 | 153.7 Ų | 153.7 | 82% | 0.824 | 86% | 0.855 | S | S | * | * | trans | -94.9 | 134.1 | 154.4 | -118.6 | 20 | 0 | 0 | 0 | 107.4 | ||||
| 4 | T | 51.9 | Low | 42.9 | Very low | 144 Ų | 144 | 155 Ų | 155 | 88% | 0.883 | 85% | 0.851 | S | S | * | * | trans | -145.3 | 103.4 | 151.3 | 55.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 5 | S | 40.4 | Very low | 42.4 | Very low | 111 Ų | 111 | 150.2 Ų | 150.2 | 78% | 0.776 | 85% | 0.851 | S | S | * | * | trans | -75.8 | 147.8 | 160 | -57 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 6 | S | 54.9 | Low | 42.4 | Very low | 123 Ų | 123 | 146.1 Ų | 146.1 | 86% | 0.86 | 85% | 0.852 | S | S | * | * | trans | -133 | 113 | 160.3 | -177.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 7 | E | 39 | Very low | 42.3 | Very low | 158 Ų | 158 | 148.6 Ų | 148.6 | 74% | 0.738 | 85% | 0.854 | S | S | * | * | trans | -99.3 | 163.5 | 167.3 | -69.9 | -169.9 | 122.6 | 0 | 0 | 111 | ||||
| 8 | R | 40.4 | Very low | 42.4 | Very low | 227 Ų | 227 | 150.9 Ų | 150.9 | 86% | 0.857 | 85% | 0.852 | S | S | * | * | trans | 89.7 | 115.2 | 155.7 | -72 | -173.6 | 162.5 | 89.5 | -1 | 119.9 | ||||
| 9 | A | 42 | Very low | 42.8 | Very low | 96 Ų | 96 | 149.5 Ų | 149.5 | 79% | 0.793 | 85% | 0.848 | S | S | * | * | 177.8 | 105.5 | 111.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | |||||
| 10 | A | 36.9 | Very low | 42.7 | Very low | 95 Ų | 95 | 148.1 Ų | 148.1 | 79% | 0.785 | 85% | 0.845 | S | S | * | * | 58.5 | 108.8 | 90.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 11 | L | 43.4 | Very low | 42.5 | Very low | 175 Ų | 175 | 152.8 Ų | 152.8 | 92% | 0.916 | 85% | 0.849 | S | S | * | * | trans | -162.5 | 132.1 | 134.8 | -124.6 | 99.7 | 0 | 0 | 0 | 111.2 | ||||
| 12 | E | 35.4 | Very low | 42.2 | Very low | 174 Ų | 174 | 150.6 Ų | 150.6 | 81% | 0.813 | 83% | 0.827 | S | S | * | * | trans | -70.4 | 162.1 | -177.1 | -57.8 | -178.3 | 130.9 | 0 | 0 | 114.7 | ||||
| 13 | R | 41 | Very low | 41.6 | Very low | 206 Ų | 206 | 152 Ų | 152 | 78% | 0.777 | 82% | 0.815 | S | S | * | * | 177.9 | 134.8 | 111.6 | -97.3 | 178.9 | -149.5 | -155 | 8.9 | 115.1 | |||||
| 14 | H | 42.2 | Very low | 41.8 | Very low | 172 Ų | 172 | 150 Ų | 150 | 80% | 0.796 | 81% | 0.813 | S | S | * | * | trans | 65.2 | 126.4 | 155.1 | -56.7 | -55.4 | 0 | 0 | 0 | 118.3 | ||||
| 15 | G | 34.4 | Very low | 41.1 | Very low | 83 Ų | 83 | 148.6 Ų | 148.6 | 86% | 0.856 | 81% | 0.808 | S | S | * | * | cis | 123.8 | 99.3 | 17.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 16 | G | 42.4 | Very low | 40.9 | Very low | 84 Ų | 84 | 147.5 Ų | 147.5 | 87% | 0.866 | 82% | 0.815 | S | S | * | * | trans | -167.2 | 93.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 17 | H | 40.6 | Very low | 40 | Very low | 189 Ų | 189 | 145 Ų | 145 | 88% | 0.875 | 81% | 0.808 | S | S | * | * | trans | -92.2 | 156.2 | 179.7 | -105.2 | -77.3 | 0 | 0 | 0 | 112.8 | ||||
| 18 | K | 44.5 | Very low | 39.9 | Very low | 190 Ų | 190 | 143.8 Ų | 143.8 | 83% | 0.826 | 81% | 0.812 | S | S | * | * | trans | 129.2 | 128.9 | 143.5 | -71.6 | 177.3 | -175.8 | -177.1 | 0 | 110.9 | ||||
| 19 | T | 50.5 | Low | 40.1 | Very low | 125 Ų | 125 | 141.5 Ų | 141.5 | 77% | 0.767 | 81% | 0.808 | S | S | * | * | cis | -174.1 | 144.6 | 10 | 32.5 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 20 | P | 40.1 | Very low | 39.9 | Very low | 121 Ų | 121 | 144 Ų | 144 | 79% | 0.786 | 81% | 0.808 | S | S | * | * | trans | -109.1 | 153.3 | 169.3 | 36.9 | -27.1 | 0 | 0 | 0 | 112.5 | ||||
| 21 | R | 39.1 | Very low | 40.1 | Very low | 246 Ų | 246 | 143.1 Ų | 143.1 | 93% | 0.928 | 81% | 0.809 | S | S | * | * | trans | -179.6 | 151.7 | 163.9 | -101.9 | 167.7 | -171.9 | -178.6 | 2.6 | 108.8 | ||||
| 22 | R | 39.8 | Very low | 40.1 | Very low | 207 Ų | 207 | 142 Ų | 142 | 78% | 0.781 | 80% | 0.804 | S | S | * | * | cis | 175.7 | 134.7 | -21 | 175.9 | 174 | 177.7 | -152.5 | -11.6 | 106 | ||||
| 23 | D | 37.7 | Very low | 40.4 | Very low | 113 Ų | 113 | 143.7 Ų | 143.7 | 60% | 0.604 | 80% | 0.803 | S | S | * | * | trans | 55.5 | 145.2 | 149.5 | -57.6 | -10.1 | 0 | 0 | 0 | 125.5 | ||||
| 24 | S | 41.5 | Very low | 40.6 | Very low | 112 Ų | 112 | 138.9 Ų | 138.9 | 78% | 0.783 | 80% | 0.798 | S | S | * | * | trans | 108.6 | 138.9 | 138.9 | -46.7 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 25 | S | 37.3 | Very low | 40.5 | Very low | 113 Ų | 113 | 139.4 Ų | 139.4 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | cis | 174.3 | 142.1 | -11.9 | 48.3 | 0 | 0 | 0 | 0 | 107 | ||||
| 26 | G | 36.9 | Very low | 41.1 | Very low | 88 Ų | 88 | 143.7 Ų | 143.7 | 91% | 0.907 | 80% | 0.8 | S | S | * | * | trans | 85.6 | 145 | 158.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 27 | G | 35.8 | Very low | 41 | Very low | 71 Ų | 71 | 146.9 Ų | 146.9 | 73% | 0.732 | 80% | 0.796 | S | S | * | * | cis | -177.4 | 144.1 | 4.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 28 | T | 35.6 | Very low | 41.3 | Very low | 133 Ų | 133 | 145.1 Ų | 145.1 | 82% | 0.816 | 79% | 0.79 | S | S | * | * | trans | 1.2 | 135.1 | 156.4 | 57.4 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 29 | K | 44.1 | Very low | 40.9 | Very low | 179 Ų | 179 | 143.2 Ų | 143.2 | 78% | 0.778 | 79% | 0.789 | S | S | * | * | 164.7 | 133.9 | 99.8 | -95.4 | -166.4 | 165.8 | -178 | 0 | 114.4 | |||||
| 30 | D | 38.2 | Very low | 40.4 | Very low | 147 Ų | 147 | 141.7 Ų | 141.7 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | trans | 54.5 | 131.6 | 136.1 | -58.8 | -40.6 | 0 | 0 | 0 | 122.2 | ||||
| 31 | G | 42.7 | Very low | 40.7 | Very low | 78 Ų | 78 | 141.8 Ų | 141.8 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | 170.3 | 57.9 | 166.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 32 | D | 41.7 | Very low | 40.8 | Very low | 151 Ų | 151 | 137.6 Ų | 137.6 | 81% | 0.807 | 78% | 0.775 | S | S | * | * | trans | 18 | 123.2 | 146.5 | -134.7 | 8 | 0 | 0 | 0 | 123.2 | ||||
| 33 | R | 42.3 | Very low | 41 | Very low | 209 Ų | 209 | 135.2 Ų | 135.2 | 79% | 0.789 | 78% | 0.778 | S | S | * | * | trans | 22.7 | 171.3 | 137.2 | -98 | -175.9 | 170 | -153.9 | 1.7 | 123.3 | ||||
| 34 | P | 45.3 | Very low | 41.3 | Very low | 106 Ų | 106 | 134 Ų | 134 | 69% | 0.688 | 78% | 0.784 | S | S | * | * | cis | -139.2 | 175.3 | -0.3 | 24.3 | 2.1 | 0 | 0 | 0 | 117.8 | ||||
| 35 | K | 39.1 | Very low | 41.4 | Very low | 183 Ų | 183 | 136.1 Ų | 136.1 | 80% | 0.796 | 79% | 0.786 | S | S | * | * | trans | -52.5 | 141.1 | 166.7 | -62.2 | 169.8 | 173.3 | -177.1 | 0 | 113.4 | ||||
| 36 | I | 47.9 | Very low | 41.6 | Very low | 172 Ų | 172 | 136.9 Ų | 136.9 | 88% | 0.882 | 78% | 0.781 | S | S | * | * | trans | -123.3 | 122.3 | 156.7 | -60.8 | 178.4 | 0 | 0 | 0 | 108 | ||||
| 37 | L | 40.3 | Very low | 41.8 | Very low | 152 Ų | 152 | 142.7 Ų | 142.7 | 80% | 0.796 | 78% | 0.781 | S | S | * | * | trans | -134.3 | 114.6 | 174.9 | -172.5 | 153.4 | 0 | 0 | 0 | 104.5 | ||||
| 38 | M | 46.2 | Very low | 41.9 | Very low | 152 Ų | 152 | 147.7 Ų | 147.7 | 75% | 0.749 | 79% | 0.785 | S | S | * | * | trans | 168.7 | 122 | 146.6 | -119.3 | 116.6 | 116.1 | 0 | 0 | 108.2 | ||||
| 39 | D | 36.8 | Very low | 41.8 | Very low | 150 Ų | 150 | 146.9 Ų | 146.9 | 80% | 0.802 | 79% | 0.785 | S | S | * | * | 64.2 | 103.7 | 107.4 | -83.1 | -21.3 | 0 | 0 | 0 | 114.1 | |||||
| 40 | S | 39.9 | Very low | 41.5 | Very low | 93 Ų | 93 | 146.7 Ų | 146.7 | 65% | 0.65 | 79% | 0.787 | S | S | * | * | -175.8 | 141.3 | 113.5 | -133.1 | 0 | 0 | 0 | 0 | 111.3 | E42 | S40-E42 PolarHBondContact O-N 3.5Š| |||
| 41 | P | 45.9 | Very low | 41.4 | Very low | 123 Ų | 123 | 148.5 Ų | 148.5 | 80% | 0.799 | 79% | 0.791 | S | S | * | * | trans | -96.2 | 78.3 | -177.6 | 36.8 | -28.3 | 0 | 0 | 0 | 110.6 | ||||
| 42 | E | 42.5 | Very low | 41.5 | Very low | 158 Ų | 158 | 151.9 Ų | 151.9 | 74% | 0.738 | 79% | 0.789 | S | S | * | * | trans | -138 | 5.5 | -174.3 | -60.5 | -172.3 | -173.2 | 0 | 0 | 116.4 | S40 A44 | S40-E42 PolarHBondContact O-N 3.5Å; E42-A44 PolarHBondContact O-N 2.89Å | ||
| 43 | D | 43.6 | Very low | 41.2 | Very low | 157 Ų | 157 | 154.2 Ų | 154.2 | 84% | 0.84 | 79% | 0.792 | S | S | * | * | trans | -98.6 | 38.8 | 177.7 | -97.8 | -30.8 | 0 | 0 | 0 | 113.8 | D45 | D43-D45 PolarHBondContact O-N 3.09Š| ||
| 44 | A | 43.4 | Very low | 41.1 | Very low | 88 Ų | 88 | 147.1 Ų | 147.1 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | 55.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | E42 | E42-A44 PolarHBondContact O-N 2.89Š|
| 45 | D | 42.9 | Very low | 41.2 | Very low | 156 Ų | 156 | 146.6 Ų | 146.6 | 83% | 0.834 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -160.9 | 22.7 | 171.8 | -93.1 | -30.8 | 0 | 0 | 0 | 115.2 | D43 | D43-D45 PolarHBondContact O-N 3.09Š|
| 46 | L | 42.8 | Very low | 41.6 | Very low | 129 Ų | 129 | 145.1 Ų | 145.1 | 68% | 0.675 | 77% | 0.771 | S | S | * | * | trans | -128.4 | 39.6 | -171.2 | -130.5 | 91.2 | 0 | 0 | 0 | 116.3 | ||||
| 47 | F | 41.7 | Very low | 41.7 | Very low | 210 Ų | 210 | 145.4 Ų | 145.4 | 92% | 0.921 | 77% | 0.765 | S | S | * | * | trans | -135.2 | 101.6 | 158.6 | -81 | -80.8 | 0 | 0 | 0 | 110.4 | S49 | F47-S49 PolarHBondContact O-N 3.39Š| ||
| 48 | H | 37.8 | Very low | 42.2 | Very low | 175 Ų | 175 | 145.8 Ų | 145.8 | 81% | 0.81 | 76% | 0.763 | S | S | * | * | trans | -60.6 | 128 | 174.8 | -74.6 | 37.6 | 0 | 0 | 0 | 110.1 | E50 | H48-E50 PolarHBondContact O-N 2.91Š| ||
| 49 | S | 33.5 | Very low | 42.5 | Very low | 117 Ų | 117 | 146.2 Ų | 146.2 | 82% | 0.818 | 76% | 0.763 | S | S | * | * | trans | -59.4 | 98.1 | 169 | -53.9 | 0 | 0 | 0 | 0 | 110.7 | F47 | F47-S49 PolarHBondContact O-N 3.39Š| ||
| 50 | E | 37.4 | Very low | 43.3 | Very low | 174 Ų | 174 | 146.3 Ų | 146.3 | 81% | 0.813 | 76% | 0.757 | S | S | * | * | trans | -95.3 | 103.3 | 148.2 | -75.4 | -160.6 | 145.2 | 0 | 0 | 107.4 | H48 I52 | H48-E50 PolarHBondContact O-N 2.91Å; E50-I52 VanDerWaalsContact C-N 3.26Å; E50-I52 PolarHBondContact O-N 2.89Å | ||
| 51 | E | 35.1 | Very low | 44 | Very low | 185 Ų | 185 | 146.4 Ų | 146.4 | 86% | 0.864 | 75% | 0.749 | S | S | * | * | trans | -61.4 | 85.9 | 169.7 | -79.5 | -176.2 | 136.2 | 0 | 0 | 109.8 | K53 | E51-K53 PolarHBondContact O-N 2.98Š| ||
| 52 | I | 45 | Very low | 44.6 | Very low | 149 Ų | 149 | 143.2 Ų | 143.2 | 76% | 0.764 | 73% | 0.734 | S | S | * | * | trans | -77 | 88.2 | 157.4 | -58.2 | 174.9 | 0 | 0 | 0 | 105.9 | E50 A54 | E50-I52 VanDerWaalsContact C-N 3.26Å; E50-I52 PolarHBondContact O-N 2.89Å; I52-A54 VanDerWaalsContact C-N 3.3Å; I52-A54 PolarHBondContact O-N 2.68Å | ||
| 53 | K | 35.3 | Very low | 45.8 | Very low | 200 Ų | 200 | 141.9 Ų | 141.9 | 87% | 0.87 | 72% | 0.722 | S | S | * | * | trans | -64.9 | 90 | 173.9 | -153.7 | 177.9 | -172.7 | -177.5 | 0 | 108.1 | E51 | E51-K53 PolarHBondContact O-N 2.98Š| ||
| 54 | A | 39.8 | Very low | 46.4 | Very low | 60 Ų | 60 | 138.9 Ų | 138.9 | 50% | 0.496 | 70% | 0.703 | S | S | . | * | trans | -63.1 | 134.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | I52 E56 | I52-A54 VanDerWaalsContact C-N 3.3Å; I52-A54 PolarHBondContact O-N 2.68Å; A54-E56 PolarHBondContact O-N 2.85Å | ||
| 55 | P | 47.6 | Very low | 46.8 | Very low | 95 Ų | 95 | 140.5 Ų | 140.5 | 62% | 0.617 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | 7.2 | -179 | 32.1 | -33.4 | 0 | 0 | 0 | 113.9 | K57 E58 | P55-K57 VanDerWaalsContact C-N 3.27Å; P55-K57 PolarHBondContact O-N 2.9Å; P55-E58 PolarHBondContact O-N 2.88Å |
| 56 | E | 48 | Very low | 47.4 | Very low | 153 Ų | 153 | 138.7 Ų | 138.7 | 72% | 0.715 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -69.5 | -20.6 | -172.8 | -65.6 | -174.9 | 159.3 | 0 | 0 | 114 | A54 | A54-E56 PolarHBondContact O-N 2.85Å |
| 57 | K | 51.1 | Low | 48 | Very low | 178 Ų | 178 | 138.2 Ų | 138.2 | 77% | 0.774 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -82.4 | -25.1 | -178.1 | -134.5 | 179.9 | -175.4 | -178.9 | 0 | 113.2 | P55 | P55-K57 VanDerWaalsContact C-N 3.27Å; P55-K57 PolarHBondContact O-N 2.9Å |
| 58 | E | 49.6 | Very low | 48.7 | Very low | 160 Ų | 160 | 135.6 Ų | 135.6 | 75% | 0.748 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -81 | -37.9 | 178 | -82.2 | 173.5 | 165 | 0 | 0 | 111.5 | P55 F60 L61 A62 | P55-E58 PolarHBondContact O-N 2.88Å; E58-F60 VanDerWaalsContact C-N 3.27Å; E58-F60 PolarHBondContact O-N 2.87Å; E58-L61 PolarHBondContact O-N 2.98Å; E58-A62 PolarHBondContact O-N 3.23Å |
| 59 | E | 52.9 | Low | 49.4 | Very low | 161 Ų | 161 | 131.7 Ų | 131.7 | 75% | 0.752 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -63.1 | -32.7 | 172.4 | -79.4 | -171.5 | 154.3 | 0 | 0 | 112.5 | L61 A62 | E59-L61 PolarHBondContact O-N 3.08Å; E59-A62 PolarHBondContact O-N 2.76Å |
| 60 | F | 53 | Low | 50.4 | Low | 152 Ų | 152 | 132.5 Ų | 132.5 | 67% | 0.667 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.7 | -10.3 | 178.5 | -160.1 | -95 | 0 | 0 | 0 | 114 | E58 W63 | E58-F60 VanDerWaalsContact C-N 3.27Å; E58-F60 PolarHBondContact O-N 2.87Å; F60-W63 PolarHBondContact O-NE1 2.86Å |
| 61 | L | 54.8 | Low | 51.2 | Low | 94 Ų | 94 | 131.3 Ų | 131.3 | 49% | 0.492 | 66% | 0.656 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.6 | -7.3 | 178.6 | -63.4 | 175.8 | 0 | 0 | 0 | 113.3 | E58 E59 W63 Q64 | E58-L61 PolarHBondContact O-N 2.98Å; E59-L61 PolarHBondContact O-N 3.08Å; L61-W63 PolarHBondContact O-N 2.98Å; L61-Q64 WeakPolarHBondContact O-CB 3.36Å; L61-Q64 PolarHBondContact O-N 2.96Å |
| 62 | A | 59.4 | Low | 52 | Low | 57 Ų | 57 | 131.6 Ų | 131.6 | 47% | 0.471 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -57.9 | -36.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | E58 E59 Q64 H65 | E58-A62 PolarHBondContact O-N 3.23Å; E59-A62 PolarHBondContact O-N 2.76Å; A62-Q64 VanDerWaalsContact C-N 3.27Å; A62-Q64 PolarHBondContact O-N 2.99Å; A62-H65 PolarHBondContact O-N 3.31Å |
| 63 | W | 66.6 | Low | 52.6 | Low | 130 Ų | 130 | 128 Ų | 128 | 49% | 0.492 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -68.5 | -21.5 | 178.4 | 65.5 | -87.2 | 0 | 0 | 0 | 114 | F60 L61 L67 | F60-W63 PolarHBondContact O-NE1 2.86Å; L61-W63 PolarHBondContact O-N 2.98Å; W63-L67 HydrophobicContact CE3-CD1 3.93Å; W63-L67 HydrophobicContact CZ3-CD1 3.83Å |
| 64 | Q | 57.3 | Low | 53.9 | Low | 94 Ų | 94 | 122.7 Ų | 122.7 | 44% | 0.439 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -71.5 | -34.7 | 175.5 | -74.1 | -172.5 | -36.2 | 0 | 0 | 111.4 | L61 A62 D66 L67 E68 | L61-Q64 WeakPolarHBondContact O-CB 3.36Å; L61-Q64 PolarHBondContact O-N 2.96Å; A62-Q64 VanDerWaalsContact C-N 3.27Å; A62-Q64 PolarHBondContact O-N 2.99Å; Q64-D66 VanDerWaalsContact C-N 3.29Å; Q64-D66 PolarHBondContact O-N 3.44Å; Q64-L67 PolarHBondContact O-N 3.22Å; Q64-E68 PolarHBondContact O-N 3.35Å |
| 65 | H | 51.9 | Low | 55.1 | Low | 121 Ų | 121 | 123.5 Ų | 123.5 | 56% | 0.56 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -67.3 | -32.8 | 177.4 | -167.9 | -85.9 | 0 | 0 | 0 | 111.5 | A62 L67 E68 V69 | A62-H65 PolarHBondContact O-N 3.31Å; H65-L67 VanDerWaalsContact C-N 3.28Å; H65-L67 PolarHBondContact O-N 2.85Å; H65-E68 PolarHBondContact O-N 2.79Å; H65-V69 VanDerWaalsContact CE1-CG2 3.48Å; H65-V69 WeakPolarHBondContact CE1-CG2 3.47Å; H65-V69 VanDerWaalsContact O-CG2 3.26Å; H65-V69 WeakPolarHBondContact O-CG2 3.25Å; H65-V69 PolarHBondContact O-N 2.87Å |
| 66 | D | 54.5 | Low | 56.4 | Low | 118 Ų | 118 | 126 Ų | 126 | 63% | 0.631 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -66.9 | -28 | 176.1 | -66.5 | -23.7 | 0 | 0 | 0 | 112.9 | Q64 | Q64-D66 VanDerWaalsContact C-N 3.29Å; Q64-D66 PolarHBondContact O-N 3.44Å |
| 67 | L | 56.5 | Low | 58.3 | Low | 119 Ų | 119 | 120.5 Ų | 120.5 | 62% | 0.623 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -73.7 | -30.9 | 175.2 | -70.1 | 170.3 | 0 | 0 | 0 | 112.5 | W63 Q64 H65 | W63-L67 HydrophobicContact CE3-CD1 3.93Å; W63-L67 HydrophobicContact CZ3-CD1 3.83Å; Q64-L67 PolarHBondContact O-N 3.22Å; H65-L67 VanDerWaalsContact C-N 3.28Å; H65-L67 PolarHBondContact O-N 2.85Å |
| 68 | E | 54.5 | Low | 60.3 | Low | 155 Ų | 155 | 113.2 Ų | 113.2 | 72% | 0.724 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -87 | -19.9 | -176.5 | -66.8 | -177.9 | 170.6 | 0 | 0 | 113.3 | Q64 H65 | Q64-E68 PolarHBondContact O-N 3.35Å; H65-E68 PolarHBondContact O-N 2.79Å |
| 69 | V | 54.5 | Low | 62.6 | Low | 94 Ų | 94 | 109.2 Ų | 109.2 | 57% | 0.57 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -83.1 | -18.6 | -178.2 | 175 | 0 | 0 | 0 | 0 | 113 | H65 D71 | H65-V69 VanDerWaalsContact CE1-CG2 3.48Å; H65-V69 WeakPolarHBondContact CE1-CG2 3.47Å; H65-V69 VanDerWaalsContact O-CG2 3.26Å; H65-V69 WeakPolarHBondContact O-CG2 3.25Å; H65-V69 PolarHBondContact O-N 2.87Å; V69-D71 VanDerWaalsContact C-N 3.34Å; V69-D71 PolarHBondContact O-N 2.99Å |
| 70 | N | 53.3 | Low | 64.7 | Low | 134 Ų | 134 | 102 Ų | 102 | 72% | 0.717 | 55% | 0.546 | S | S | * | . | G | 310 helix | trans | -78.3 | -10.3 | -173 | -159.9 | 38 | 0 | 0 | 0 | 115 | K72 | N70-K72 VanDerWaalsContact C-N 3.33Å; N70-K72 PolarHBondContact O-N 2.8Å |
| 71 | D | 54.6 | Low | 66.8 | Low | 149 Ų | 149 | 99 Ų | 99 | 80% | 0.797 | 54% | 0.541 | S | S | * | . | G | 310 helix | trans | -85.4 | 10.4 | -169.4 | -102.2 | -23.3 | 0 | 0 | 0 | 115.6 | V69 | V69-D71 VanDerWaalsContact C-N 3.34Å; V69-D71 PolarHBondContact O-N 2.99Å |
| 72 | K | 52.5 | Low | 68.9 | Low | 191 Ų | 191 | 94.8 Ų | 94.8 | 83% | 0.83 | 52% | 0.518 | S | S | * | . | G | 310 helix | trans | -127.2 | 12.6 | -173.1 | -68.6 | -163.2 | 178.6 | -178.7 | 0 | 116.7 | N70 P74 | N70-K72 VanDerWaalsContact C-N 3.33Å; N70-K72 PolarHBondContact O-N 2.8Å; K72-P74 WeakPolarHBondContact O-CD 3.41Å |
| 73 | A | 56.4 | Low | 70.7 | Confident | 73 Ų | 73 | 98.7 Ų | 98.7 | 60% | 0.603 | 52% | 0.521 | S | S | * | . | S | Bend | trans | -71.2 | 120.7 | 162.5 | 0 | 0 | 0 | 0 | 0 | 108 | A75 | A73-A75 PolarHBondContact O-N 2.69Š|
| 74 | P | 62.8 | Low | 72.2 | Confident | 89 Ų | 89 | 94 Ų | 94 | 58% | 0.578 | 50% | 0.503 | S | S | * | . | trans | -57.7 | 130.9 | 174.8 | 24.4 | -31.7 | 0 | 0 | 0 | 107.7 | K72 Q76 A77 | K72-P74 WeakPolarHBondContact O-CD 3.41Å; P74-Q76 PolarHBondContact O-N 2.63Å; P74-A77 PolarHBondContact O-N 2.83Å | ||
| 75 | A | 65.9 | Low | 74 | Confident | 76 Ų | 76 | 93.3 Ų | 93.3 | 63% | 0.628 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.2 | -2.5 | -174.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | A73 | A73-A75 PolarHBondContact O-N 2.69Š|
| 76 | Q | 74.8 | Confident | 75.8 | Confident | 147 Ų | 147 | 88.6 Ų | 88.6 | 69% | 0.687 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91 | -14.6 | 178.6 | -62.1 | -176.2 | -6.6 | 0 | 0 | 114.4 | P74 L118 P119 | P74-Q76 PolarHBondContact O-N 2.63Å; Q76-L118 CarbonylContact O-C 3.58Å; Q76-P119 VanDerWaalsContact O-CA 3.23Å; Q76-P119 WeakPolarHBondContact O-CA 3.38Å |
| 77 | A | 87.8 | Confident | 77.4 | Confident | 39 Ų | 39 | 85.7 Ų | 85.7 | 32% | 0.322 | 49% | 0.487 | S | S | . | . | trans | -110.1 | 99.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | P74 D117 | P74-A77 PolarHBondContact O-N 2.83Å; A77-D117 HydrophobicContact CB-CB 3.91Å | ||
| 78 | R | 92.9 | Very high | 79 | Confident | 25 Ų | 25 | 80.6 Ų | 80.6 | 9% | 0.094 | 46% | 0.463 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.1 | 116.1 | -177.1 | -60.7 | -169.1 | 174.7 | 162.4 | 6 | 111.9 | T80 D117 L118 E120 V155 K156 F160 | R78-T80 PolarHBondContact O-N 2.84Å; R78-T80 PolarHBondContact O-OG1 2.92Å; R78-T80 VanDerWaalsContact O-OG1 3.08Å; R78-D117 WeakPolarHBondContact O-CA 2.79Å; R78-L118 WeakPolarHBondContact CB-O 3.23Å; R78-L118 PolarHBondContact N-O 3.41Å; R78-L118 VanDerWaalsContact N-O 3.13Å; R78-L118 PolarHBondContact O-N 2.85Å; R78-E120 IonicContact CZ-OE2 3.18Å; R78-E120 IonicContact NH1-OE2 2.8Å; R78-E120 PolarHBondContact NH1-OE2 2.9Å; R78-E120 IonicContact NH2-OE2 2.75Å; R78-E120 PolarHBondContact NH2-OE2 2.89Å; R78-V155 HydrophobicContact CB-CG1 4.2Å; R78-K156 PolarHBondContact NH1-O 3.31Å; R78-F160 HydrophobicContact CB-CD1 3.97Å; R78-F160 HydrophobicContact CB-CD2 4.13Å; R78-F160 HydrophobicContact CB-CE1 3.53Å; R78-F160 HydrophobicContact CB-CE2 3.72Å; R78-F160 HydrophobicContact CB-CG 4.25Å; R78-F160 HydrophobicContact CB-CZ 3.41Å; R78-F160 VanDerWaalsContact CB-CZ 3.41Å; R78-F160 VanDerWaalsContact CD-CD2 3.49Å; R78-F160 HydrophobicContact CG-CD2 4.28Å; R78-F160 HydrophobicContact CG-CE2 4.23Å; R78-F160 HydrophobicContact CG-CG 4.46Å; R78-F160 HydrophobicContact CG-CZ 4.38Å |
| 79 | P | 96.7 | Very high | 80.9 | Confident | 75 Ų | 75 | 81.7 Ų | 81.7 | 49% | 0.487 | 47% | 0.466 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.6 | 104.3 | -172.6 | -23.6 | 31.7 | 0 | 0 | 0 | 113.5 | I115 D117 F160 | P79-I115 HydrophobicContact CB-CG2 4.06Å; P79-D117 WeakPolarHBondContact CA-OD1 3.12Å; P79-D117 WeakPolarHBondContact CG-OD1 3.47Å; P79-F160 WeakPolarHBondContact O-CE1 2.88Å |
| 80 | T | 97.6 | Very high | 82.8 | Confident | 10 Ų | 10 | 82.8 Ų | 82.8 | 6% | 0.061 | 46% | 0.464 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.9 | 125.8 | -178.1 | -54.2 | 0 | 0 | 0 | 0 | 109.9 | R78 F82 I115 L116 L118 I153 V155 | R78-T80 PolarHBondContact O-N 2.84Å; R78-T80 PolarHBondContact O-OG1 2.92Å; R78-T80 VanDerWaalsContact O-OG1 3.08Å; T80-F82 HydrophobicContact CG2-CE2 3.85Å; T80-F82 HydrophobicContact CG2-CZ 4.07Å; T80-I115 WeakPolarHBondContact O-CA 3.28Å; T80-L116 WeakPolarHBondContact CB-O 3.29Å; T80-L116 PolarHBondContact N-O 3.44Å; T80-L116 PolarHBondContact O-N 2.89Å; T80-L118 HydrophobicContact CG2-CD1 4.16Å; T80-I153 HydrophobicContact CG2-CD1 3.54Å; T80-V155 HydrophobicContact CG2-CG2 4.42Å |
| 81 | V | 97.7 | Very high | 84.9 | Confident | 90 Ų | 90 | 76.6 Ų | 76.6 | 55% | 0.545 | 43% | 0.431 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89 | 121.9 | -178.2 | -176.2 | 0 | 0 | 0 | 0 | 110 | V113 I115 | V81-V113 HydrophobicContact CG1-CG1 4.05Å; V81-I115 HydrophobicContact CG2-CG1 4.27Å |
| 82 | F | 98 | Very high | 87 | Confident | 4 Ų | 4 | 72.2 Ų | 72.2 | 2% | 0.018 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.5 | 120.9 | 168.2 | -67.2 | -89.6 | 0 | 0 | 0 | 108.9 | T80 L93 F97 V113 A114 L116 L118 Y125 I153 | T80-F82 HydrophobicContact CG2-CE2 3.85Å; T80-F82 HydrophobicContact CG2-CZ 4.07Å; F82-L93 HydrophobicContact CB-CD2 3.61Å; F82-L93 HydrophobicContact CD1-CD1 4.05Å; F82-L93 HydrophobicContact CD1-CD2 3.87Å; F82-L93 HydrophobicContact CD2-CD2 3.8Å; F82-L93 HydrophobicContact CE2-CD2 4.46Å; F82-L93 HydrophobicContact CG-CD1 4.43Å; F82-L93 HydrophobicContact CG-CD2 3.46Å; F82-L93 VanDerWaalsContact CG-CD2 3.46Å; F82-F97 HydrophobicContact CE1-CE1 4.23Å; F82-F97 HydrophobicContact CE1-CZ 4.34Å; F82-F97 HydrophobicContact CE2-CE1 4.41Å; F82-F97 HydrophobicContact CE2-CZ 4.3Å; F82-F97 AromaticContact CZ-CE1 3.77Å; F82-F97 HydrophobicContact CZ-CE1 3.77Å; F82-F97 AromaticContact CZ-CZ 3.98Å; F82-F97 HydrophobicContact CZ-CZ 3.98Å; F82-V113 WeakPolarHBondContact O-CA 3.29Å; F82-A114 PolarHBondContact N-O 2.97Å; F82-A114 PolarHBondContact O-N 3.03Å; F82-L116 HydrophobicContact CD2-CB 4.45Å; F82-L116 HydrophobicContact CD2-CD1 4.11Å; F82-L116 HydrophobicContact CD2-CG 4.39Å; F82-L116 HydrophobicContact CE2-CB 4.27Å; F82-L116 HydrophobicContact CE2-CD1 4.13Å; F82-L118 HydrophobicContact CE2-CD1 3.74Å; F82-L118 HydrophobicContact CZ-CD1 3.65Å; F82-Y125 HydrophobicContact CD1-CD1 4.44Å; F82-Y125 AromaticContact CD1-CD2 3.95Å; F82-Y125 HydrophobicContact CD1-CD2 3.95Å; F82-Y125 HydrophobicContact CD1-CE1 4.44Å; F82-Y125 AromaticContact CD1-CE2 3.93Å; F82-Y125 HydrophobicContact CD1-CE2 3.93Å; F82-Y125 HydrophobicContact CD1-CG 4.19Å; F82-Y125 AromaticContact CE1-CD1 3.74Å; F82-Y125 HydrophobicContact CE1-CD1 3.74Å; F82-Y125 HydrophobicContact CE1-CD2 4.02Å; F82-Y125 AromaticContact CE1-CE1 3.93Å; F82-Y125 HydrophobicContact CE1-CE1 3.93Å; F82-Y125 HydrophobicContact CE1-CE2 4.18Å; F82-Y125 AromaticContact CE1-CG 3.78Å; F82-Y125 HydrophobicContact CE1-CG 3.78Å; F82-I153 HydrophobicContact CE1-CG2 4.24Å; F82-I153 HydrophobicContact CZ-CG2 4.22Å |
| 83 | R | 97.5 | Very high | 89.2 | Confident | 139 Ų | 139 | 63.1 Ų | 63.1 | 53% | 0.525 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 133.1 | 179.5 | -178.6 | 178.5 | 68.4 | 176.5 | 0.3 | 110 | N111 F112 V113 | R83-N111 HydrophobicContact CG-CB 4.42Å; R83-F112 CarbonylContact C-O 3.56Å; R83-F112 WeakPolarHBondContact CA-O 3.32Å; R83-V113 HydrophobicContact CB-CG2 4.37Å; R83-V113 HydrophobicContact CG-CG2 4.07Å |
| 84 | W | 97.5 | Very high | 91.2 | Very high | 33 Ų | 33 | 59.7 Ų | 59.7 | 13% | 0.125 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.5 | 121.9 | 165.3 | 172.8 | -98.4 | 0 | 0 | 0 | 108.9 | V91 L105 N111 F112 F127 V129 T134 D136 | W84-V91 HydrophobicContact CB-CG1 4.28Å; W84-V91 HydrophobicContact CG-CG1 4.19Å; W84-L105 HydrophobicContact CB-CD1 4.38Å; W84-N111 CarbonylContact O-C 3.53Å; W84-N111 WeakPolarHBondContact O-CA 3.13Å; W84-F112 HydrophobicContact CB-CB 4.24Å; W84-F112 AromaticContact CD1-CD2 3.95Å; W84-F112 PolarHBondContact N-O 2.77Å; W84-F112 PolarHBondContact O-N 3.43Å; W84-F127 HydrophobicContact CB-CD1 4.05Å; W84-F127 HydrophobicContact CB-CE1 3.82Å; W84-F127 HydrophobicContact CB-CZ 4.18Å; W84-F127 HydrophobicContact CD2-CG 4.43Å; W84-F127 HydrophobicContact CE3-CB 4.25Å; W84-F127 HydrophobicContact CE3-CD1 4.38Å; W84-F127 AromaticContact CE3-CD2 3.59Å; W84-F127 HydrophobicContact CE3-CD2 3.59Å; W84-F127 AromaticContact CE3-CE2 3.93Å; W84-F127 HydrophobicContact CE3-CE2 3.93Å; W84-F127 AromaticContact CE3-CG 3.82Å; W84-F127 HydrophobicContact CE3-CG 3.82Å; W84-F127 HydrophobicContact CE3-CZ 4.47Å; W84-F127 HydrophobicContact CZ3-CD2 4.02Å; W84-F127 HydrophobicContact CZ3-CG 4.42Å; W84-V129 HydrophobicContact CD2-CG2 4.17Å; W84-V129 HydrophobicContact CH2-CG2 4.39Å; W84-V129 HydrophobicContact CZ2-CG2 3.83Å; W84-T134 HydrophobicContact CH2-CG2 3.55Å; W84-T134 HydrophobicContact CZ2-CG2 4.14Å; W84-T134 HydrophobicContact CZ3-CG2 3.96Å; W84-D136 HydrophobicContact CE3-CB 4.39Å; W84-D136 HydrophobicContact CZ3-CB 4.24Å |
| 85 | T | 95.5 | Very high | 92.9 | Very high | 79 Ų | 79 | 55.4 Ų | 55.4 | 49% | 0.485 | 31% | 0.308 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.8 | 113.2 | 177.5 | -62.6 | 0 | 0 | 0 | 0 | 109.5 | N111 | T85-N111 WeakPolarHBondContact CB-OD1 3.4Å; T85-N111 PolarHBondContact OG1-OD1 3.43Å |
| 86 | G | 90.8 | Very high | 94.3 | Very high | 21 Ų | 21 | 54.2 Ų | 54.2 | 22% | 0.216 | 30% | 0.295 | C | S | . | . | S | Bend | trans | 159.8 | -178.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | N110 | G86-N110 PolarHBondContact N-O 2.84Š|
| 87 | G | 88.6 | Confident | 95.4 | Very high | 58 Ų | 58 | 49.6 Ų | 49.6 | 60% | 0.598 | 27% | 0.273 | S | S | * | . | trans | -71.6 | 159.4 | 170 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 88 | G | 89.8 | Confident | 95.8 | Very high | 11 Ų | 11 | 49 Ų | 49 | 11% | 0.113 | 27% | 0.265 | C | S | . | . | trans | 168.8 | 146.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | R107 F112 D130 | G88-R107 PolarHBondContact O-NH1 2.92Å; G88-F112 WeakPolarHBondContact O-CZ 3.4Å; G88-D130 WeakPolarHBondContact CA-OD2 3.46Å | ||
| 89 | K | 93.1 | Very high | 96 | Very high | 179 Ų | 179 | 54.9 Ų | 54.9 | 78% | 0.778 | 30% | 0.298 | S | S | * | . | S | Bend | trans | -89.2 | -48 | 163.1 | -64.9 | -177.1 | -178 | 177.9 | 0 | 109.7 | D130 | K89-D130 WeakPolarHBondContact CA-OD1 3.33Å; K89-D130 WeakPolarHBondContact CB-OD1 3.49Å; K89-D130 PolarHBondContact N-OD1 3.46Å; K89-D130 PolarHBondContact N-OD2 3.43Å |
| 90 | E | 95.3 | Very high | 96 | Very high | 116 Ų | 116 | 56.5 Ų | 56.5 | 54% | 0.542 | 29% | 0.294 | S | S | . | . | S | Bend | trans | -128.8 | 122.9 | 179.3 | -61.4 | -177.8 | 161.4 | 0 | 0 | 109.7 | Y92 D130 | E90-Y92 HydrophobicContact CB-CE2 3.76Å; E90-D130 PolarHBondContact N-OD1 3.49Å; E90-D130 PolarHBondContact O-N 3.26Å |
| 91 | V | 97.9 | Very high | 96 | Very high | 4 Ų | 4 | 59.1 Ų | 59.1 | 2% | 0.024 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 127.3 | 178 | -175.6 | 0 | 0 | 0 | 0 | 108.7 | W84 L105 F112 F127 F128 V129 | W84-V91 HydrophobicContact CB-CG1 4.28Å; W84-V91 HydrophobicContact CG-CG1 4.19Å; V91-L105 HydrophobicContact CB-CD1 4.42Å; V91-L105 HydrophobicContact CG1-CD1 3.65Å; V91-L105 HydrophobicContact CG1-CG 4.26Å; V91-L105 PolarHBondContact O-N 3.19Å; V91-F112 HydrophobicContact CB-CB 4.17Å; V91-F112 HydrophobicContact CB-CD1 3.64Å; V91-F112 HydrophobicContact CB-CD2 4.44Å; V91-F112 HydrophobicContact CB-CE1 4.07Å; V91-F112 HydrophobicContact CB-CG 3.84Å; V91-F112 HydrophobicContact CG1-CB 4.3Å; V91-F112 HydrophobicContact CG1-CG 4.42Å; V91-F112 HydrophobicContact CG2-CB 4.42Å; V91-F112 HydrophobicContact CG2-CD1 3.6Å; V91-F112 HydrophobicContact CG2-CD2 3.79Å; V91-F112 HydrophobicContact CG2-CE1 3.62Å; V91-F112 HydrophobicContact CG2-CE2 3.84Å; V91-F112 HydrophobicContact CG2-CG 3.67Å; V91-F112 HydrophobicContact CG2-CZ 3.75Å; V91-F127 HydrophobicContact CG1-CD1 4.27Å; V91-F128 WeakPolarHBondContact CA-O 3.46Å; V91-V129 HydrophobicContact CG1-CG2 3.95Å; V91-V129 HydrophobicContact CG2-CG1 4.22Å; V91-V129 HydrophobicContact CG2-CG2 4.3Å |
| 92 | Y | 98.3 | Very high | 96 | Very high | 58 Ų | 58 | 59.7 Ų | 59.7 | 23% | 0.227 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 153 | 176.2 | -53.5 | -100.6 | 0 | 0 | 0 | 111 | E90 K102 L103 P104 F127 F128 | E90-Y92 HydrophobicContact CB-CE2 3.76Å; Y92-K102 HydrophobicContact CD1-CB 3.81Å; Y92-K102 HydrophobicContact CG-CB 4.03Å; Y92-L103 CarbonylContact C-O 3.04Å; Y92-L103 WeakPolarHBondContact CA-O 3.48Å; Y92-P104 HydrophobicContact CD1-CB 3.97Å; Y92-P104 HydrophobicContact CE1-CB 3.89Å; Y92-F127 CarbonylContact O-C 3.39Å; Y92-F127 WeakPolarHBondContact O-CA 3.39Å; Y92-F128 AromaticContact CD2-CD1 3.9Å; Y92-F128 HydrophobicContact CD2-CD1 3.9Å; Y92-F128 HydrophobicContact CE2-CD1 4.47Å; Y92-F128 PolarHBondContact N-O 3.35Å; Y92-F128 PolarHBondContact O-N 2.95Å |
| 93 | L | 98.4 | Very high | 96 | Very high | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 32% | 0.321 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.3 | 133.8 | 173.1 | 176.3 | 68.1 | 0 | 0 | 0 | 109.8 | F82 F97 N98 S101 L103 L105 L116 Y125 F127 | F82-L93 HydrophobicContact CB-CD2 3.61Å; F82-L93 HydrophobicContact CD1-CD1 4.05Å; F82-L93 HydrophobicContact CD1-CD2 3.87Å; F82-L93 HydrophobicContact CD2-CD2 3.8Å; F82-L93 HydrophobicContact CE2-CD2 4.46Å; F82-L93 HydrophobicContact CG-CD1 4.43Å; F82-L93 HydrophobicContact CG-CD2 3.46Å; F82-L93 VanDerWaalsContact CG-CD2 3.46Å; L93-F97 HydrophobicContact CD2-CE2 4.32Å; L93-F97 HydrophobicContact CD2-CZ 3.99Å; L93-F97 HydrophobicContact CG-CZ 4.13Å; L93-N98 PolarHBondContact O-ND2 2.89Å; L93-S101 VanDerWaalsContact O-O 3.14Å; L93-L103 PolarHBondContact N-O 2.88Å; L93-L103 WeakPolarHBondContact O-CB 3.41Å; L93-L103 PolarHBondContact O-N 2.87Å; L93-L105 HydrophobicContact CB-CD2 3.77Å; L93-L105 HydrophobicContact CB-CG 4.32Å; L93-L105 HydrophobicContact CD2-CD2 4.42Å; L93-L116 HydrophobicContact CD2-CD1 3.89Å; L93-Y125 HydrophobicContact CD1-CD2 3.59Å; L93-Y125 HydrophobicContact CD1-CG 4.17Å; L93-F127 HydrophobicContact CD1-CD1 4.23Å; L93-F127 HydrophobicContact CD1-CE1 3.97Å; L93-F127 HydrophobicContact CD1-CZ 4.38Å |
| 94 | S | 98.4 | Very high | 96 | Very high | 0 Ų | 0 | 59.6 Ų | 59.6 | 0% | 0 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.9 | 139.3 | 173.4 | -63.8 | 0 | 0 | 0 | 0 | 109.7 | S101 Y125 K126 | S94-S101 WeakPolarHBondContact CA-O 3.39Å; S94-S101 WeakPolarHBondContact CB-O 3.36Å; S94-S101 VanDerWaalsContact OG-C 3.31Å; S94-S101 PolarHBondContact OG-O 3.27Å; S94-Y125 CarbonylContact O-C 3.54Å; S94-Y125 VanDerWaalsContact O-CA 3.23Å; S94-Y125 WeakPolarHBondContact O-CA 3.15Å; S94-K126 PolarHBondContact N-O 2.88Å; S94-K126 PolarHBondContact O-N 2.96Å |
| 95 | G | 97.8 | Very high | 96 | Very high | 0 Ų | 0 | 58.8 Ų | 58.8 | 0% | 0 | 32% | 0.321 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -162.5 | -178.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | F97 N98 N99 W100 Q124 | G95-F97 PolarHBondContact O-N 3.42Å; G95-N98 PolarHBondContact N-OD1 2.92Å; G95-N98 PolarHBondContact O-N 3.24Å; G95-N98 PolarHBondContact O-OD1 3.16Å; G95-N99 PolarHBondContact O-N 3.2Å; G95-W100 PolarHBondContact O-N 3.47Å; G95-Q124 CarbonylContact C-O 3.47Å; G95-Q124 WeakPolarHBondContact CA-O 3.33Å |
| 96 | S | 97 | Very high | 96 | Very high | 50 Ų | 50 | 60.3 Ų | 60.3 | 35% | 0.35 | 33% | 0.33 | S | S | . | . | G | 310 helix | trans | -57.3 | -35.1 | 178.7 | 50.2 | 0 | 0 | 0 | 0 | 112.7 | N98 H123 Q124 | S96-N98 VanDerWaalsContact C-N 3.34Å; S96-N98 PolarHBondContact O-N 3.43Å; S96-H123 WeakPolarHBondContact OG-CA 3.38Å; S96-Q124 PolarHBondContact N-O 3.27Å; S96-Q124 PolarHBondContact OG-N 3.05Å |
| 97 | F | 96.2 | Very high | 96.3 | Very high | 51 Ų | 51 | 66.4 Ų | 66.4 | 22% | 0.224 | 35% | 0.346 | C | S | . | . | G | 310 helix | trans | -71.7 | -19.7 | -178 | 48.4 | -98 | 0 | 0 | 0 | 114.8 | F82 L93 G95 L116 L118 H123 | F82-F97 HydrophobicContact CE1-CE1 4.23Å; F82-F97 HydrophobicContact CE1-CZ 4.34Å; F82-F97 HydrophobicContact CE2-CE1 4.41Å; F82-F97 HydrophobicContact CE2-CZ 4.3Å; F82-F97 AromaticContact CZ-CE1 3.77Å; F82-F97 HydrophobicContact CZ-CE1 3.77Å; F82-F97 AromaticContact CZ-CZ 3.98Å; F82-F97 HydrophobicContact CZ-CZ 3.98Å; L93-F97 HydrophobicContact CD2-CE2 4.32Å; L93-F97 HydrophobicContact CD2-CZ 3.99Å; L93-F97 HydrophobicContact CG-CZ 4.13Å; G95-F97 PolarHBondContact O-N 3.42Å; F97-L116 HydrophobicContact CD2-CD1 3.97Å; F97-L116 HydrophobicContact CE2-CD1 3.42Å; F97-L116 VanDerWaalsContact CE2-CD1 3.42Å; F97-L116 HydrophobicContact CZ-CD1 4.08Å; F97-L118 HydrophobicContact CB-CD2 3.5Å; F97-L118 HydrophobicContact CD1-CD1 4.06Å; F97-L118 HydrophobicContact CD1-CD2 3.94Å; F97-L118 HydrophobicContact CD2-CD2 4.07Å; F97-L118 HydrophobicContact CE1-CD1 4.4Å; F97-L118 HydrophobicContact CG-CD2 3.57Å; F97-H123 HydrophobicContact CD1-CB 4.05Å |
| 98 | N | 96 | Very high | 96.4 | Very high | 27 Ų | 27 | 66.7 Ų | 66.7 | 14% | 0.144 | 34% | 0.339 | C | S | . | . | G | 310 helix | trans | -121.5 | 24.2 | -179.9 | 73.9 | -3.2 | 0 | 0 | 0 | 112.8 | L93 G95 S96 W100 S101 | L93-N98 PolarHBondContact O-ND2 2.89Å; G95-N98 PolarHBondContact N-OD1 2.92Å; G95-N98 PolarHBondContact O-N 3.24Å; G95-N98 PolarHBondContact O-OD1 3.16Å; S96-N98 VanDerWaalsContact C-N 3.34Å; S96-N98 PolarHBondContact O-N 3.43Å; N98-W100 PolarHBondContact O-N 2.97Å; N98-W100 VanDerWaalsContact O-N 3.16Å; N98-W100 PolarHBondContact OD1-N 3.37Å; N98-S101 PolarHBondContact ND2-O 3.39Å; N98-S101 WeakPolarHBondContact O-CB 3.42Å; N98-S101 PolarHBondContact O-N 3.42Å; N98-S101 PolarHBondContact O-OG 3.25Å; N98-S101 PolarHBondContact OD1-N 3.04Å; N98-S101 PolarHBondContact OD1-O 2.7Å |
| 99 | N | 97 | Very high | 96.4 | Very high | 148 Ų | 148 | 74 Ų | 74 | 79% | 0.791 | 37% | 0.37 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.8 | 36.2 | -176.3 | -61.9 | -49.4 | 0 | 0 | 0 | 112.8 | G95 S101 | G95-N99 PolarHBondContact O-N 3.2Å; N99-S101 PolarHBondContact O-N 2.88Å |
| 100 | W | 96.9 | Very high | 96.4 | Very high | 108 Ų | 108 | 70.6 Ų | 70.6 | 41% | 0.409 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 59.6 | 23.7 | -178.5 | -58.2 | 93.6 | 0 | 0 | 0 | 115.2 | G95 N98 Q124 K126 N150 | G95-W100 PolarHBondContact O-N 3.47Å; N98-W100 PolarHBondContact O-N 2.97Å; N98-W100 VanDerWaalsContact O-N 3.16Å; N98-W100 PolarHBondContact OD1-N 3.37Å; W100-Q124 HydrophobicContact CH2-CB 4.2Å; W100-Q124 HydrophobicContact CZ2-CB 4.3Å; W100-K126 HydrophobicContact CZ3-CB 4.19Å; W100-N150 WeakPolarHBondContact CH2-ND2 3.24Å |
| 101 | S | 97.6 | Very high | 96.4 | Very high | 66 Ų | 66 | 67.4 Ų | 67.4 | 46% | 0.462 | 35% | 0.347 | S | S | . | . | trans | -71 | 154.8 | 169.4 | 61.6 | 0 | 0 | 0 | 0 | 111.3 | L93 S94 N98 N99 L103 | L93-S101 VanDerWaalsContact O-O 3.14Å; S94-S101 WeakPolarHBondContact CA-O 3.39Å; S94-S101 WeakPolarHBondContact CB-O 3.36Å; S94-S101 VanDerWaalsContact OG-C 3.31Å; S94-S101 PolarHBondContact OG-O 3.27Å; N98-S101 PolarHBondContact ND2-O 3.39Å; N98-S101 WeakPolarHBondContact O-CB 3.42Å; N98-S101 PolarHBondContact O-N 3.42Å; N98-S101 PolarHBondContact O-OG 3.25Å; N98-S101 PolarHBondContact OD1-N 3.04Å; N98-S101 PolarHBondContact OD1-O 2.7Å; N99-S101 PolarHBondContact O-N 2.88Å; S101-L103 PolarHBondContact O-N 2.82Å | ||
| 102 | K | 97.7 | Very high | 96.3 | Very high | 102 Ų | 102 | 67.4 Ų | 67.4 | 44% | 0.443 | 35% | 0.347 | S | S | . | . | trans | -85.6 | 102.4 | -179.9 | -65.8 | -174 | -174.1 | -174.7 | 0 | 110.4 | Y92 F128 | Y92-K102 HydrophobicContact CD1-CB 3.81Å; Y92-K102 HydrophobicContact CG-CB 4.03Å; K102-F128 HydrophobicContact CD-CD1 4.13Å; K102-F128 HydrophobicContact CD-CE1 4.48Å; K102-F128 VanDerWaalsContact NZ-CZ 3.26Å | ||
| 103 | L | 97.9 | Very high | 96.3 | Very high | 55 Ų | 55 | 66.7 Ų | 66.7 | 29% | 0.288 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.8 | 118.1 | 173.4 | -179.2 | 78 | 0 | 0 | 0 | 109.9 | Y92 L93 S101 A114 L116 | Y92-L103 CarbonylContact C-O 3.04Å; Y92-L103 WeakPolarHBondContact CA-O 3.48Å; L93-L103 PolarHBondContact N-O 2.88Å; L93-L103 WeakPolarHBondContact O-CB 3.41Å; L93-L103 PolarHBondContact O-N 2.87Å; S101-L103 PolarHBondContact O-N 2.82Å; L103-A114 HydrophobicContact CD2-CB 4.1Å; L103-L116 HydrophobicContact CD2-CD1 3.78Å; L103-L116 HydrophobicContact CD2-CD2 3.73Å; L103-L116 HydrophobicContact CD2-CG 4.16Å |
| 104 | P | 97.6 | Very high | 96.2 | Very high | 86 Ų | 86 | 67.4 Ų | 67.4 | 56% | 0.558 | 35% | 0.354 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -68 | 133.2 | 178.5 | 27.6 | -33.6 | 0 | 0 | 0 | 111.3 | Y92 | Y92-P104 HydrophobicContact CD1-CB 3.97Å; Y92-P104 HydrophobicContact CE1-CB 3.89Å |
| 105 | L | 97.8 | Very high | 96.2 | Very high | 16 Ų | 16 | 72.7 Ų | 72.7 | 8% | 0.084 | 38% | 0.381 | C | S | . | . | P | Polyproline II helix | trans | -89.2 | 144.4 | 176.3 | -60.8 | -170.9 | 0 | 0 | 0 | 111.7 | W84 V91 L93 F112 A114 F127 | W84-L105 HydrophobicContact CB-CD1 4.38Å; V91-L105 HydrophobicContact CB-CD1 4.42Å; V91-L105 HydrophobicContact CG1-CD1 3.65Å; V91-L105 HydrophobicContact CG1-CG 4.26Å; V91-L105 PolarHBondContact O-N 3.19Å; L93-L105 HydrophobicContact CB-CD2 3.77Å; L93-L105 HydrophobicContact CB-CG 4.32Å; L93-L105 HydrophobicContact CD2-CD2 4.42Å; L105-F112 HydrophobicContact CB-CB 3.8Å; L105-F112 HydrophobicContact CB-CD1 4.42Å; L105-F112 HydrophobicContact CD1-CB 3.87Å; L105-A114 HydrophobicContact CD2-CB 3.39Å; L105-F127 HydrophobicContact CD1-CD1 3.99Å; L105-F127 HydrophobicContact CD1-CE1 3.79Å |
| 106 | T | 96.9 | Very high | 96.1 | Very high | 110 Ų | 110 | 74.5 Ų | 74.5 | 68% | 0.675 | 39% | 0.391 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78.7 | 123.5 | 174.6 | -55.5 | 0 | 0 | 0 | 0 | 110.1 | F112 V113 | T106-F112 WeakPolarHBondContact O-CA 3.24Å; T106-V113 PolarHBondContact N-O 3.15Å; T106-V113 PolarHBondContact O-N 2.87Å |
| 107 | R | 95.9 | Very high | 96.1 | Very high | 149 Ų | 149 | 77 Ų | 77 | 56% | 0.562 | 40% | 0.4 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -79.9 | 129.3 | 177.6 | -172.1 | 178.3 | 173.7 | 176.9 | -4.4 | 111.3 | G88 H109 F112 | G88-R107 PolarHBondContact O-NH1 2.92Å; R107-H109 PolarHBondContact NE-O 2.9Å; R107-F112 HydrophobicContact CB-CD1 3.78Å; R107-F112 HydrophobicContact CB-CE1 3.53Å; R107-F112 HydrophobicContact CB-CZ 4.09Å; R107-F112 HydrophobicContact CG-CD1 4.11Å; R107-F112 HydrophobicContact CG-CE1 3.6Å; R107-F112 HydrophobicContact CG-CE2 4.12Å; R107-F112 HydrophobicContact CG-CZ 3.59Å |
| 108 | S | 91.6 | Very high | 96.1 | Very high | 64 Ų | 64 | 74.7 Ų | 74.7 | 45% | 0.448 | 39% | 0.39 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 106.1 | 168.5 | -179.5 | 0 | 0 | 0 | 0 | 109.7 | N110 N111 | S108-N110 PolarHBondContact O-N 2.77Å; S108-N111 CarbonylContact C-O 3.47Å; S108-N111 PolarHBondContact N-O 2.97Å; S108-N111 PolarHBondContact O-N 3.01Å; S108-N111 VanDerWaalsContact O-O 3.11Å |
| 109 | H | 90 | Very high | 96.1 | Very high | 166 Ų | 166 | 76.5 Ų | 76.5 | 77% | 0.769 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.2 | -105.2 | -175.6 | -57.9 | 83.9 | 0 | 0 | 0 | 112.5 | R107 | R107-H109 PolarHBondContact NE-O 2.9Š|
| 110 | N | 91.7 | Very high | 96 | Very high | 106 Ų | 106 | 74.6 Ų | 74.6 | 57% | 0.567 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.3 | 7.9 | -178.3 | -125.1 | 31.6 | 0 | 0 | 0 | 113.3 | G86 S108 | G86-N110 PolarHBondContact N-O 2.84Å; S108-N110 PolarHBondContact O-N 2.77Å |
| 111 | N | 95 | Very high | 96 | Very high | 49 Ų | 49 | 70.3 Ų | 70.3 | 26% | 0.262 | 38% | 0.379 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 149.4 | 179.8 | -65 | -56.4 | 0 | 0 | 0 | 110.6 | R83 W84 T85 S108 V113 | R83-N111 HydrophobicContact CG-CB 4.42Å; W84-N111 CarbonylContact O-C 3.53Å; W84-N111 WeakPolarHBondContact O-CA 3.13Å; T85-N111 WeakPolarHBondContact CB-OD1 3.4Å; T85-N111 PolarHBondContact OG1-OD1 3.43Å; S108-N111 CarbonylContact C-O 3.47Å; S108-N111 PolarHBondContact N-O 2.97Å; S108-N111 PolarHBondContact O-N 3.01Å; S108-N111 VanDerWaalsContact O-O 3.11Å; N111-V113 HydrophobicContact CB-CG2 4.4Å |
| 112 | F | 97.7 | Very high | 96 | Very high | 5 Ų | 5 | 72.3 Ų | 72.3 | 2% | 0.022 | 38% | 0.381 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.8 | 128.9 | 168.9 | -67.8 | -102.5 | 0 | 0 | 0 | 107.9 | R83 W84 G88 V91 L105 T106 R107 | R83-F112 CarbonylContact C-O 3.56Å; R83-F112 WeakPolarHBondContact CA-O 3.32Å; W84-F112 HydrophobicContact CB-CB 4.24Å; W84-F112 AromaticContact CD1-CD2 3.95Å; W84-F112 PolarHBondContact N-O 2.77Å; W84-F112 PolarHBondContact O-N 3.43Å; G88-F112 WeakPolarHBondContact O-CZ 3.4Å; V91-F112 HydrophobicContact CB-CB 4.17Å; V91-F112 HydrophobicContact CB-CD1 3.64Å; V91-F112 HydrophobicContact CB-CD2 4.44Å; V91-F112 HydrophobicContact CB-CE1 4.07Å; V91-F112 HydrophobicContact CB-CG 3.84Å; V91-F112 HydrophobicContact CG1-CB 4.3Å; V91-F112 HydrophobicContact CG1-CG 4.42Å; V91-F112 HydrophobicContact CG2-CB 4.42Å; V91-F112 HydrophobicContact CG2-CD1 3.6Å; V91-F112 HydrophobicContact CG2-CD2 3.79Å; V91-F112 HydrophobicContact CG2-CE1 3.62Å; V91-F112 HydrophobicContact CG2-CE2 3.84Å; V91-F112 HydrophobicContact CG2-CG 3.67Å; V91-F112 HydrophobicContact CG2-CZ 3.75Å; L105-F112 HydrophobicContact CB-CB 3.8Å; L105-F112 HydrophobicContact CB-CD1 4.42Å; L105-F112 HydrophobicContact CD1-CB 3.87Å; T106-F112 WeakPolarHBondContact O-CA 3.24Å; R107-F112 HydrophobicContact CB-CD1 3.78Å; R107-F112 HydrophobicContact CB-CE1 3.53Å; R107-F112 HydrophobicContact CB-CZ 4.09Å; R107-F112 HydrophobicContact CG-CD1 4.11Å; R107-F112 HydrophobicContact CG-CE1 3.6Å; R107-F112 HydrophobicContact CG-CE2 4.12Å; R107-F112 HydrophobicContact CG-CZ 3.59Å |
| 113 | V | 97.5 | Very high | 96 | Very high | 42 Ų | 42 | 68.5 Ų | 68.5 | 26% | 0.255 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.8 | 143 | -170.2 | -175.7 | 0 | 0 | 0 | 0 | 111.2 | V81 F82 R83 T106 N111 I115 | V81-V113 HydrophobicContact CG1-CG1 4.05Å; F82-V113 WeakPolarHBondContact O-CA 3.29Å; R83-V113 HydrophobicContact CB-CG2 4.37Å; R83-V113 HydrophobicContact CG-CG2 4.07Å; T106-V113 PolarHBondContact N-O 3.15Å; T106-V113 PolarHBondContact O-N 2.87Å; N111-V113 HydrophobicContact CB-CG2 4.4Å; V113-I115 HydrophobicContact CG1-CG1 4.47Å |
| 114 | A | 97.2 | Very high | 96 | Very high | 15 Ų | 15 | 68.4 Ų | 68.4 | 12% | 0.124 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.4 | 146.7 | 158.1 | 0 | 0 | 0 | 0 | 0 | 109 | F82 L103 L105 | F82-A114 PolarHBondContact N-O 2.97Å; F82-A114 PolarHBondContact O-N 3.03Å; L103-A114 HydrophobicContact CD2-CB 4.1Å; L105-A114 HydrophobicContact CD2-CB 3.39Å |
| 115 | I | 97.2 | Very high | 96 | Very high | 111 Ų | 111 | 64.9 Ų | 64.9 | 57% | 0.569 | 34% | 0.339 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -112.8 | 123.3 | 172.2 | -54.3 | -178.6 | 0 | 0 | 0 | 106.2 | P79 T80 V81 V113 | P79-I115 HydrophobicContact CB-CG2 4.06Å; T80-I115 WeakPolarHBondContact O-CA 3.28Å; V81-I115 HydrophobicContact CG2-CG1 4.27Å; V113-I115 HydrophobicContact CG1-CG1 4.47Å |
| 116 | L | 96.8 | Very high | 96 | Very high | 39 Ų | 39 | 65.5 Ų | 65.5 | 20% | 0.204 | 34% | 0.341 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.1 | 132.1 | -176.3 | -63.5 | 178.2 | 0 | 0 | 0 | 109.9 | T80 F82 L93 F97 L103 L118 | T80-L116 WeakPolarHBondContact CB-O 3.29Å; T80-L116 PolarHBondContact N-O 3.44Å; T80-L116 PolarHBondContact O-N 2.89Å; F82-L116 HydrophobicContact CD2-CB 4.45Å; F82-L116 HydrophobicContact CD2-CD1 4.11Å; F82-L116 HydrophobicContact CD2-CG 4.39Å; F82-L116 HydrophobicContact CE2-CB 4.27Å; F82-L116 HydrophobicContact CE2-CD1 4.13Å; L93-L116 HydrophobicContact CD2-CD1 3.89Å; F97-L116 HydrophobicContact CD2-CD1 3.97Å; F97-L116 HydrophobicContact CE2-CD1 3.42Å; F97-L116 VanDerWaalsContact CE2-CD1 3.42Å; F97-L116 HydrophobicContact CZ-CD1 4.08Å; L103-L116 HydrophobicContact CD2-CD1 3.78Å; L103-L116 HydrophobicContact CD2-CD2 3.73Å; L103-L116 HydrophobicContact CD2-CG 4.16Å; L116-L118 HydrophobicContact CB-CD2 4.26Å; L116-L118 HydrophobicContact CB-CG 4.43Å; L116-L118 PolarHBondContact O-N 2.91Å |
| 117 | D | 96.6 | Very high | 96.1 | Very high | 101 Ų | 101 | 60.3 Ų | 60.3 | 54% | 0.54 | 31% | 0.309 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.2 | 115 | 171.8 | -66.8 | -35.6 | 0 | 0 | 0 | 109.7 | A77 R78 P79 | A77-D117 HydrophobicContact CB-CB 3.91Å; R78-D117 WeakPolarHBondContact O-CA 2.79Å; P79-D117 WeakPolarHBondContact CA-OD1 3.12Å; P79-D117 WeakPolarHBondContact CG-OD1 3.47Å |
| 118 | L | 96.2 | Very high | 96.2 | Very high | 4 Ų | 4 | 54.6 Ų | 54.6 | 2% | 0.021 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.1 | 145 | -178.4 | -62.4 | -172.3 | 0 | 0 | 0 | 111.6 | Q76 R78 T80 F82 F97 L116 V155 | Q76-L118 CarbonylContact O-C 3.58Å; R78-L118 WeakPolarHBondContact CB-O 3.23Å; R78-L118 PolarHBondContact N-O 3.41Å; R78-L118 VanDerWaalsContact N-O 3.13Å; R78-L118 PolarHBondContact O-N 2.85Å; T80-L118 HydrophobicContact CG2-CD1 4.16Å; F82-L118 HydrophobicContact CE2-CD1 3.74Å; F82-L118 HydrophobicContact CZ-CD1 3.65Å; F97-L118 HydrophobicContact CB-CD2 3.5Å; F97-L118 HydrophobicContact CD1-CD1 4.06Å; F97-L118 HydrophobicContact CD1-CD2 3.94Å; F97-L118 HydrophobicContact CD2-CD2 4.07Å; F97-L118 HydrophobicContact CE1-CD1 4.4Å; F97-L118 HydrophobicContact CG-CD2 3.57Å; L116-L118 HydrophobicContact CB-CD2 4.26Å; L116-L118 HydrophobicContact CB-CG 4.43Å; L116-L118 PolarHBondContact O-N 2.91Å; L118-V155 HydrophobicContact CB-CG2 4.11Å; L118-V155 HydrophobicContact CD1-CG2 4.22Å |
| 119 | P | 95.3 | Very high | 96.5 | Very high | 64 Ų | 64 | 52.4 Ų | 52.4 | 42% | 0.416 | 27% | 0.272 | S | S | . | . | trans | -63.3 | 152.4 | 166 | -21.7 | 33.4 | 0 | 0 | 0 | 111.9 | Q76 G121 H123 | Q76-P119 VanDerWaalsContact O-CA 3.23Å; Q76-P119 WeakPolarHBondContact O-CA 3.38Å; P119-G121 PolarHBondContact O-N 3.03Å; P119-H123 PolarHBondContact O-NE2 2.82Å | ||
| 120 | E | 95.7 | Very high | 96.8 | Very high | 108 Ų | 108 | 48.6 Ų | 48.6 | 51% | 0.505 | 26% | 0.257 | S | S | . | . | S | Bend | trans | -56.3 | 133.7 | 169.2 | -169.2 | 173.5 | 156.8 | 0 | 0 | 110.6 | R78 V155 | R78-E120 IonicContact CZ-OE2 3.18Å; R78-E120 IonicContact NH1-OE2 2.8Å; R78-E120 PolarHBondContact NH1-OE2 2.9Å; R78-E120 IonicContact NH2-OE2 2.75Å; R78-E120 PolarHBondContact NH2-OE2 2.89Å; E120-V155 VanDerWaalsContact CG-O 3.24Å; E120-V155 WeakPolarHBondContact CG-O 3.34Å |
| 121 | G | 96 | Very high | 97 | Very high | 19 Ų | 19 | 45.6 Ų | 45.6 | 20% | 0.196 | 25% | 0.252 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 141.8 | -174.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | P119 Q154 V155 | P119-G121 PolarHBondContact O-N 3.03Å; G121-Q154 VanDerWaalsContact C-NE2 3.27Å; G121-Q154 PolarHBondContact O-NE2 2.81Å; G121-V155 PolarHBondContact N-O 3.05Å; G121-V155 VanDerWaalsContact N-O 3.12Å; G121-V155 PolarHBondContact O-N 3.02Å |
| 122 | E | 97.8 | Very high | 97 | Very high | 108 Ų | 108 | 50 Ų | 50 | 51% | 0.505 | 27% | 0.271 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.7 | 132.2 | 175.1 | -175 | -175.6 | 120.6 | 0 | 0 | 110 | I152 | E122-I152 HydrophobicContact CG-CD1 3.58Å; E122-I152 HydrophobicContact CG-CG1 3.71Å |
| 123 | H | 97.7 | Very high | 97 | Very high | 21 Ų | 21 | 55.6 Ų | 55.6 | 10% | 0.097 | 29% | 0.292 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.2 | 137.4 | 171.7 | -61.8 | -85.5 | 0 | 0 | 0 | 110.4 | S96 F97 P119 I152 I153 | S96-H123 WeakPolarHBondContact OG-CA 3.38Å; F97-H123 HydrophobicContact CD1-CB 4.05Å; P119-H123 PolarHBondContact O-NE2 2.82Å; H123-I152 WeakPolarHBondContact O-CA 3.07Å; H123-I153 HydrophobicContact CB-CG2 3.91Å; H123-I153 PolarHBondContact N-O 2.91Å; H123-I153 PolarHBondContact O-N 2.98Å |
| 124 | Q | 98 | Very high | 97 | Very high | 54 Ų | 54 | 55.7 Ų | 55.7 | 25% | 0.252 | 29% | 0.293 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 141.1 | 173.9 | -65.6 | -176.3 | 25 | 0 | 0 | 109.9 | G95 S96 W100 V142 N150 N151 | G95-Q124 CarbonylContact C-O 3.47Å; G95-Q124 WeakPolarHBondContact CA-O 3.33Å; S96-Q124 PolarHBondContact N-O 3.27Å; S96-Q124 PolarHBondContact OG-N 3.05Å; W100-Q124 HydrophobicContact CH2-CB 4.2Å; W100-Q124 HydrophobicContact CZ2-CB 4.3Å; Q124-V142 HydrophobicContact CG-CG1 3.97Å; Q124-N150 HydrophobicContact CB-CB 4.42Å; Q124-N150 PolarHBondContact OE1-ND2 3.17Å; Q124-N151 WeakPolarHBondContact CA-O 3.4Å |
| 125 | Y | 98.4 | Very high | 97 | Very high | 11 Ų | 11 | 57.6 Ų | 57.6 | 4% | 0.043 | 30% | 0.299 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.4 | 165.6 | -179.1 | 69 | -80.1 | 0 | 0 | 0 | 112.2 | F82 L93 S94 F127 N151 I153 | F82-Y125 HydrophobicContact CD1-CD1 4.44Å; F82-Y125 AromaticContact CD1-CD2 3.95Å; F82-Y125 HydrophobicContact CD1-CD2 3.95Å; F82-Y125 HydrophobicContact CD1-CE1 4.44Å; F82-Y125 AromaticContact CD1-CE2 3.93Å; F82-Y125 HydrophobicContact CD1-CE2 3.93Å; F82-Y125 HydrophobicContact CD1-CG 4.19Å; F82-Y125 AromaticContact CE1-CD1 3.74Å; F82-Y125 HydrophobicContact CE1-CD1 3.74Å; F82-Y125 HydrophobicContact CE1-CD2 4.02Å; F82-Y125 AromaticContact CE1-CE1 3.93Å; F82-Y125 HydrophobicContact CE1-CE1 3.93Å; F82-Y125 HydrophobicContact CE1-CE2 4.18Å; F82-Y125 AromaticContact CE1-CG 3.78Å; F82-Y125 HydrophobicContact CE1-CG 3.78Å; L93-Y125 HydrophobicContact CD1-CD2 3.59Å; L93-Y125 HydrophobicContact CD1-CG 4.17Å; S94-Y125 CarbonylContact O-C 3.54Å; S94-Y125 VanDerWaalsContact O-CA 3.23Å; S94-Y125 WeakPolarHBondContact O-CA 3.15Å; Y125-F127 HydrophobicContact CD2-CE2 4.11Å; Y125-F127 HydrophobicContact CD2-CZ 4.31Å; Y125-F127 HydrophobicContact CE2-CD2 4.47Å; Y125-F127 AromaticContact CE2-CE2 3.61Å; Y125-F127 HydrophobicContact CE2-CE2 3.61Å; Y125-F127 AromaticContact CE2-CZ 3.87Å; Y125-F127 HydrophobicContact CE2-CZ 3.87Å; Y125-N151 HydrophobicContact CD1-CB 3.8Å; Y125-N151 HydrophobicContact CD2-CB 3.96Å; Y125-N151 HydrophobicContact CE1-CB 3.35Å; Y125-N151 HydrophobicContact CE2-CB 3.54Å; Y125-N151 HydrophobicContact CG-CB 4.09Å; Y125-N151 PolarHBondContact N-O 3.4Å; Y125-N151 PolarHBondContact O-N 2.91Å; Y125-I153 HydrophobicContact CD1-CG2 4.11Å; Y125-I153 HydrophobicContact CE1-CB 4.03Å; Y125-I153 HydrophobicContact CE1-CG2 4.03Å |
| 126 | K | 98.1 | Very high | 97 | Very high | 30 Ų | 30 | 52.9 Ų | 52.9 | 13% | 0.13 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -153.8 | 148.1 | 177.7 | -170.9 | 174.1 | -92.1 | 164.2 | 0 | 110.1 | S94 W100 W133 T134 V149 N150 | S94-K126 PolarHBondContact N-O 2.88Å; S94-K126 PolarHBondContact O-N 2.96Å; W100-K126 HydrophobicContact CZ3-CB 4.19Å; K126-W133 HydrophobicContact CB-CE3 4.28Å; K126-W133 HydrophobicContact CB-CZ3 4.35Å; K126-W133 HydrophobicContact CD-CB 4.17Å; K126-W133 HydrophobicContact CD-CD2 4.34Å; K126-W133 HydrophobicContact CD-CE3 3.73Å; K126-W133 HydrophobicContact CG-CE3 3.82Å; K126-W133 HydrophobicContact CG-CZ3 4.37Å; K126-T134 WeakPolarHBondContact CG-O 3.5Å; K126-V149 WeakPolarHBondContact CE-O 3.44Å; K126-V149 PolarHBondContact NZ-O 2.98Å; K126-N150 WeakPolarHBondContact CE-OD1 3.34Å; K126-N150 PolarHBondContact NZ-OD1 3.31Å |
| 127 | F | 98.3 | Very high | 96.9 | Very high | 1 Ų | 1 | 56.3 Ų | 56.3 | 0% | 0.004 | 30% | 0.299 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.1 | 146.5 | 175.5 | -62.3 | -82.6 | 0 | 0 | 0 | 111.4 | W84 V91 Y92 L93 L105 Y125 V129 T134 D136 | W84-F127 HydrophobicContact CB-CD1 4.05Å; W84-F127 HydrophobicContact CB-CE1 3.82Å; W84-F127 HydrophobicContact CB-CZ 4.18Å; W84-F127 HydrophobicContact CD2-CG 4.43Å; W84-F127 HydrophobicContact CE3-CB 4.25Å; W84-F127 HydrophobicContact CE3-CD1 4.38Å; W84-F127 AromaticContact CE3-CD2 3.59Å; W84-F127 HydrophobicContact CE3-CD2 3.59Å; W84-F127 AromaticContact CE3-CE2 3.93Å; W84-F127 HydrophobicContact CE3-CE2 3.93Å; W84-F127 AromaticContact CE3-CG 3.82Å; W84-F127 HydrophobicContact CE3-CG 3.82Å; W84-F127 HydrophobicContact CE3-CZ 4.47Å; W84-F127 HydrophobicContact CZ3-CD2 4.02Å; W84-F127 HydrophobicContact CZ3-CG 4.42Å; V91-F127 HydrophobicContact CG1-CD1 4.27Å; Y92-F127 CarbonylContact O-C 3.39Å; Y92-F127 WeakPolarHBondContact O-CA 3.39Å; L93-F127 HydrophobicContact CD1-CD1 4.23Å; L93-F127 HydrophobicContact CD1-CE1 3.97Å; L93-F127 HydrophobicContact CD1-CZ 4.38Å; L105-F127 HydrophobicContact CD1-CD1 3.99Å; L105-F127 HydrophobicContact CD1-CE1 3.79Å; Y125-F127 HydrophobicContact CD2-CE2 4.11Å; Y125-F127 HydrophobicContact CD2-CZ 4.31Å; Y125-F127 HydrophobicContact CE2-CD2 4.47Å; Y125-F127 AromaticContact CE2-CE2 3.61Å; Y125-F127 HydrophobicContact CE2-CE2 3.61Å; Y125-F127 AromaticContact CE2-CZ 3.87Å; Y125-F127 HydrophobicContact CE2-CZ 3.87Å; F127-V129 HydrophobicContact CB-CG2 4.05Å; F127-T134 WeakPolarHBondContact CA-O 3.33Å; F127-T134 HydrophobicContact CB-CG2 4.24Å; F127-T134 PolarHBondContact N-O 3.48Å; F127-T134 PolarHBondContact O-N 3.39Å; F127-D136 HydrophobicContact CD2-CB 4.45Å; F127-D136 HydrophobicContact CE2-CB 3.96Å |
| 128 | F | 97.9 | Very high | 96.9 | Very high | 29 Ų | 29 | 56 Ų | 56 | 13% | 0.127 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.8 | 103.5 | 168.4 | -172.7 | -102.6 | 0 | 0 | 0 | 108 | V91 Y92 K102 G131 Q132 W133 | V91-F128 WeakPolarHBondContact CA-O 3.46Å; Y92-F128 AromaticContact CD2-CD1 3.9Å; Y92-F128 HydrophobicContact CD2-CD1 3.9Å; Y92-F128 HydrophobicContact CE2-CD1 4.47Å; Y92-F128 PolarHBondContact N-O 3.35Å; Y92-F128 PolarHBondContact O-N 2.95Å; K102-F128 HydrophobicContact CD-CD1 4.13Å; K102-F128 HydrophobicContact CD-CE1 4.48Å; K102-F128 VanDerWaalsContact NZ-CZ 3.26Å; F128-G131 VanDerWaalsContact CE2-C 3.44Å; F128-G131 VanDerWaalsContact CE2-O 3.25Å; F128-G131 WeakPolarHBondContact CE2-O 3.04Å; F128-G131 VanDerWaalsContact CZ-C 3.4Å; F128-G131 WeakPolarHBondContact CZ-O 3.36Å; F128-Q132 CarbonylContact C-O 3.57Å; F128-Q132 WeakPolarHBondContact CA-O 3.35Å; F128-W133 HydrophobicContact CB-CD2 4.34Å; F128-W133 HydrophobicContact CB-CE3 3.96Å; F128-W133 HydrophobicContact CB-CH2 4.25Å; F128-W133 HydrophobicContact CB-CZ3 3.92Å; F128-W133 AromaticContact CD2-CD1 3.85Å; F128-W133 AromaticContact CD2-CD2 3.57Å; F128-W133 HydrophobicContact CD2-CD2 3.57Å; F128-W133 AromaticContact CD2-CE2 3.54Å; F128-W133 HydrophobicContact CD2-CE3 4.07Å; F128-W133 AromaticContact CD2-CG 3.8Å; F128-W133 HydrophobicContact CD2-CG 3.8Å; F128-W133 HydrophobicContact CD2-CZ2 4.06Å; F128-W133 AromaticContact CD2-NE1 3.7Å; F128-W133 AromaticContact CE2-CD1 3.92Å; F128-W133 HydrophobicContact CE2-CD2 4.37Å; F128-W133 HydrophobicContact CE2-CG 4.3Å; F128-W133 AromaticContact CE2-NE1 3.77Å; F128-W133 HydrophobicContact CG-CD2 4.42Å |
| 129 | V | 97.4 | Very high | 97 | Very high | 17 Ų | 17 | 59.8 Ų | 59.8 | 10% | 0.103 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 118.1 | -171.4 | 179.6 | 0 | 0 | 0 | 0 | 108.2 | W84 V91 F127 G131 Q132 T134 | W84-V129 HydrophobicContact CD2-CG2 4.17Å; W84-V129 HydrophobicContact CH2-CG2 4.39Å; W84-V129 HydrophobicContact CZ2-CG2 3.83Å; V91-V129 HydrophobicContact CG1-CG2 3.95Å; V91-V129 HydrophobicContact CG2-CG1 4.22Å; V91-V129 HydrophobicContact CG2-CG2 4.3Å; F127-V129 HydrophobicContact CB-CG2 4.05Å; V129-G131 PolarHBondContact O-N 3.15Å; V129-G131 VanDerWaalsContact O-N 3.08Å; V129-Q132 PolarHBondContact N-O 3.27Å; V129-Q132 PolarHBondContact O-N 3.12Å; V129-T134 HydrophobicContact CB-CG2 4.2Å; V129-T134 HydrophobicContact CG2-CG2 3.71Å |
| 130 | D | 96 | Very high | 97.1 | Very high | 86 Ų | 86 | 60.5 Ų | 60.5 | 46% | 0.46 | 33% | 0.327 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 47.8 | 41.2 | 176.3 | -67.5 | -21.1 | 0 | 0 | 0 | 114.4 | G88 K89 E90 | G88-D130 WeakPolarHBondContact CA-OD2 3.46Å; K89-D130 WeakPolarHBondContact CA-OD1 3.33Å; K89-D130 WeakPolarHBondContact CB-OD1 3.49Å; K89-D130 PolarHBondContact N-OD1 3.46Å; K89-D130 PolarHBondContact N-OD2 3.43Å; E90-D130 PolarHBondContact N-OD1 3.49Å; E90-D130 PolarHBondContact O-N 3.26Å |
| 131 | G | 95.7 | Very high | 97.2 | Very high | 44 Ų | 44 | 59.3 Ų | 59.3 | 45% | 0.454 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 91.1 | -5.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | F128 V129 | F128-G131 VanDerWaalsContact CE2-C 3.44Å; F128-G131 VanDerWaalsContact CE2-O 3.25Å; F128-G131 WeakPolarHBondContact CE2-O 3.04Å; F128-G131 VanDerWaalsContact CZ-C 3.4Å; F128-G131 WeakPolarHBondContact CZ-O 3.36Å; V129-G131 PolarHBondContact O-N 3.15Å; V129-G131 VanDerWaalsContact O-N 3.08Å |
| 132 | Q | 96.7 | Very high | 97.3 | Very high | 140 Ų | 140 | 60.5 Ų | 60.5 | 65% | 0.654 | 33% | 0.327 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -112.6 | 134.6 | -176.4 | -61.8 | -64.1 | -21.2 | 0 | 0 | 111.8 | F128 V129 | F128-Q132 CarbonylContact C-O 3.57Å; F128-Q132 WeakPolarHBondContact CA-O 3.35Å; V129-Q132 PolarHBondContact N-O 3.27Å; V129-Q132 PolarHBondContact O-N 3.12Å |
| 133 | W | 96.7 | Very high | 97.2 | Very high | 123 Ų | 123 | 59.4 Ų | 59.4 | 47% | 0.466 | 33% | 0.328 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.8 | 121.9 | 171.8 | -78.1 | 109.9 | 0 | 0 | 0 | 110.1 | K126 F128 | K126-W133 HydrophobicContact CB-CE3 4.28Å; K126-W133 HydrophobicContact CB-CZ3 4.35Å; K126-W133 HydrophobicContact CD-CB 4.17Å; K126-W133 HydrophobicContact CD-CD2 4.34Å; K126-W133 HydrophobicContact CD-CE3 3.73Å; K126-W133 HydrophobicContact CG-CE3 3.82Å; K126-W133 HydrophobicContact CG-CZ3 4.37Å; F128-W133 HydrophobicContact CB-CD2 4.34Å; F128-W133 HydrophobicContact CB-CE3 3.96Å; F128-W133 HydrophobicContact CB-CH2 4.25Å; F128-W133 HydrophobicContact CB-CZ3 3.92Å; F128-W133 AromaticContact CD2-CD1 3.85Å; F128-W133 AromaticContact CD2-CD2 3.57Å; F128-W133 HydrophobicContact CD2-CD2 3.57Å; F128-W133 AromaticContact CD2-CE2 3.54Å; F128-W133 HydrophobicContact CD2-CE3 4.07Å; F128-W133 AromaticContact CD2-CG 3.8Å; F128-W133 HydrophobicContact CD2-CG 3.8Å; F128-W133 HydrophobicContact CD2-CZ2 4.06Å; F128-W133 AromaticContact CD2-NE1 3.7Å; F128-W133 AromaticContact CE2-CD1 3.92Å; F128-W133 HydrophobicContact CE2-CD2 4.37Å; F128-W133 HydrophobicContact CE2-CG 4.3Å; F128-W133 AromaticContact CE2-NE1 3.77Å; F128-W133 HydrophobicContact CG-CD2 4.42Å |
| 134 | T | 97 | Very high | 96.8 | Very high | 45 Ų | 45 | 61.3 Ų | 61.3 | 28% | 0.276 | 34% | 0.343 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.3 | 154.5 | -179.9 | -169.5 | 0 | 0 | 0 | 0 | 111.4 | W84 K126 F127 V129 | W84-T134 HydrophobicContact CH2-CG2 3.55Å; W84-T134 HydrophobicContact CZ2-CG2 4.14Å; W84-T134 HydrophobicContact CZ3-CG2 3.96Å; K126-T134 WeakPolarHBondContact CG-O 3.5Å; F127-T134 WeakPolarHBondContact CA-O 3.33Å; F127-T134 HydrophobicContact CB-CG2 4.24Å; F127-T134 PolarHBondContact N-O 3.48Å; F127-T134 PolarHBondContact O-N 3.39Å; V129-T134 HydrophobicContact CB-CG2 4.2Å; V129-T134 HydrophobicContact CG2-CG2 3.71Å |
| 135 | H | 96.9 | Very high | 96.5 | Very high | 54 Ų | 54 | 68.4 Ų | 68.4 | 25% | 0.25 | 38% | 0.377 | C | S | . | . | trans | -101.9 | 163.2 | 168.4 | 66.6 | -85.3 | 0 | 0 | 0 | 109.1 | P137 N151 | H135-P137 WeakPolarHBondContact O-CD 3.45Å; H135-N151 VanDerWaalsContact CA-OD1 3.29Å; H135-N151 WeakPolarHBondContact CA-OD1 3.37Å; H135-N151 VanDerWaalsContact CB-OD1 3.28Å; H135-N151 WeakPolarHBondContact CB-OD1 3.33Å | ||
| 136 | D | 97 | Very high | 96.2 | Very high | 13 Ų | 13 | 75.5 Ų | 75.5 | 7% | 0.07 | 41% | 0.414 | C | S | . | . | trans | -82.4 | 116.3 | 168.7 | -169.4 | -33.1 | 0 | 0 | 0 | 109.4 | W84 F127 S138 E139 N151 | W84-D136 HydrophobicContact CE3-CB 4.39Å; W84-D136 HydrophobicContact CZ3-CB 4.24Å; F127-D136 HydrophobicContact CD2-CB 4.45Å; F127-D136 HydrophobicContact CE2-CB 3.96Å; D136-S138 PolarHBondContact O-N 3.46Å; D136-S138 WeakPolarHBondContact OD1-CB 3.23Å; D136-S138 PolarHBondContact OD1-N 3.13Å; D136-S138 PolarHBondContact OD1-OG 3.31Å; D136-E139 HydrophobicContact CB-CB 4.25Å; D136-E139 HydrophobicContact CB-CG 4.13Å; D136-E139 PolarHBondContact O-N 2.98Å; D136-N151 PolarHBondContact N-OD1 3.08Å; D136-N151 PolarHBondContact O-ND2 2.79Å | ||
| 137 | P | 96.2 | Very high | 95.9 | Very high | 110 Ų | 110 | 76.7 Ų | 76.7 | 71% | 0.714 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.3 | -15.5 | 180 | -18.7 | 33.3 | 0 | 0 | 0 | 114.6 | H135 | H135-P137 WeakPolarHBondContact O-CD 3.45Š|
| 138 | S | 96.3 | Very high | 95.7 | Very high | 94 Ų | 94 | 79.7 Ų | 79.7 | 66% | 0.657 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.5 | -15.6 | 179.5 | 68.7 | 0 | 0 | 0 | 0 | 113.2 | D136 | D136-S138 PolarHBondContact O-N 3.46Å; D136-S138 WeakPolarHBondContact OD1-CB 3.23Å; D136-S138 PolarHBondContact OD1-N 3.13Å; D136-S138 PolarHBondContact OD1-OG 3.31Å |
| 139 | E | 97.5 | Very high | 95.7 | Very high | 85 Ų | 85 | 80.3 Ų | 80.3 | 40% | 0.397 | 46% | 0.46 | S | S | . | . | S | Bend | trans | -103.2 | 156.6 | -179.2 | -63.4 | -62.1 | 160.8 | 0 | 0 | 111.3 | D136 | D136-E139 HydrophobicContact CB-CB 4.25Å; D136-E139 HydrophobicContact CB-CG 4.13Å; D136-E139 PolarHBondContact O-N 2.98Å |
| 140 | P | 97.8 | Very high | 95.7 | Very high | 79 Ų | 79 | 80.1 Ų | 80.1 | 51% | 0.513 | 46% | 0.458 | S | S | . | . | trans | -55.7 | 145.5 | 176.7 | -25.3 | 35.1 | 0 | 0 | 0 | 113.3 | N151 I152 | P140-N151 VanDerWaalsContact O-CA 3.29Å; P140-N151 WeakPolarHBondContact O-CA 3.27Å; P140-N151 PolarHBondContact O-ND2 3.34Å; P140-I152 HydrophobicContact CB-CG2 3.84Å; P140-I152 PolarHBondContact O-N 3.01Å | ||
| 141 | I | 98.1 | Very high | 95.8 | Very high | 83 Ų | 83 | 76 Ų | 76 | 43% | 0.426 | 44% | 0.436 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.7 | 156.8 | 179.6 | 60.6 | 168.1 | 0 | 0 | 0 | 112.6 | V149 N150 N151 | I141-V149 HydrophobicContact CB-CG1 4.21Å; I141-V149 HydrophobicContact CD1-CG1 3.92Å; I141-V149 HydrophobicContact CG2-CG1 4.41Å; I141-N150 CarbonylContact C-O 3.56Å; I141-N150 VanDerWaalsContact CA-O 3.24Å; I141-N150 WeakPolarHBondContact CA-O 3.47Å; I141-N150 WeakPolarHBondContact CB-O 3.43Å; I141-N151 WeakPolarHBondContact CG2-ND2 3.49Å |
| 142 | V | 97.5 | Very high | 95.9 | Very high | 44 Ų | 44 | 75.6 Ų | 75.6 | 27% | 0.267 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.6 | 138.6 | 170.2 | 64.5 | 0 | 0 | 0 | 0 | 109.7 | Q124 N150 I152 | Q124-V142 HydrophobicContact CG-CG1 3.97Å; V142-N150 HydrophobicContact CG1-CB 4.49Å; V142-N150 PolarHBondContact N-O 3.33Å; V142-N150 PolarHBondContact O-N 2.94Å; V142-I152 HydrophobicContact CB-CB 4.36Å; V142-I152 HydrophobicContact CB-CD1 4.3Å; V142-I152 HydrophobicContact CB-CG2 4.41Å; V142-I152 HydrophobicContact CG1-CB 4.09Å; V142-I152 HydrophobicContact CG1-CD1 4.36Å |
| 143 | T | 96.4 | Very high | 96 | Very high | 85 Ų | 85 | 71 Ų | 71 | 52% | 0.521 | 40% | 0.402 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 121.1 | 178.6 | -55.6 | 0 | 0 | 0 | 0 | 109.7 | T148 V149 | T143-T148 WeakPolarHBondContact CA-O 3.41Å; T143-V149 HydrophobicContact CG2-CG2 4.14Å |
| 144 | S | 89.9 | Confident | 96 | Very high | 61 Ų | 61 | 69.3 Ų | 69.3 | 43% | 0.427 | 40% | 0.4 | S | S | . | . | trans | -71.4 | 159.2 | 175.1 | 178.4 | 0 | 0 | 0 | 0 | 111.5 | L146 G147 T148 | S144-L146 PolarHBondContact O-N 3.21Å; S144-L146 VanDerWaalsContact O-N 3.09Å; S144-G147 PolarHBondContact O-N 2.67Å; S144-T148 PolarHBondContact N-O 3.34Å | ||
| 145 | Q | 90.9 | Very high | 96 | Very high | 203 Ų | 203 | 67.4 Ų | 67.4 | 95% | 0.949 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | -23.8 | 174.1 | -61.1 | 179.3 | 13.1 | 0 | 0 | 112.9 | G147 | Q145-G147 VanDerWaalsContact C-N 3.28Å; Q145-G147 PolarHBondContact O-N 3.3Å |
| 146 | L | 92.6 | Very high | 95.9 | Very high | 159 Ų | 159 | 69.9 Ų | 69.9 | 83% | 0.832 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.8 | 2.5 | 176.4 | -60 | 175.5 | 0 | 0 | 0 | 113.6 | S144 | S144-L146 PolarHBondContact O-N 3.21Å; S144-L146 VanDerWaalsContact O-N 3.09Å |
| 147 | G | 92.3 | Very high | 95.7 | Very high | 55 Ų | 55 | 75.1 Ų | 75.1 | 57% | 0.567 | 42% | 0.42 | S | S | * | . | S | Bend | trans | 84.6 | 1.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 115 | S144 Q145 V149 | S144-G147 PolarHBondContact O-N 2.67Å; Q145-G147 VanDerWaalsContact C-N 3.28Å; Q145-G147 PolarHBondContact O-N 3.3Å; G147-V149 PolarHBondContact O-N 3.38Å |
| 148 | T | 93.5 | Very high | 95.5 | Very high | 65 Ų | 65 | 72.4 Ų | 72.4 | 40% | 0.399 | 40% | 0.402 | S | S | . | . | trans | -72.6 | 121.4 | 175.9 | -53.6 | 0 | 0 | 0 | 0 | 110.8 | T143 S144 | T143-T148 WeakPolarHBondContact CA-O 3.41Å; S144-T148 PolarHBondContact N-O 3.34Å | ||
| 149 | V | 97.1 | Very high | 95.3 | Very high | 41 Ų | 41 | 71.4 Ų | 71.4 | 25% | 0.248 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.8 | 119.9 | 176.1 | -177.3 | 0 | 0 | 0 | 0 | 110 | K126 I141 T143 G147 | K126-V149 WeakPolarHBondContact CE-O 3.44Å; K126-V149 PolarHBondContact NZ-O 2.98Å; I141-V149 HydrophobicContact CB-CG1 4.21Å; I141-V149 HydrophobicContact CD1-CG1 3.92Å; I141-V149 HydrophobicContact CG2-CG1 4.41Å; T143-V149 HydrophobicContact CG2-CG2 4.14Å; G147-V149 PolarHBondContact O-N 3.38Å |
| 150 | N | 97.9 | Very high | 95.1 | Very high | 14 Ų | 14 | 70.7 Ų | 70.7 | 8% | 0.075 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 157.7 | 174.9 | -65.3 | -25.3 | 0 | 0 | 0 | 109.9 | W100 Q124 K126 I141 V142 | W100-N150 WeakPolarHBondContact CH2-ND2 3.24Å; Q124-N150 HydrophobicContact CB-CB 4.42Å; Q124-N150 PolarHBondContact OE1-ND2 3.17Å; K126-N150 WeakPolarHBondContact CE-OD1 3.34Å; K126-N150 PolarHBondContact NZ-OD1 3.31Å; I141-N150 CarbonylContact C-O 3.56Å; I141-N150 VanDerWaalsContact CA-O 3.24Å; I141-N150 WeakPolarHBondContact CA-O 3.47Å; I141-N150 WeakPolarHBondContact CB-O 3.43Å; V142-N150 HydrophobicContact CG1-CB 4.49Å; V142-N150 PolarHBondContact N-O 3.33Å; V142-N150 PolarHBondContact O-N 2.94Å |
| 151 | N | 98.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 71.6 Ų | 71.6 | 0% | 0 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.5 | 154 | 163.1 | -69.2 | 109.8 | 0 | 0 | 0 | 110.3 | Q124 Y125 H135 D136 P140 I141 | Q124-N151 WeakPolarHBondContact CA-O 3.4Å; Y125-N151 HydrophobicContact CD1-CB 3.8Å; Y125-N151 HydrophobicContact CD2-CB 3.96Å; Y125-N151 HydrophobicContact CE1-CB 3.35Å; Y125-N151 HydrophobicContact CE2-CB 3.54Å; Y125-N151 HydrophobicContact CG-CB 4.09Å; Y125-N151 PolarHBondContact N-O 3.4Å; Y125-N151 PolarHBondContact O-N 2.91Å; H135-N151 VanDerWaalsContact CA-OD1 3.29Å; H135-N151 WeakPolarHBondContact CA-OD1 3.37Å; H135-N151 VanDerWaalsContact CB-OD1 3.28Å; H135-N151 WeakPolarHBondContact CB-OD1 3.33Å; D136-N151 PolarHBondContact N-OD1 3.08Å; D136-N151 PolarHBondContact O-ND2 2.79Å; P140-N151 VanDerWaalsContact O-CA 3.29Å; P140-N151 WeakPolarHBondContact O-CA 3.27Å; P140-N151 PolarHBondContact O-ND2 3.34Å; I141-N151 WeakPolarHBondContact CG2-ND2 3.49Å |
| 152 | I | 98.2 | Very high | 94.5 | Very high | 34 Ų | 34 | 72.3 Ų | 72.3 | 17% | 0.174 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.8 | 133.2 | 178.9 | -175.2 | 170.1 | 0 | 0 | 0 | 109.4 | E122 H123 P140 V142 | E122-I152 HydrophobicContact CG-CD1 3.58Å; E122-I152 HydrophobicContact CG-CG1 3.71Å; H123-I152 WeakPolarHBondContact O-CA 3.07Å; P140-I152 HydrophobicContact CB-CG2 3.84Å; P140-I152 PolarHBondContact O-N 3.01Å; V142-I152 HydrophobicContact CB-CB 4.36Å; V142-I152 HydrophobicContact CB-CD1 4.3Å; V142-I152 HydrophobicContact CB-CG2 4.41Å; V142-I152 HydrophobicContact CG1-CB 4.09Å; V142-I152 HydrophobicContact CG1-CD1 4.36Å |
| 153 | I | 98 | Very high | 94.2 | Very high | 43 Ų | 43 | 78.4 Ų | 78.4 | 22% | 0.221 | 41% | 0.413 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.9 | 136.7 | 174.6 | -173.7 | 164.1 | 0 | 0 | 0 | 109.5 | T80 F82 H123 Y125 | T80-I153 HydrophobicContact CG2-CD1 3.54Å; F82-I153 HydrophobicContact CE1-CG2 4.24Å; F82-I153 HydrophobicContact CZ-CG2 4.22Å; H123-I153 HydrophobicContact CB-CG2 3.91Å; H123-I153 PolarHBondContact N-O 2.91Å; H123-I153 PolarHBondContact O-N 2.98Å; Y125-I153 HydrophobicContact CD1-CG2 4.11Å; Y125-I153 HydrophobicContact CE1-CB 4.03Å; Y125-I153 HydrophobicContact CE1-CG2 4.03Å |
| 154 | Q | 97.4 | Very high | 94.1 | Very high | 89 Ų | 89 | 77.3 Ų | 77.3 | 42% | 0.416 | 40% | 0.404 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.9 | 106.8 | 173.8 | -176 | 66.2 | 38.6 | 0 | 0 | 108.7 | G121 K156 | G121-Q154 VanDerWaalsContact C-NE2 3.27Å; G121-Q154 PolarHBondContact O-NE2 2.81Å; Q154-K156 HydrophobicContact CG-CD 4.43Å; Q154-K156 HydrophobicContact CG-CG 3.84Å; Q154-K156 PolarHBondContact O-N 2.91Å |
| 155 | V | 96.8 | Very high | 94.2 | Very high | 4 Ų | 4 | 75.5 Ų | 75.5 | 2% | 0.024 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.7 | 114.8 | 174.9 | 179.6 | 0 | 0 | 0 | 0 | 107.4 | R78 T80 L118 E120 G121 F160 | R78-V155 HydrophobicContact CB-CG1 4.2Å; T80-V155 HydrophobicContact CG2-CG2 4.42Å; L118-V155 HydrophobicContact CB-CG2 4.11Å; L118-V155 HydrophobicContact CD1-CG2 4.22Å; E120-V155 VanDerWaalsContact CG-O 3.24Å; E120-V155 WeakPolarHBondContact CG-O 3.34Å; G121-V155 PolarHBondContact N-O 3.05Å; G121-V155 VanDerWaalsContact N-O 3.12Å; G121-V155 PolarHBondContact O-N 3.02Å; V155-F160 HydrophobicContact CG1-CE2 3.65Å; V155-F160 HydrophobicContact CG1-CZ 3.85Å |
| 156 | K | 94.5 | Very high | 94.2 | Very high | 107 Ų | 107 | 70.9 Ų | 70.9 | 47% | 0.465 | 37% | 0.374 | S | S | . | . | trans | -114.4 | 158.6 | 179.7 | -58.5 | 178.7 | -179.1 | 176.1 | 0 | 111.2 | R78 Q154 T158 D159 F160 | R78-K156 PolarHBondContact NH1-O 3.31Å; Q154-K156 HydrophobicContact CG-CD 4.43Å; Q154-K156 HydrophobicContact CG-CG 3.84Å; Q154-K156 PolarHBondContact O-N 2.91Å; K156-T158 VanDerWaalsContact C-N 3.34Å; K156-T158 PolarHBondContact O-N 2.75Å; K156-D159 WeakPolarHBondContact CB-OD2 3.23Å; K156-D159 PolarHBondContact N-OD2 2.68Å; K156-D159 PolarHBondContact O-N 2.8Å; K156-F160 WeakPolarHBondContact O-CD2 3.12Å; K156-F160 WeakPolarHBondContact O-CE2 3.37Å | ||
| 157 | K | 91.9 | Very high | 94.1 | Very high | 123 Ų | 123 | 68 Ų | 68 | 54% | 0.535 | 36% | 0.357 | S | S | . | . | G | 310 helix | trans | -63.6 | -40.3 | 177.7 | -172.2 | 179.1 | 175.2 | -174.7 | 0 | 112.9 | D159 F160 | K157-D159 PolarHBondContact O-N 3.16Å; K157-D159 VanDerWaalsContact O-N 3.12Å; K157-F160 PolarHBondContact O-N 3.12Å; K157-F160 VanDerWaalsContact O-N 3.16Å |
| 158 | T | 92.4 | Very high | 93.8 | Very high | 52 Ų | 52 | 67.2 Ų | 67.2 | 32% | 0.319 | 34% | 0.342 | S | S | . | . | G | 310 helix | trans | -61.1 | -21.2 | -177.3 | 51.5 | 0 | 0 | 0 | 0 | 113.9 | K156 F160 D164 A165 | K156-T158 VanDerWaalsContact C-N 3.34Å; K156-T158 PolarHBondContact O-N 2.75Å; T158-F160 VanDerWaalsContact C-N 3.25Å; T158-F160 PolarHBondContact O-N 3Å; T158-D164 HydrophobicContact CG2-CB 4.46Å; T158-A165 PolarHBondContact O-N 3.07Å |
| 159 | D | 93.3 | Very high | 93.6 | Very high | 74 Ų | 74 | 68.2 Ų | 68.2 | 40% | 0.396 | 35% | 0.345 | S | S | . | . | G | 310 helix | trans | -77.8 | -13.7 | -177.9 | -54.3 | -32.8 | 0 | 0 | 0 | 112.3 | K156 K157 | K156-D159 WeakPolarHBondContact CB-OD2 3.23Å; K156-D159 PolarHBondContact N-OD2 2.68Å; K156-D159 PolarHBondContact O-N 2.8Å; K157-D159 PolarHBondContact O-N 3.16Å; K157-D159 VanDerWaalsContact O-N 3.12Å |
| 160 | F | 92.6 | Very high | 93 | Very high | 69 Ų | 69 | 68.7 Ų | 68.7 | 30% | 0.303 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108.3 | -16.9 | -176.2 | -58.6 | -85 | 0 | 0 | 0 | 113.2 | R78 P79 V155 K156 K157 T158 | R78-F160 HydrophobicContact CB-CD1 3.97Å; R78-F160 HydrophobicContact CB-CD2 4.13Å; R78-F160 HydrophobicContact CB-CE1 3.53Å; R78-F160 HydrophobicContact CB-CE2 3.72Å; R78-F160 HydrophobicContact CB-CG 4.25Å; R78-F160 HydrophobicContact CB-CZ 3.41Å; R78-F160 VanDerWaalsContact CB-CZ 3.41Å; R78-F160 VanDerWaalsContact CD-CD2 3.49Å; R78-F160 HydrophobicContact CG-CD2 4.28Å; R78-F160 HydrophobicContact CG-CE2 4.23Å; R78-F160 HydrophobicContact CG-CG 4.46Å; R78-F160 HydrophobicContact CG-CZ 4.38Å; P79-F160 WeakPolarHBondContact O-CE1 2.88Å; V155-F160 HydrophobicContact CG1-CE2 3.65Å; V155-F160 HydrophobicContact CG1-CZ 3.85Å; K156-F160 WeakPolarHBondContact O-CD2 3.12Å; K156-F160 WeakPolarHBondContact O-CE2 3.37Å; K157-F160 PolarHBondContact O-N 3.12Å; K157-F160 VanDerWaalsContact O-N 3.16Å; T158-F160 VanDerWaalsContact C-N 3.25Å; T158-F160 PolarHBondContact O-N 3Å |
| 161 | E | 91.5 | Very high | 92.1 | Very high | 98 Ų | 98 | 75 Ų | 75 | 46% | 0.458 | 38% | 0.379 | S | S | . | . | S | Bend | trans | -85.6 | 110.4 | 170.2 | -64 | -60.2 | 158.1 | 0 | 0 | 108.4 | F163 D164 A165 | E161-F163 VanDerWaalsContact C-N 3.27Å; E161-F163 PolarHBondContact O-N 3.25Å; E161-F163 VanDerWaalsContact O-N 3.15Å; E161-D164 HydrophobicContact CB-CB 3.91Å; E161-D164 PolarHBondContact O-N 2.92Å; E161-A165 PolarHBondContact O-N 2.9Å |
| 162 | V | 91.8 | Very high | 91.1 | Very high | 99 Ų | 99 | 82.1 Ų | 82.1 | 60% | 0.6 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -52.6 | -43.9 | -169.7 | 176.4 | 0 | 0 | 0 | 0 | 112.5 | L166 | V162-L166 HydrophobicContact CG1-CD1 4.1Å; V162-L166 WeakPolarHBondContact O-CB 3.45Å; V162-L166 VanDerWaalsContact O-CG 3.25Å; V162-L166 WeakPolarHBondContact O-CG 3.42Å; V162-L166 PolarHBondContact O-N 2.99Å |
| 163 | F | 91.8 | Very high | 89.5 | Confident | 172 Ų | 172 | 84 Ų | 84 | 75% | 0.754 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -72.9 | -34 | -179.4 | -63.6 | -62.1 | 0 | 0 | 0 | 113 | E161 M167 | E161-F163 VanDerWaalsContact C-N 3.27Å; E161-F163 PolarHBondContact O-N 3.25Å; E161-F163 VanDerWaalsContact O-N 3.15Å; F163-M167 VanDerWaalsContact O-CB 3.28Å; F163-M167 WeakPolarHBondContact O-CB 3.34Å; F163-M167 PolarHBondContact O-N 3.15Å |
| 164 | D | 92.7 | Very high | 87.6 | Confident | 62 Ų | 62 | 87.1 Ų | 87.1 | 33% | 0.332 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -70.2 | -42.2 | 176.5 | -68.1 | -18.3 | 0 | 0 | 0 | 110.6 | T158 E161 M167 V168 | T158-D164 HydrophobicContact CG2-CB 4.46Å; E161-D164 HydrophobicContact CB-CB 3.91Å; E161-D164 PolarHBondContact O-N 2.92Å; D164-M167 PolarHBondContact O-N 3.43Å; D164-V168 WeakPolarHBondContact O-CG2 3.48Å; D164-V168 PolarHBondContact O-N 3.11Å |
| 165 | A | 93 | Very high | 85.7 | Confident | 22 Ų | 22 | 89.5 Ų | 89.5 | 18% | 0.182 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -58.3 | -49.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | T158 E161 M167 V168 D169 | T158-A165 PolarHBondContact O-N 3.07Å; E161-A165 PolarHBondContact O-N 2.9Å; A165-M167 VanDerWaalsContact C-N 3.33Å; A165-M167 PolarHBondContact O-N 3.18Å; A165-V168 PolarHBondContact O-N 3.27Å; A165-D169 WeakPolarHBondContact O-CB 3.47Å; A165-D169 PolarHBondContact O-N 3.21Å |
| 166 | L | 91.1 | Very high | 83.7 | Confident | 106 Ų | 106 | 91.5 Ų | 91.5 | 56% | 0.555 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -61.6 | -39.3 | 176.4 | -72.1 | 173 | 0 | 0 | 0 | 112.6 | V162 S170 | V162-L166 HydrophobicContact CG1-CD1 4.1Å; V162-L166 WeakPolarHBondContact O-CB 3.45Å; V162-L166 VanDerWaalsContact O-CG 3.25Å; V162-L166 WeakPolarHBondContact O-CG 3.42Å; V162-L166 PolarHBondContact O-N 2.99Å; L166-S170 WeakPolarHBondContact O-CB 3.3Å; L166-S170 PolarHBondContact O-N 3.49Å |
| 167 | M | 89.1 | Confident | 81.6 | Confident | 98 Ų | 98 | 91.5 Ų | 91.5 | 48% | 0.483 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.1 | -46.8 | 177.2 | 179.4 | 177.4 | 59 | 0 | 0 | 111.3 | F163 D164 A165 D169 S170 Q171 | F163-M167 VanDerWaalsContact O-CB 3.28Å; F163-M167 WeakPolarHBondContact O-CB 3.34Å; F163-M167 PolarHBondContact O-N 3.15Å; D164-M167 PolarHBondContact O-N 3.43Å; A165-M167 VanDerWaalsContact C-N 3.33Å; A165-M167 PolarHBondContact O-N 3.18Å; M167-D169 VanDerWaalsContact C-N 3.35Å; M167-S170 PolarHBondContact O-N 3.49Å; M167-S170 PolarHBondContact O-OG 3.27Å; M167-Q171 PolarHBondContact O-N 3.36Å |
| 168 | V | 87.9 | Confident | 79.7 | Confident | 39 Ų | 39 | 89.4 Ų | 89.4 | 24% | 0.236 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -64.6 | -40.4 | 178.7 | 171.7 | 0 | 0 | 0 | 0 | 111.2 | D164 A165 S170 Q171 K172 | D164-V168 WeakPolarHBondContact O-CG2 3.48Å; D164-V168 PolarHBondContact O-N 3.11Å; A165-V168 PolarHBondContact O-N 3.27Å; V168-S170 VanDerWaalsContact C-N 3.35Å; V168-Q171 PolarHBondContact O-N 3.05Å; V168-K172 HydrophobicContact CG1-CD 4.38Å; V168-K172 PolarHBondContact O-N 3.25Å; V168-K172 VanDerWaalsContact O-N 3.17Å |
| 169 | D | 87.7 | Confident | 77.8 | Confident | 87 Ų | 87 | 92 Ų | 92 | 47% | 0.465 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.8 | -37.5 | 178.8 | -75 | -11.4 | 0 | 0 | 0 | 112.1 | A165 M167 Q171 K172 C173 | A165-D169 WeakPolarHBondContact O-CB 3.47Å; A165-D169 PolarHBondContact O-N 3.21Å; M167-D169 VanDerWaalsContact C-N 3.35Å; D169-Q171 VanDerWaalsContact C-N 3.25Å; D169-Q171 PolarHBondContact O-N 3.48Å; D169-K172 PolarHBondContact O-N 3.26Å; D169-C173 PolarHBondContact O-N 3.39Å |
| 170 | S | 84.3 | Confident | 75.7 | Confident | 50 Ų | 50 | 91.8 Ų | 91.8 | 35% | 0.35 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.5 | -37.8 | 173.4 | 77.7 | 0 | 0 | 0 | 0 | 111.7 | L166 M167 V168 C173 V176 | L166-S170 WeakPolarHBondContact O-CB 3.3Å; L166-S170 PolarHBondContact O-N 3.49Å; M167-S170 PolarHBondContact O-N 3.49Å; M167-S170 PolarHBondContact O-OG 3.27Å; V168-S170 VanDerWaalsContact C-N 3.35Å; S170-C173 VanDerWaalsContact O-O 3.11Å; S170-V176 WeakPolarHBondContact O-CG2 3.28Å |
| 171 | Q | 80.2 | Confident | 74 | Confident | 146 Ų | 146 | 92.5 Ų | 92.5 | 68% | 0.682 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -74.6 | -32.1 | 179.8 | -66.8 | 176 | 5.6 | 0 | 0 | 113.3 | M167 V168 D169 | M167-Q171 PolarHBondContact O-N 3.36Å; V168-Q171 PolarHBondContact O-N 3.05Å; D169-Q171 VanDerWaalsContact C-N 3.25Å; D169-Q171 PolarHBondContact O-N 3.48Å |
| 172 | K | 77.1 | Confident | 72.6 | Confident | 150 Ų | 150 | 93.4 Ų | 93.4 | 65% | 0.652 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -73.5 | -35.5 | 178 | -71.1 | 176 | -173.6 | 162.9 | 0 | 112.2 | V168 D169 S174 | V168-K172 HydrophobicContact CG1-CD 4.38Å; V168-K172 PolarHBondContact O-N 3.25Å; V168-K172 VanDerWaalsContact O-N 3.17Å; D169-K172 PolarHBondContact O-N 3.26Å; K172-S174 VanDerWaalsContact C-N 3.33Å; K172-S174 PolarHBondContact O-N 3.25Å |
| 173 | C | 65.6 | Low | 71.3 | Confident | 74 Ų | 74 | 92.7 Ų | 92.7 | 50% | 0.5 | 53% | 0.528 | S | S | . | . | trans | -75.7 | 87.6 | 169.6 | -76.4 | 0 | 0 | 0 | 0 | 108.6 | D169 S170 D175 V176 | D169-C173 PolarHBondContact O-N 3.39Å; S170-C173 VanDerWaalsContact O-O 3.11Å; C173-D175 PolarHBondContact O-N 3.24Å; C173-V176 HydrophobicContact CB-CG1 4Å; C173-V176 WeakPolarHBondContact O-CG2 3.35Å; C173-V176 PolarHBondContact O-N 3.22Å | ||
| 174 | S | 57.9 | Low | 69.7 | Low | 108 Ų | 108 | 89.1 Ų | 89.1 | 76% | 0.755 | 52% | 0.522 | S | S | * | . | G | 310 helix | trans | -55.2 | -9.1 | 176 | 56 | 0 | 0 | 0 | 0 | 114.3 | K172 | K172-S174 VanDerWaalsContact C-N 3.33Å; K172-S174 PolarHBondContact O-N 3.25Å |
| 175 | D | 55.8 | Low | 68.1 | Low | 139 Ų | 139 | 87.1 Ų | 87.1 | 74% | 0.743 | 52% | 0.516 | S | S | * | . | G | 310 helix | trans | -83.1 | -3.7 | 177.7 | -141 | 9.1 | 0 | 0 | 0 | 114.4 | C173 | C173-D175 PolarHBondContact O-N 3.24Š|
| 176 | V | 55.3 | Low | 66.5 | Low | 46 Ų | 46 | 89.4 Ų | 89.4 | 28% | 0.279 | 53% | 0.529 | S | S | . | . | G | 310 helix | trans | -99.4 | 3.4 | 180 | -48.4 | 0 | 0 | 0 | 0 | 114.5 | S170 C173 E178 L179 | S170-V176 WeakPolarHBondContact O-CG2 3.28Å; C173-V176 HydrophobicContact CB-CG1 4Å; C173-V176 WeakPolarHBondContact O-CG2 3.35Å; C173-V176 PolarHBondContact O-N 3.22Å; V176-E178 PolarHBondContact O-N 3.32Å; V176-L179 HydrophobicContact CB-CB 4.48Å; V176-L179 HydrophobicContact CB-CD1 3.91Å; V176-L179 HydrophobicContact CB-CG 4.2Å; V176-L179 HydrophobicContact CG1-CD1 3.89Å; V176-L179 PolarHBondContact O-N 3.32Å |
| 177 | S | 51.3 | Low | 65.1 | Low | 107 Ų | 107 | 90.5 Ų | 90.5 | 75% | 0.748 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.1 | -13.7 | 170.1 | -72.1 | 0 | 0 | 0 | 0 | 112.4 | ||
| 178 | E | 50.5 | Low | 64.1 | Low | 80 Ų | 80 | 92 Ų | 92 | 37% | 0.374 | 53% | 0.532 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.5 | 4.6 | 172.9 | -58.3 | -162.5 | 169.1 | 0 | 0 | 114.4 | V176 G185 P186 | V176-E178 PolarHBondContact O-N 3.32Å; E178-G185 CarbonylContact C-O 3.55Å; E178-G185 CarbonylContact O-C 3.32Å; E178-G185 VanDerWaalsContact O-CA 3.3Å; E178-G185 WeakPolarHBondContact O-CA 3.25Å; E178-G185 PolarHBondContact O-N 3.22Å; E178-P186 HydrophobicContact CB-CB 4.38Å; E178-P186 VanDerWaalsContact CD-CB 3.45Å; E178-P186 HydrophobicContact CG-CB 3.82Å; E178-P186 HydrophobicContact CG-CG 4.43Å; E178-P186 WeakPolarHBondContact OE1-CB 3.47Å; E178-P186 VanDerWaalsContact OE2-CD 3.27Å; E178-P186 WeakPolarHBondContact OE2-CD 3.5Å; E178-P186 WeakPolarHBondContact OE2-CG 3.43Å |
| 179 | L | 52.7 | Low | 63.5 | Low | 105 Ų | 105 | 99.8 Ų | 99.8 | 55% | 0.55 | 57% | 0.566 | S | S | . | * | trans | -104.5 | 29.5 | -178.4 | -54.9 | -178.2 | 0 | 0 | 0 | 112.9 | V176 S181 P184 | V176-L179 HydrophobicContact CB-CB 4.48Å; V176-L179 HydrophobicContact CB-CD1 3.91Å; V176-L179 HydrophobicContact CB-CG 4.2Å; V176-L179 HydrophobicContact CG1-CD1 3.89Å; V176-L179 PolarHBondContact O-N 3.32Å; L179-S181 PolarHBondContact O-N 3.2Å; L179-S181 VanDerWaalsContact O-N 3.11Å; L179-P184 HydrophobicContact CD2-CB 3.71Å | ||
| 180 | S | 50.5 | Low | 62.9 | Low | 71 Ų | 71 | 103 Ų | 103 | 50% | 0.497 | 58% | 0.578 | S | S | . | * | S | Bend | trans | -76.5 | 97.1 | 175.9 | -167.3 | 0 | 0 | 0 | 0 | 111.2 | Y187 | S180-Y187 WeakPolarHBondContact O-CD2 2.99Å; S180-Y187 WeakPolarHBondContact O-CE2 3.18Å |
| 181 | S | 57.3 | Low | 62.5 | Low | 84 Ų | 84 | 105.4 Ų | 105.4 | 59% | 0.587 | 59% | 0.593 | S | S | * | * | S | Bend | trans | 60.3 | 134.6 | 168.7 | 69.1 | 0 | 0 | 0 | 0 | 117.1 | L179 P183 Y187 | L179-S181 PolarHBondContact O-N 3.2Å; L179-S181 VanDerWaalsContact O-N 3.11Å; S181-P183 CarbonylContact O-C 3.56Å; S181-P183 VanDerWaalsContact O-C 3.32Å; S181-Y187 WeakPolarHBondContact O-CE2 3.39Å; S181-Y187 PolarHBondContact O-OH 3.45Å |
| 182 | S | 61 | Low | 62.2 | Low | 116 Ų | 116 | 106.8 Ų | 106.8 | 81% | 0.811 | 59% | 0.593 | S | S | * | * | S | Bend | trans | -47.2 | 124.6 | -176.6 | -175.5 | 0 | 0 | 0 | 0 | 113 | ||
| 183 | P | 64.3 | Low | 62 | Low | 84 Ų | 84 | 104.8 Ų | 104.8 | 55% | 0.545 | 59% | 0.593 | S | S | . | * | S | Bend | cis | -81.6 | 143.3 | 5.6 | -8.6 | 26.3 | 0 | 0 | 0 | 112.7 | S181 G185 Y187 | S181-P183 CarbonylContact O-C 3.56Å; S181-P183 VanDerWaalsContact O-C 3.32Å; P183-G185 PolarHBondContact O-N 3.47Å; P183-Y187 VanDerWaalsContact CD-OH 3.31Å; P183-Y187 WeakPolarHBondContact CD-OH 3.31Å; P183-Y187 WeakPolarHBondContact O-CE2 3.43Å |
| 184 | P | 57.8 | Low | 62.2 | Low | 97 Ų | 97 | 104.9 Ų | 104.9 | 63% | 0.63 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 126.1 | 164.4 | -24.9 | 35.3 | 0 | 0 | 0 | 111.2 | L179 | L179-P184 HydrophobicContact CD2-CB 3.71Š|
| 185 | G | 60.2 | Low | 62.7 | Low | 21 Ų | 21 | 106.1 Ų | 106.1 | 22% | 0.216 | 59% | 0.585 | C | S | . | * | S | Bend | trans | 164.6 | 159.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | E178 P183 Y187 | E178-G185 CarbonylContact C-O 3.55Å; E178-G185 CarbonylContact O-C 3.32Å; E178-G185 VanDerWaalsContact O-CA 3.3Å; E178-G185 WeakPolarHBondContact O-CA 3.25Å; E178-G185 PolarHBondContact O-N 3.22Å; P183-G185 PolarHBondContact O-N 3.47Å; G185-Y187 WeakPolarHBondContact O-CD2 3.17Å; G185-Y187 PolarHBondContact O-N 3.1Å |
| 186 | P | 58.1 | Low | 63.2 | Low | 69 Ų | 69 | 103.8 Ų | 103.8 | 45% | 0.448 | 58% | 0.578 | S | S | . | * | trans | -61.2 | 105.5 | -178.2 | 13.2 | -18.8 | 0 | 0 | 0 | 111.3 | E178 H188 | E178-P186 HydrophobicContact CB-CB 4.38Å; E178-P186 VanDerWaalsContact CD-CB 3.45Å; E178-P186 HydrophobicContact CG-CB 3.82Å; E178-P186 HydrophobicContact CG-CG 4.43Å; E178-P186 WeakPolarHBondContact OE1-CB 3.47Å; E178-P186 VanDerWaalsContact OE2-CD 3.27Å; E178-P186 WeakPolarHBondContact OE2-CD 3.5Å; E178-P186 WeakPolarHBondContact OE2-CG 3.43Å; P186-H188 WeakPolarHBondContact CB-NE2 3.32Å; P186-H188 PolarHBondContact O-N 3.48Å | ||
| 187 | Y | 61.8 | Low | 63.7 | Low | 129 Ų | 129 | 109.8 Ų | 109.8 | 51% | 0.506 | 60% | 0.603 | S | S | . | * | trans | -86.9 | 91.1 | 164.2 | -74.8 | -91.3 | 0 | 0 | 0 | 107.8 | S180 S181 P183 G185 | S180-Y187 WeakPolarHBondContact O-CD2 2.99Å; S180-Y187 WeakPolarHBondContact O-CE2 3.18Å; S181-Y187 WeakPolarHBondContact O-CE2 3.39Å; S181-Y187 PolarHBondContact O-OH 3.45Å; P183-Y187 VanDerWaalsContact CD-OH 3.31Å; P183-Y187 WeakPolarHBondContact CD-OH 3.31Å; P183-Y187 WeakPolarHBondContact O-CE2 3.43Å; G185-Y187 WeakPolarHBondContact O-CD2 3.17Å; G185-Y187 PolarHBondContact O-N 3.1Å | ||
| 188 | H | 69.3 | Low | 64.2 | Low | 131 Ų | 131 | 110.1 Ų | 110.1 | 61% | 0.606 | 59% | 0.593 | S | S | * | * | trans | -93 | 142.7 | 171.9 | -58.1 | -44.8 | 0 | 0 | 0 | 110.4 | P186 E190 | P186-H188 WeakPolarHBondContact CB-NE2 3.32Å; P186-H188 PolarHBondContact O-N 3.48Å; H188-E190 VanDerWaalsContact C-N 3.3Å; H188-E190 HydrophobicContact CB-CB 4.47Å | ||
| 189 | Q | 76 | Confident | 64.6 | Low | 202 Ų | 202 | 115.4 Ų | 115.4 | 94% | 0.944 | 61% | 0.609 | S | S | * | * | trans | -90.7 | -0.3 | 171.1 | -65.4 | -178.3 | -15.7 | 0 | 0 | 112.2 | ||||
| 190 | E | 74 | Confident | 65.3 | Low | 154 Ų | 154 | 119.2 Ų | 119.2 | 72% | 0.72 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -62.7 | 143.7 | 176.8 | -71.9 | -65.1 | 156.7 | 0 | 0 | 110.5 | H188 Y192 | H188-E190 VanDerWaalsContact C-N 3.3Å; H188-E190 HydrophobicContact CB-CB 4.47Å; E190-Y192 PolarHBondContact O-N 3.31Å |
| 191 | P | 76.5 | Confident | 66.7 | Low | 101 Ų | 101 | 127 Ų | 127 | 66% | 0.656 | 64% | 0.64 | S | S | * | * | trans | -49.3 | 134 | 173.4 | -25.8 | 34.2 | 0 | 0 | 0 | 110.7 | V193 | P191-V193 PolarHBondContact O-N 2.92Š| ||
| 192 | Y | 73.1 | Confident | 68.1 | Low | 175 Ų | 175 | 127.2 Ų | 127.2 | 69% | 0.686 | 65% | 0.647 | S | S | * | * | trans | -57.8 | 111.3 | -179.6 | 178.5 | -101.7 | 0 | 0 | 0 | 110.6 | E190 C194 | E190-Y192 PolarHBondContact O-N 3.31Å; Y192-C194 HydrophobicContact CD1-CB 4.47Å; Y192-C194 HydrophobicContact CE1-CB 3.66Å; Y192-C194 PolarHBondContact OH-SG 3.27Å | ||
| 193 | V | 73.5 | Confident | 69.4 | Low | 108 Ų | 108 | 127.1 Ų | 127.1 | 66% | 0.655 | 64% | 0.644 | S | S | * | * | trans | -103.1 | 110 | 170.4 | -177.5 | 0 | 0 | 0 | 0 | 107.4 | P191 K195 | P191-V193 PolarHBondContact O-N 2.92Å; V193-K195 PolarHBondContact O-N 3.07Å | ||
| 194 | C | 68.7 | Low | 70.8 | Confident | 76 Ų | 76 | 129.1 Ų | 129.1 | 51% | 0.514 | 66% | 0.657 | S | S | . | * | trans | -65.8 | 100.9 | -179.6 | -155.7 | 0 | 0 | 0 | 0 | 109.9 | Y192 | Y192-C194 HydrophobicContact CD1-CB 4.47Å; Y192-C194 HydrophobicContact CE1-CB 3.66Å; Y192-C194 PolarHBondContact OH-SG 3.27Å | ||
| 195 | K | 68.2 | Low | 72.7 | Confident | 133 Ų | 133 | 132.2 Ų | 132.2 | 58% | 0.578 | 67% | 0.666 | S | S | * | * | trans | -79.8 | 133.2 | 178.2 | -68.7 | 179.2 | -176.4 | 171.8 | 0 | 109.6 | V193 E197 E198 | V193-K195 PolarHBondContact O-N 3.07Å; K195-E197 PolarHBondContact O-N 3.19Å; K195-E197 VanDerWaalsContact O-N 3.15Å; K195-E198 PolarHBondContact O-N 3.32Å | ||
| 196 | P | 66.9 | Low | 74.4 | Confident | 91 Ų | 91 | 136 Ų | 136 | 59% | 0.591 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -62.4 | -21.4 | -180 | 21.6 | -30.5 | 0 | 0 | 0 | 113.8 | E198 R199 | P196-E198 PolarHBondContact O-N 3.12Å; P196-R199 WeakPolarHBondContact O-CB 3.26Å; P196-R199 WeakPolarHBondContact O-CG 3.48Å; P196-R199 PolarHBondContact O-N 3.36Å |
| 197 | E | 65.1 | Low | 76.2 | Confident | 171 Ų | 171 | 135.9 Ų | 135.9 | 80% | 0.799 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -74.7 | -20.1 | -177.9 | -57.4 | -156.4 | 166.3 | 0 | 0 | 114.5 | K195 R199 | K195-E197 PolarHBondContact O-N 3.19Å; K195-E197 VanDerWaalsContact O-N 3.15Å; E197-R199 PolarHBondContact O-N 3.16Å |
| 198 | E | 62.4 | Low | 77.9 | Confident | 114 Ų | 114 | 134 Ų | 134 | 53% | 0.533 | 68% | 0.684 | S | S | . | * | G | 310 helix | trans | -72.5 | -11.8 | 177.1 | -72 | 172.8 | -171.6 | 0 | 0 | 112.8 | K195 P196 F200 | K195-E198 PolarHBondContact O-N 3.32Å; P196-E198 PolarHBondContact O-N 3.12Å; E198-F200 PolarHBondContact O-N 3.46Å; E198-F200 VanDerWaalsContact O-N 3.15Å |
| 199 | R | 60.2 | Low | 79.2 | Confident | 191 Ų | 191 | 132 Ų | 132 | 72% | 0.721 | 68% | 0.675 | S | S | * | * | G | 310 helix | trans | -72.1 | -7 | -170.9 | -66.9 | -172.2 | -175.1 | -179.1 | 3.8 | 115.4 | P196 E197 | P196-R199 WeakPolarHBondContact O-CB 3.26Å; P196-R199 WeakPolarHBondContact O-CG 3.48Å; P196-R199 PolarHBondContact O-N 3.36Å; E197-R199 PolarHBondContact O-N 3.16Å |
| 200 | F | 66.3 | Low | 80.2 | Confident | 185 Ų | 185 | 123.9 Ų | 123.9 | 81% | 0.811 | 64% | 0.638 | S | S | * | * | G | 310 helix | trans | -98.7 | 3.9 | -171.6 | -64.2 | -72.3 | 0 | 0 | 0 | 115.3 | E198 | E198-F200 PolarHBondContact O-N 3.46Å; E198-F200 VanDerWaalsContact O-N 3.15Å |
| 201 | R | 79.2 | Confident | 81.2 | Confident | 235 Ų | 235 | 122.3 Ų | 122.3 | 89% | 0.887 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -93.2 | 120.9 | 175.1 | -63.1 | -168.4 | -176.6 | -145.4 | 3.3 | 110.1 | ||
| 202 | A | 86.7 | Confident | 82 | Confident | 88 Ų | 88 | 122.5 Ų | 122.5 | 73% | 0.727 | 63% | 0.625 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 142.1 | 168.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||
| 203 | P | 90.2 | Very high | 83 | Confident | 115 Ų | 115 | 115.5 Ų | 115.5 | 75% | 0.747 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 143.7 | 173.4 | -24.4 | 33.8 | 0 | 0 | 0 | 111.2 | ||
| 204 | P | 93 | Very high | 84 | Confident | 126 Ų | 126 | 110.6 Ų | 110.6 | 82% | 0.818 | 57% | 0.571 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 142.5 | 177 | 26.3 | -33.5 | 0 | 0 | 0 | 110.7 | L206 | P204-L206 PolarHBondContact O-N 3.19Š|
| 205 | I | 96.6 | Very high | 85.3 | Confident | 161 Ų | 161 | 110.1 Ų | 110.1 | 83% | 0.826 | 56% | 0.563 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 134.8 | 175.7 | -60 | 172.6 | 0 | 0 | 0 | 108.7 | P207 | I205-P207 WeakPolarHBondContact O-CD 3.49Š|
| 206 | L | 96.4 | Very high | 86.6 | Confident | 101 Ų | 101 | 109.4 Ų | 109.4 | 53% | 0.529 | 57% | 0.565 | S | S | . | * | P | Polyproline II helix | trans | -58.1 | 121.5 | 179.3 | 179.3 | 66.7 | 0 | 0 | 0 | 110.8 | P204 L210 L211 | P204-L206 PolarHBondContact O-N 3.19Å; L206-L210 HydrophobicContact CD1-CB 4.35Å; L206-L210 HydrophobicContact CD1-CD1 3.95Å; L206-L211 HydrophobicContact CD2-CD2 3.66Å; L206-L211 HydrophobicContact CD2-CG 4.21Å |
| 207 | P | 97.2 | Very high | 87.8 | Confident | 67 Ų | 67 | 109.6 Ų | 109.6 | 44% | 0.435 | 56% | 0.557 | S | S | . | * | P | Polyproline II helix | trans | -61.1 | 128.2 | 175.4 | -25 | 35.4 | 0 | 0 | 0 | 110.9 | I205 H209 L210 | I205-P207 WeakPolarHBondContact O-CD 3.49Å; P207-H209 PolarHBondContact O-N 2.78Å; P207-L210 PolarHBondContact O-N 2.69Å; P207-L210 VanDerWaalsContact O-N 3.07Å |
| 208 | P | 97.2 | Very high | 89.2 | Confident | 89 Ų | 89 | 109.4 Ų | 109.4 | 58% | 0.578 | 56% | 0.561 | S | S | * | * | G | 310 helix | trans | -62.8 | -20.5 | -175.2 | 24.5 | -34.7 | 0 | 0 | 0 | 113.2 | L210 L211 | P208-L210 PolarHBondContact O-N 3.02Å; P208-L211 WeakPolarHBondContact O-CB 3.32Å; P208-L211 PolarHBondContact O-N 3.5Å; P208-L211 VanDerWaalsContact O-N 3.16Å |
| 209 | H | 96.3 | Very high | 90.6 | Very high | 89 Ų | 89 | 106.6 Ų | 106.6 | 41% | 0.412 | 55% | 0.552 | S | S | . | * | G | 310 helix | trans | -57.6 | -34.6 | 174.6 | -58.8 | 93.3 | 0 | 0 | 0 | 113.1 | P207 L211 Q212 V234 | P207-H209 PolarHBondContact O-N 2.78Å; H209-L211 PolarHBondContact O-N 3.37Å; H209-Q212 PolarHBondContact O-N 2.97Å; H209-V234 HydrophobicContact CB-CG2 3.6Å |
| 210 | L | 96.2 | Very high | 92 | Very high | 32 Ų | 32 | 99.8 Ų | 99.8 | 17% | 0.168 | 54% | 0.541 | C | S | . | . | G | 310 helix | trans | -72.8 | -16.9 | -178.4 | -61.3 | -176.2 | 0 | 0 | 0 | 112.8 | L206 P207 P208 Q212 M235 H238 Y240 | L206-L210 HydrophobicContact CD1-CB 4.35Å; L206-L210 HydrophobicContact CD1-CD1 3.95Å; P207-L210 PolarHBondContact O-N 2.69Å; P207-L210 VanDerWaalsContact O-N 3.07Å; P208-L210 PolarHBondContact O-N 3.02Å; L210-Q212 VanDerWaalsContact C-N 3.29Å; L210-M235 HydrophobicContact CD2-CB 4.45Å; L210-H238 HydrophobicContact CD2-CB 4.44Å; L210-Y240 VanDerWaalsContact O-CE1 3.32Å; L210-Y240 WeakPolarHBondContact O-CE1 3.48Å; L210-Y240 PolarHBondContact O-OH 3.42Å |
| 211 | L | 95.8 | Very high | 93.3 | Very high | 120 Ų | 120 | 99.8 Ų | 99.8 | 63% | 0.628 | 55% | 0.548 | S | S | * | . | G | 310 helix | trans | -77.7 | -14.8 | 176.6 | -59.2 | 175.4 | 0 | 0 | 0 | 112.6 | L206 P208 H209 V213 | L206-L211 HydrophobicContact CD2-CD2 3.66Å; L206-L211 HydrophobicContact CD2-CG 4.21Å; P208-L211 WeakPolarHBondContact O-CB 3.32Å; P208-L211 PolarHBondContact O-N 3.5Å; P208-L211 VanDerWaalsContact O-N 3.16Å; H209-L211 PolarHBondContact O-N 3.37Å; L211-V213 VanDerWaalsContact C-N 3.32Å; L211-V213 PolarHBondContact O-N 3.07Å |
| 212 | Q | 93 | Very high | 94 | Very high | 105 Ų | 105 | 94.4 Ų | 94.4 | 49% | 0.491 | 55% | 0.546 | S | S | . | . | trans | -84.8 | 69.2 | -179 | -61.2 | -175.2 | 7.7 | 0 | 0 | 111.8 | H209 L210 I214 M235 | H209-Q212 PolarHBondContact O-N 2.97Å; L210-Q212 VanDerWaalsContact C-N 3.29Å; Q212-I214 PolarHBondContact O-N 3.31Å; Q212-M235 WeakPolarHBondContact O-CE 3.06Å | ||
| 213 | V | 93.9 | Very high | 94.4 | Very high | 29 Ų | 29 | 92.9 Ų | 92.9 | 18% | 0.176 | 53% | 0.529 | C | S | . | . | trans | -62.8 | 120.2 | -176.5 | -170.8 | 0 | 0 | 0 | 0 | 111.4 | L211 L215 N216 Y240 | L211-V213 VanDerWaalsContact C-N 3.32Å; L211-V213 PolarHBondContact O-N 3.07Å; V213-L215 VanDerWaalsContact C-N 3.29Å; V213-L215 HydrophobicContact CG1-CB 4.39Å; V213-L215 PolarHBondContact O-N 3.11Å; V213-N216 HydrophobicContact CB-CB 4.04Å; V213-N216 HydrophobicContact CG1-CB 4.45Å; V213-N216 PolarHBondContact O-N 3.37Å; V213-N216 VanDerWaalsContact O-N 3.08Å; V213-Y240 HydrophobicContact CB-CD1 4.39Å; V213-Y240 HydrophobicContact CB-CE1 4.34Å; V213-Y240 HydrophobicContact CG1-CD1 3.94Å; V213-Y240 HydrophobicContact CG1-CE1 4.31Å; V213-Y240 HydrophobicContact CG1-CG 4.32Å; V213-Y240 HydrophobicContact CG2-CD1 3.8Å; V213-Y240 HydrophobicContact CG2-CE1 3.7Å | ||
| 214 | I | 95 | Very high | 94.6 | Very high | 5 Ų | 5 | 91.7 Ų | 91.7 | 3% | 0.026 | 52% | 0.517 | C | S | . | . | G | 310 helix | trans | -61.4 | -35.8 | -177.7 | -171.8 | 167.5 | 0 | 0 | 0 | 113 | Q212 N216 K217 L228 P229 P231 M235 T263 | Q212-I214 PolarHBondContact O-N 3.31Å; I214-N216 VanDerWaalsContact C-N 3.25Å; I214-N216 PolarHBondContact O-N 3.23Å; I214-K217 PolarHBondContact O-N 2.81Å; I214-L228 HydrophobicContact CD1-CB 3.96Å; I214-L228 HydrophobicContact CD1-CD1 4.41Å; I214-L228 HydrophobicContact CG1-CB 4.25Å; I214-P229 WeakPolarHBondContact CD1-O 3.39Å; I214-P231 HydrophobicContact CD1-CB 3.98Å; I214-M235 HydrophobicContact CB-CE 4.21Å; I214-M235 HydrophobicContact CG2-CE 4.48Å; I214-T263 HydrophobicContact CG2-CG2 4.48Å |
| 215 | L | 95.7 | Very high | 94.7 | Very high | 66 Ų | 66 | 91.3 Ų | 91.3 | 35% | 0.346 | 51% | 0.514 | S | S | . | . | G | 310 helix | trans | -75.8 | -12 | 178.9 | -64.2 | -179.8 | 0 | 0 | 0 | 113.5 | V213 L228 S252 T263 L265 | V213-L215 VanDerWaalsContact C-N 3.29Å; V213-L215 HydrophobicContact CG1-CB 4.39Å; V213-L215 PolarHBondContact O-N 3.11Å; L215-L228 HydrophobicContact CD2-CD1 3.83Å; L215-L228 HydrophobicContact CD2-CD2 4.05Å; L215-S252 VanDerWaalsContact CD1-OG 3.28Å; L215-S252 WeakPolarHBondContact CD1-OG 3.28Å; L215-T263 HydrophobicContact CD1-CG2 4.01Å; L215-T263 HydrophobicContact CD2-CG2 3.89Å; L215-T263 HydrophobicContact CG-CG2 4.02Å; L215-L265 HydrophobicContact CD1-CD1 3.97Å; L215-L265 HydrophobicContact CD1-CD2 4.22Å; L215-L265 HydrophobicContact CD1-CG 4.14Å; L215-L265 HydrophobicContact CD2-CD1 4.41Å |
| 216 | N | 94.8 | Very high | 94.7 | Very high | 117 Ų | 117 | 87.6 Ų | 87.6 | 63% | 0.626 | 51% | 0.508 | S | S | * | . | G | 310 helix | trans | -93.2 | 1 | 174.5 | -65.6 | -4.2 | 0 | 0 | 0 | 112 | V213 I214 | V213-N216 HydrophobicContact CB-CB 4.04Å; V213-N216 HydrophobicContact CG1-CB 4.45Å; V213-N216 PolarHBondContact O-N 3.37Å; V213-N216 VanDerWaalsContact O-N 3.08Å; I214-N216 VanDerWaalsContact C-N 3.25Å; I214-N216 PolarHBondContact O-N 3.23Å |
| 217 | K | 93.3 | Very high | 94.7 | Very high | 96 Ų | 96 | 87.8 Ų | 87.8 | 42% | 0.417 | 51% | 0.509 | S | S | . | . | S | Bend | trans | -90.7 | 127.3 | 176.4 | -64 | -174.2 | 179.4 | -178.2 | 0 | 109.1 | I214 P229 | I214-K217 PolarHBondContact O-N 2.81Å; K217-P229 HydrophobicContact CD-CG 4.47Å |
| 218 | D | 93.1 | Very high | 94.6 | Very high | 166 Ų | 166 | 87.9 Ų | 87.9 | 89% | 0.888 | 51% | 0.505 | S | S | * | . | P | Polyproline II helix | trans | -68.3 | 136.7 | 171.9 | -62.3 | -45.1 | 0 | 0 | 0 | 110.3 | ||
| 219 | T | 92.5 | Very high | 94.6 | Very high | 56 Ų | 56 | 85.9 Ų | 85.9 | 34% | 0.344 | 49% | 0.492 | S | S | . | . | P | Polyproline II helix | trans | -101.4 | 152.3 | 171.2 | 54 | 0 | 0 | 0 | 0 | 109.9 | P229 | T219-P229 HydrophobicContact CG2-CG 4.38Š|
| 220 | G | 91.1 | Very high | 94.5 | Very high | 47 Ų | 47 | 88.8 Ų | 88.8 | 49% | 0.485 | 51% | 0.506 | S | S | . | . | P | Polyproline II helix | trans | -63.4 | 138.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | S222 C223 | G220-S222 PolarHBondContact O-N 3.21Å; G220-C223 PolarHBondContact O-N 3.26Å; G220-C223 PolarHBondContact O-SG 3.05Å |
| 221 | I | 93 | Very high | 94.6 | Very high | 186 Ų | 186 | 87.8 Ų | 87.8 | 95% | 0.954 | 50% | 0.501 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60 | -12.7 | -177.8 | 60 | 167.4 | 0 | 0 | 0 | 114.8 | ||
| 222 | S | 94.4 | Very high | 94.6 | Very high | 122 Ų | 122 | 85 Ų | 85 | 85% | 0.853 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.8 | -9 | 179.5 | 55.2 | 0 | 0 | 0 | 0 | 114.3 | G220 | G220-S222 PolarHBondContact O-N 3.21Š|
| 223 | C | 93.2 | Very high | 94.8 | Very high | 55 Ų | 55 | 86 Ų | 86 | 37% | 0.372 | 49% | 0.492 | S | S | . | . | S | Bend | trans | -100.6 | 161.5 | -179.4 | 73 | 0 | 0 | 0 | 0 | 112.4 | G220 | G220-C223 PolarHBondContact O-N 3.26Å; G220-C223 PolarHBondContact O-SG 3.05Å |
| 224 | D | 95.7 | Very high | 94.9 | Very high | 90 Ų | 90 | 87.1 Ų | 87.1 | 48% | 0.481 | 50% | 0.499 | S | S | . | . | trans | -60.2 | 127.3 | 175.4 | 178.8 | -24.9 | 0 | 0 | 0 | 110.1 | A226 L227 | D224-A226 PolarHBondContact O-N 2.87Å; D224-A226 VanDerWaalsContact O-N 3.14Å; D224-A226 WeakPolarHBondContact OD1-CB 3.38Å; D224-A226 PolarHBondContact OD1-N 2.83Å; D224-L227 HydrophobicContact CB-CD1 3.86Å; D224-L227 HydrophobicContact CB-CG 3.92Å; D224-L227 WeakPolarHBondContact O-CB 3.46Å; D224-L227 PolarHBondContact O-N 2.92Å | ||
| 225 | P | 95.4 | Very high | 95 | Very high | 118 Ų | 118 | 87.2 Ų | 87.2 | 77% | 0.766 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.3 | -16 | -176.9 | 27.3 | -36.8 | 0 | 0 | 0 | 114.3 | L227 | P225-L227 VanDerWaalsContact C-N 3.31Š|
| 226 | A | 96 | Very high | 95 | Very high | 84 Ų | 84 | 84.8 Ų | 84.8 | 69% | 0.694 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.8 | -11.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113 | D224 | D224-A226 PolarHBondContact O-N 2.87Å; D224-A226 VanDerWaalsContact O-N 3.14Å; D224-A226 WeakPolarHBondContact OD1-CB 3.38Å; D224-A226 PolarHBondContact OD1-N 2.83Å |
| 227 | L | 96.1 | Very high | 95.2 | Very high | 104 Ų | 104 | 84.9 Ų | 84.9 | 55% | 0.545 | 49% | 0.487 | S | S | . | . | trans | -82.8 | 136.1 | 177.4 | -62.5 | 176.4 | 0 | 0 | 0 | 110.8 | D224 P225 | D224-L227 HydrophobicContact CB-CD1 3.86Å; D224-L227 HydrophobicContact CB-CG 3.92Å; D224-L227 WeakPolarHBondContact O-CB 3.46Å; D224-L227 PolarHBondContact O-N 2.92Å; P225-L227 VanDerWaalsContact C-N 3.31Å | ||
| 228 | L | 96.2 | Very high | 95.4 | Very high | 69 Ų | 69 | 84.1 Ų | 84.1 | 36% | 0.361 | 48% | 0.484 | S | S | . | . | trans | -118.1 | 155.6 | 175.4 | -65 | 174.1 | 0 | 0 | 0 | 110.1 | I214 L215 T263 | I214-L228 HydrophobicContact CD1-CB 3.96Å; I214-L228 HydrophobicContact CD1-CD1 4.41Å; I214-L228 HydrophobicContact CG1-CB 4.25Å; L215-L228 HydrophobicContact CD2-CD1 3.83Å; L215-L228 HydrophobicContact CD2-CD2 4.05Å; L228-T263 HydrophobicContact CD1-CG2 4.23Å; L228-T263 WeakPolarHBondContact CD1-OG1 3.4Å | ||
| 229 | P | 95.4 | Very high | 95.6 | Very high | 48 Ų | 48 | 81.9 Ų | 81.9 | 31% | 0.312 | 47% | 0.472 | S | S | . | . | P | Polyproline II helix | trans | -57.4 | 159.2 | 171.3 | -22.4 | 33.6 | 0 | 0 | 0 | 112.2 | I214 K217 T219 P231 | I214-P229 WeakPolarHBondContact CD1-O 3.39Å; K217-P229 HydrophobicContact CD-CG 4.47Å; T219-P229 HydrophobicContact CG2-CG 4.38Å; P229-P231 WeakPolarHBondContact O-CD 3.47Å |
| 230 | E | 95.9 | Very high | 95.9 | Very high | 149 Ų | 149 | 80.8 Ų | 80.8 | 70% | 0.696 | 46% | 0.462 | S | S | * | . | P | Polyproline II helix | trans | -64.2 | 123.7 | 173 | -174.4 | 170.9 | -173.8 | 0 | 0 | 110.6 | Y261 | E230-Y261 HydrophobicContact CG-CD2 4.33Å; E230-Y261 HydrophobicContact CG-CE2 3.81Å; E230-Y261 PolarHBondContact OE1-OH 3.06Å |
| 231 | P | 96.7 | Very high | 96.2 | Very high | 11 Ų | 11 | 81.9 Ų | 81.9 | 7% | 0.071 | 47% | 0.466 | C | S | . | . | P | Polyproline II helix | trans | -75.1 | 152.8 | 178.1 | 31.1 | -35.7 | 0 | 0 | 0 | 111.4 | I214 P229 M235 L236 T254 Y261 | I214-P231 HydrophobicContact CD1-CB 3.98Å; P229-P231 WeakPolarHBondContact O-CD 3.47Å; P231-M235 HydrophobicContact CB-CG 4.17Å; P231-M235 HydrophobicContact CB-SD 3.88Å; P231-L236 HydrophobicContact CB-CD2 4.03Å; P231-L236 HydrophobicContact CG-CD2 3.78Å; P231-T254 HydrophobicContact CB-CG2 4.27Å; P231-T254 HydrophobicContact CG-CG2 4.01Å; P231-Y261 HydrophobicContact CG-CD1 3.53Å; P231-Y261 HydrophobicContact CG-CD2 4.12Å; P231-Y261 HydrophobicContact CG-CE1 4.05Å; P231-Y261 HydrophobicContact CG-CG 3.55Å |
| 232 | N | 96.6 | Very high | 96.3 | Very high | 62 Ų | 62 | 78.1 Ų | 78.1 | 33% | 0.332 | 45% | 0.447 | S | S | . | . | P | Polyproline II helix | trans | -69.2 | 141.5 | 166.4 | -166.8 | -30.5 | 0 | 0 | 0 | 109.6 | V234 M235 | N232-V234 HydrophobicContact CB-CG2 4.26Å; N232-V234 PolarHBondContact O-N 3.38Å; N232-V234 VanDerWaalsContact O-N 3.12Å; N232-V234 PolarHBondContact OD1-N 3.02Å; N232-M235 HydrophobicContact CB-CG 4.42Å; N232-M235 WeakPolarHBondContact O-CG 3.48Å; N232-M235 PolarHBondContact O-N 2.95Å |
| 233 | H | 97 | Very high | 96.4 | Very high | 125 Ų | 125 | 78 Ų | 78 | 58% | 0.579 | 45% | 0.446 | S | S | * | . | G | 310 helix | trans | -59 | -28 | 179.9 | 71.6 | -77.6 | 0 | 0 | 0 | 113.2 | M235 L236 | H233-M235 VanDerWaalsContact C-N 3.34Å; H233-M235 PolarHBondContact O-N 3.15Å; H233-L236 WeakPolarHBondContact O-CB 3.25Å; H233-L236 WeakPolarHBondContact O-CG 3.45Å; H233-L236 PolarHBondContact O-N 3.41Å |
| 234 | V | 96.9 | Very high | 96.6 | Very high | 54 Ų | 54 | 80 Ų | 80 | 33% | 0.327 | 45% | 0.453 | S | S | . | . | G | 310 helix | trans | -75.2 | -17.1 | -178.6 | -53.9 | 0 | 0 | 0 | 0 | 114.5 | H209 N232 H238 | H209-V234 HydrophobicContact CB-CG2 3.6Å; N232-V234 HydrophobicContact CB-CG2 4.26Å; N232-V234 PolarHBondContact O-N 3.38Å; N232-V234 VanDerWaalsContact O-N 3.12Å; N232-V234 PolarHBondContact OD1-N 3.02Å; V234-H238 PolarHBondContact O-CD2 2.9Å; V234-H238 PolarHBondContact O-NE2 2.85Å |
| 235 | M | 95.9 | Very high | 96.6 | Very high | 7 Ų | 7 | 82.9 Ų | 82.9 | 3% | 0.034 | 46% | 0.461 | C | S | . | . | G | 310 helix | trans | -94.2 | -7.2 | 177.1 | 66.4 | 177 | -36.6 | 0 | 0 | 112.7 | L210 Q212 I214 P231 N232 H233 H238 Y240 | L210-M235 HydrophobicContact CD2-CB 4.45Å; Q212-M235 WeakPolarHBondContact O-CE 3.06Å; I214-M235 HydrophobicContact CB-CE 4.21Å; I214-M235 HydrophobicContact CG2-CE 4.48Å; P231-M235 HydrophobicContact CB-CG 4.17Å; P231-M235 HydrophobicContact CB-SD 3.88Å; N232-M235 HydrophobicContact CB-CG 4.42Å; N232-M235 WeakPolarHBondContact O-CG 3.48Å; N232-M235 PolarHBondContact O-N 2.95Å; H233-M235 VanDerWaalsContact C-N 3.34Å; H233-M235 PolarHBondContact O-N 3.15Å; M235-H238 PolarHBondContact O-N 2.8Å; M235-Y240 HydrophobicContact CE-CE2 4.16Å; M235-Y240 WeakPolarHBondContact CE-OH 3.13Å |
| 236 | L | 97 | Very high | 96.6 | Very high | 14 Ų | 14 | 84.1 Ų | 84.1 | 7% | 0.073 | 46% | 0.461 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | 149.2 | 176.4 | -57.6 | 177.6 | 0 | 0 | 0 | 110.1 | P231 H233 H238 T254 R256 Y261 | P231-L236 HydrophobicContact CB-CD2 4.03Å; P231-L236 HydrophobicContact CG-CD2 3.78Å; H233-L236 WeakPolarHBondContact O-CB 3.25Å; H233-L236 WeakPolarHBondContact O-CG 3.45Å; H233-L236 PolarHBondContact O-N 3.41Å; L236-H238 PolarHBondContact O-CD2 2.89Å; L236-H238 VanDerWaalsContact O-CD2 3.32Å; L236-H238 PolarHBondContact O-N 2.98Å; L236-H238 VanDerWaalsContact O-N 3.1Å; L236-T254 WeakPolarHBondContact CA-O 3.47Å; L236-T254 HydrophobicContact CD2-CG2 3.55Å; L236-R256 HydrophobicContact CD1-CB 4.09Å; L236-Y261 HydrophobicContact CD1-CD1 4.13Å; L236-Y261 HydrophobicContact CD1-CE1 3.87Å; L236-Y261 HydrophobicContact CD2-CD1 4Å; L236-Y261 HydrophobicContact CD2-CE1 4.44Å |
| 237 | N | 97.4 | Very high | 96.6 | Very high | 120 Ų | 120 | 82.1 Ų | 82.1 | 64% | 0.642 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.8 | 7.3 | -178.3 | -45.7 | -35.7 | 0 | 0 | 0 | 114.7 | T254 H255 | N237-T254 PolarHBondContact N-O 3.24Å; N237-H255 PolarHBondContact OD1-CD2 3.21Å |
| 238 | H | 97.8 | Very high | 96.6 | Very high | 79 Ų | 79 | 79.5 Ų | 79.5 | 37% | 0.366 | 44% | 0.436 | S | S | . | . | trans | -87.3 | 137.3 | 168.8 | -72.4 | -91.3 | 0 | 0 | 0 | 110.9 | L210 V234 M235 L236 Y240 | L210-H238 HydrophobicContact CD2-CB 4.44Å; V234-H238 PolarHBondContact O-CD2 2.9Å; V234-H238 PolarHBondContact O-NE2 2.85Å; M235-H238 PolarHBondContact O-N 2.8Å; L236-H238 PolarHBondContact O-CD2 2.89Å; L236-H238 VanDerWaalsContact O-CD2 3.32Å; L236-H238 PolarHBondContact O-N 2.98Å; L236-H238 VanDerWaalsContact O-N 3.1Å; H238-Y240 HydrophobicContact CB-CE2 4.15Å | ||
| 239 | L | 97.9 | Very high | 96.7 | Very high | 119 Ų | 119 | 79.1 Ų | 79.1 | 62% | 0.623 | 43% | 0.434 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -82.5 | 124.2 | 176.6 | -175.3 | 70.2 | 0 | 0 | 0 | 110.2 | L251 | L239-L251 HydrophobicContact CD1-CB 4.1Å; L239-L251 HydrophobicContact CD1-CD2 4.41Å; L239-L251 HydrophobicContact CD2-CD2 4.42Å |
| 240 | Y | 97.7 | Very high | 96.8 | Very high | 34 Ų | 34 | 77.8 Ų | 77.8 | 13% | 0.133 | 43% | 0.425 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 143.8 | 167.4 | -65.9 | -84.4 | 0 | 0 | 0 | 109.1 | L210 V213 M235 H238 S252 | L210-Y240 VanDerWaalsContact O-CE1 3.32Å; L210-Y240 WeakPolarHBondContact O-CE1 3.48Å; L210-Y240 PolarHBondContact O-OH 3.42Å; V213-Y240 HydrophobicContact CB-CD1 4.39Å; V213-Y240 HydrophobicContact CB-CE1 4.34Å; V213-Y240 HydrophobicContact CG1-CD1 3.94Å; V213-Y240 HydrophobicContact CG1-CE1 4.31Å; V213-Y240 HydrophobicContact CG1-CG 4.32Å; V213-Y240 HydrophobicContact CG2-CD1 3.8Å; V213-Y240 HydrophobicContact CG2-CE1 3.7Å; M235-Y240 HydrophobicContact CE-CE2 4.16Å; M235-Y240 WeakPolarHBondContact CE-OH 3.13Å; H238-Y240 HydrophobicContact CB-CE2 4.15Å; Y240-S252 PolarHBondContact N-O 3.32Å; Y240-S252 PolarHBondContact O-N 3.41Å; Y240-S252 VanDerWaalsContact O-O 3.1Å |
| 241 | A | 97.4 | Very high | 96.9 | Very high | 69 Ų | 69 | 72.9 Ų | 72.9 | 57% | 0.57 | 40% | 0.403 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -137.5 | 145.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | V250 L251 | A241-V250 WeakPolarHBondContact CA-O 3.39Å; A241-L251 HydrophobicContact CB-CD2 3.63Å |
| 242 | L | 96.8 | Very high | 97 | Very high | 108 Ų | 108 | 72.9 Ų | 72.9 | 57% | 0.565 | 40% | 0.403 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89 | 152.2 | 164.5 | -64.7 | 175 | 0 | 0 | 0 | 109.4 | I244 V250 | L242-I244 PolarHBondContact O-N 2.9Å; L242-V250 HydrophobicContact CB-CB 4.28Å; L242-V250 HydrophobicContact CD1-CB 4.28Å; L242-V250 HydrophobicContact CD1-CG1 4.22Å; L242-V250 PolarHBondContact N-O 3.08Å; L242-V250 VanDerWaalsContact N-O 3.07Å |
| 243 | S | 96.4 | Very high | 97 | Very high | 118 Ų | 118 | 70.6 Ų | 70.6 | 83% | 0.825 | 39% | 0.393 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -56.2 | 129.5 | 170.4 | -62.5 | 0 | 0 | 0 | 0 | 109.9 | K245 | S243-K245 PolarHBondContact O-N 3.16Å |
| 244 | I | 96.1 | Very high | 97.1 | Very high | 99 Ų | 99 | 64.7 Ų | 64.7 | 51% | 0.508 | 37% | 0.366 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -57.1 | 131 | -179.6 | -63.7 | 159.5 | 0 | 0 | 0 | 109.4 | L242 M249 I270 | L242-I244 PolarHBondContact O-N 2.9Å; I244-M249 HydrophobicContact CD1-CE 4.16Å; I244-M249 HydrophobicContact CG1-CB 4.42Å; I244-M249 HydrophobicContact CG1-CG 4.28Å; I244-I270 HydrophobicContact CB-CD1 4.41Å; I244-I270 HydrophobicContact CD1-CD1 3.52Å; I244-I270 HydrophobicContact CG1-CD1 3.89Å; I244-I270 HydrophobicContact CG2-CD1 3.62Å |
| 245 | K | 95.9 | Very high | 97.1 | Very high | 150 Ų | 150 | 66.4 Ų | 66.4 | 65% | 0.652 | 37% | 0.37 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -143.6 | 143.7 | 179 | -164.7 | -175.4 | 169.4 | -176 | 0 | 109.5 | S243 G247 V248 | S243-K245 PolarHBondContact O-N 3.16Å; K245-G247 PolarHBondContact O-N 3.35Å; K245-G247 VanDerWaalsContact O-N 3.15Å; K245-V248 PolarHBondContact N-O 3.42Å; K245-V248 PolarHBondContact O-N 2.86Å |
| 246 | D | 95.8 | Very high | 97.2 | Very high | 143 Ų | 143 | 72 Ų | 72 | 77% | 0.765 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.9 | 32.8 | 175.9 | -51.6 | -40.4 | 0 | 0 | 0 | 114.1 | V248 | D246-V248 VanDerWaalsContact C-N 3.26Å; D246-V248 PolarHBondContact O-N 3.35Å |
| 247 | G | 95.5 | Very high | 97.3 | Very high | 42 Ų | 42 | 78.9 Ų | 78.9 | 43% | 0.433 | 42% | 0.417 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.2 | 12.8 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | K245 P269 I270 | K245-G247 PolarHBondContact O-N 3.35Å; K245-G247 VanDerWaalsContact O-N 3.15Å; G247-P269 WeakPolarHBondContact O-CA 3.37Å; G247-I270 PolarHBondContact O-N 3.43Å |
| 248 | V | 97.3 | Very high | 97.2 | Very high | 49 Ų | 49 | 81 Ų | 81 | 30% | 0.297 | 42% | 0.42 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.4 | 129.7 | -179 | -176.8 | 0 | 0 | 0 | 0 | 110.7 | K245 D246 V250 Y267 | K245-V248 PolarHBondContact N-O 3.42Å; K245-V248 PolarHBondContact O-N 2.86Å; D246-V248 VanDerWaalsContact C-N 3.26Å; D246-V248 PolarHBondContact O-N 3.35Å; V248-V250 HydrophobicContact CG1-CG2 4.37Å; V248-Y267 HydrophobicContact CG1-CD1 4.13Å |
| 249 | M | 97.3 | Very high | 97.2 | Very high | 62 Ų | 62 | 86.7 Ų | 86.7 | 31% | 0.305 | 44% | 0.444 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.4 | 131.8 | 167.6 | -167 | -178.2 | -66.9 | 0 | 0 | 109.6 | I244 L251 K268 I270 | I244-M249 HydrophobicContact CD1-CE 4.16Å; I244-M249 HydrophobicContact CG1-CB 4.42Å; I244-M249 HydrophobicContact CG1-CG 4.28Å; M249-L251 HydrophobicContact CG-CD2 4.04Å; M249-L251 HydrophobicContact CG-CG 4.06Å; M249-L251 HydrophobicContact SD-CD1 3.94Å; M249-L251 HydrophobicContact SD-CD2 3.98Å; M249-L251 HydrophobicContact SD-CG 4Å; M249-K268 PolarHBondContact N-O 3.39Å; M249-K268 PolarHBondContact O-N 3.41Å; M249-I270 HydrophobicContact CB-CD1 3.99Å; M249-I270 HydrophobicContact CB-CG1 4.06Å; M249-I270 HydrophobicContact CE-CD1 3.76Å; M249-I270 HydrophobicContact CE-CG1 4.28Å |
| 250 | V | 97.7 | Very high | 97.2 | Very high | 20 Ų | 20 | 88.2 Ų | 88.2 | 12% | 0.121 | 45% | 0.445 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 115.8 | 174.3 | -169.9 | 0 | 0 | 0 | 0 | 109.4 | A241 L242 V248 L266 Y267 | A241-V250 WeakPolarHBondContact CA-O 3.39Å; L242-V250 HydrophobicContact CB-CB 4.28Å; L242-V250 HydrophobicContact CD1-CB 4.28Å; L242-V250 HydrophobicContact CD1-CG1 4.22Å; L242-V250 PolarHBondContact N-O 3.08Å; L242-V250 VanDerWaalsContact N-O 3.07Å; V248-V250 HydrophobicContact CG1-CG2 4.37Å; V250-L266 WeakPolarHBondContact CA-O 3.42Å; V250-Y267 HydrophobicContact CB-CD1 4.43Å; V250-Y267 HydrophobicContact CB-CE1 4.29Å; V250-Y267 HydrophobicContact CG1-CD1 4.21Å; V250-Y267 HydrophobicContact CG1-CD2 4.42Å; V250-Y267 HydrophobicContact CG1-CE1 3.83Å; V250-Y267 HydrophobicContact CG1-CE2 4.06Å; V250-Y267 HydrophobicContact CG1-CG 4.48Å; V250-Y267 HydrophobicContact CG2-CD1 3.49Å; V250-Y267 VanDerWaalsContact CG2-CD1 3.49Å; V250-Y267 HydrophobicContact CG2-CE1 3.43Å; V250-Y267 VanDerWaalsContact CG2-CE1 3.43Å; V250-Y267 HydrophobicContact CG2-CG 4.32Å |
| 251 | L | 97.8 | Very high | 97.2 | Very high | 46 Ų | 46 | 90 Ų | 90 | 24% | 0.241 | 45% | 0.453 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 148 | 178.8 | -61 | -178.3 | 0 | 0 | 0 | 109.8 | L239 A241 M249 L265 L266 | L239-L251 HydrophobicContact CD1-CB 4.1Å; L239-L251 HydrophobicContact CD1-CD2 4.41Å; L239-L251 HydrophobicContact CD2-CD2 4.42Å; A241-L251 HydrophobicContact CB-CD2 3.63Å; M249-L251 HydrophobicContact CG-CD2 4.04Å; M249-L251 HydrophobicContact CG-CG 4.06Å; M249-L251 HydrophobicContact SD-CD1 3.94Å; M249-L251 HydrophobicContact SD-CD2 3.98Å; M249-L251 HydrophobicContact SD-CG 4Å; L251-L265 CarbonylContact O-C 3.44Å; L251-L265 WeakPolarHBondContact O-CA 3.38Å; L251-L266 PolarHBondContact N-O 3.45Å; L251-L266 PolarHBondContact O-N 3.03Å |
| 252 | S | 97.9 | Very high | 97.3 | Very high | 11 Ų | 11 | 90.4 Ų | 90.4 | 8% | 0.077 | 45% | 0.448 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.5 | 143.1 | 177.1 | 177.6 | 0 | 0 | 0 | 0 | 111.1 | L215 Y240 T263 T264 | L215-S252 VanDerWaalsContact CD1-OG 3.28Å; L215-S252 WeakPolarHBondContact CD1-OG 3.28Å; Y240-S252 PolarHBondContact N-O 3.32Å; Y240-S252 PolarHBondContact O-N 3.41Å; Y240-S252 VanDerWaalsContact O-O 3.1Å; S252-T263 VanDerWaalsContact OG-CG2 3.29Å; S252-T263 WeakPolarHBondContact OG-CG2 3.47Å; S252-T264 VanDerWaalsContact CA-O 3.28Å; S252-T264 WeakPolarHBondContact CA-O 3.36Å |
| 253 | A | 98.1 | Very high | 97.3 | Very high | 14 Ų | 14 | 86.5 Ų | 86.5 | 12% | 0.116 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.7 | 142.4 | 167.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | T264 | A253-T264 PolarHBondContact N-O 3.31Å; A253-T264 PolarHBondContact O-N 2.94Å |
| 254 | T | 98.1 | Very high | 97.4 | Very high | 1 Ų | 1 | 84.8 Ų | 84.8 | 1% | 0.006 | 41% | 0.413 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.7 | 121 | 174.3 | -51.7 | 0 | 0 | 0 | 0 | 109.7 | P231 L236 N237 V262 T263 | P231-T254 HydrophobicContact CB-CG2 4.27Å; P231-T254 HydrophobicContact CG-CG2 4.01Å; L236-T254 WeakPolarHBondContact CA-O 3.47Å; L236-T254 HydrophobicContact CD2-CG2 3.55Å; N237-T254 PolarHBondContact N-O 3.24Å; T254-V262 WeakPolarHBondContact CA-O 3.34Å; T254-T263 WeakPolarHBondContact CG2-OG1 3.18Å; T254-T263 PolarHBondContact OG1-OG1 3.07Å |
| 255 | H | 98.2 | Very high | 97.5 | Very high | 90 Ų | 90 | 83.8 Ų | 83.8 | 42% | 0.417 | 41% | 0.408 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 153.3 | 178.2 | -62.6 | 94.7 | 0 | 0 | 0 | 110.5 | N237 Y261 V262 | N237-H255 PolarHBondContact OD1-CD2 3.21Å; H255-Y261 WeakPolarHBondContact O-CA 3.45Å; H255-V262 PolarHBondContact N-O 2.84Å; H255-V262 PolarHBondContact O-N 3.06Å |
| 256 | R | 98.1 | Very high | 97.6 | Very high | 124 Ų | 124 | 81.2 Ų | 81.2 | 47% | 0.468 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.1 | 126.7 | 173.6 | 178.7 | -175.4 | -72.9 | 169.2 | -3.8 | 109.8 | L236 K258 K260 Y261 | L236-R256 HydrophobicContact CD1-CB 4.09Å; R256-K258 WeakPolarHBondContact CD-O 3.28Å; R256-K258 VanDerWaalsContact CG-O 3.25Å; R256-K258 WeakPolarHBondContact CG-O 3.49Å; R256-K260 CarbonylContact C-O 3.58Å; R256-K260 WeakPolarHBondContact CA-O 3.4Å; R256-Y261 HydrophobicContact CB-CD1 4.2Å; R256-Y261 HydrophobicContact CB-CE1 4.36Å; R256-Y261 HydrophobicContact CG-CD1 4.36Å; R256-Y261 HydrophobicContact CG-CE1 4.23Å; R256-Y261 VanDerWaalsContact NE-CE1 3.3Å; R256-Y261 PolarHBondContact NH2-OH 2.87Å; R256-Y261 VanDerWaalsContact NH2-OH 3.11Å |
| 257 | Y | 97.7 | Very high | 97.7 | Very high | 159 Ų | 159 | 81.4 Ų | 81.4 | 62% | 0.624 | 39% | 0.392 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 110.7 | 167.7 | -179.7 | -104.6 | 0 | 0 | 0 | 109.2 | K259 K260 | Y257-K259 PolarHBondContact O-N 2.97Å; Y257-K259 VanDerWaalsContact O-N 3.16Å; Y257-K260 PolarHBondContact N-O 3.14Å; Y257-K260 WeakPolarHBondContact O-CB 3.29Å; Y257-K260 PolarHBondContact O-N 2.84Å |
| 258 | K | 96.3 | Very high | 97.8 | Very high | 165 Ų | 165 | 85.7 Ų | 85.7 | 72% | 0.717 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.8 | -117.6 | -170.5 | -56.6 | -177.8 | 177.6 | -177.5 | 0 | 110.6 | R256 | R256-K258 WeakPolarHBondContact CD-O 3.28Å; R256-K258 VanDerWaalsContact CG-O 3.25Å; R256-K258 WeakPolarHBondContact CG-O 3.49Å |
| 259 | K | 97.3 | Very high | 97.8 | Very high | 197 Ų | 197 | 88.3 Ų | 88.3 | 86% | 0.857 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.2 | 13.9 | 177.4 | -60.2 | -172.4 | 177.8 | -174.3 | 0 | 113.2 | Y257 | Y257-K259 PolarHBondContact O-N 2.97Å; Y257-K259 VanDerWaalsContact O-N 3.16Å |
| 260 | K | 97.7 | Very high | 97.5 | Very high | 151 Ų | 151 | 92.5 Ų | 92.5 | 66% | 0.657 | 44% | 0.439 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -115.7 | 149.9 | -177.7 | -57.7 | -64.8 | -174.1 | 166.3 | 0 | 110.1 | R256 Y257 | R256-K260 CarbonylContact C-O 3.58Å; R256-K260 WeakPolarHBondContact CA-O 3.4Å; Y257-K260 PolarHBondContact N-O 3.14Å; Y257-K260 WeakPolarHBondContact O-CB 3.29Å; Y257-K260 PolarHBondContact O-N 2.84Å |
| 261 | Y | 98.3 | Very high | 97.5 | Very high | 73 Ų | 73 | 96.2 Ų | 96.2 | 29% | 0.286 | 46% | 0.455 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.1 | 135 | 177.7 | -54.2 | -80.8 | 0 | 0 | 0 | 109.2 | E230 P231 L236 H255 R256 | E230-Y261 HydrophobicContact CG-CD2 4.33Å; E230-Y261 HydrophobicContact CG-CE2 3.81Å; E230-Y261 PolarHBondContact OE1-OH 3.06Å; P231-Y261 HydrophobicContact CG-CD1 3.53Å; P231-Y261 HydrophobicContact CG-CD2 4.12Å; P231-Y261 HydrophobicContact CG-CE1 4.05Å; P231-Y261 HydrophobicContact CG-CG 3.55Å; L236-Y261 HydrophobicContact CD1-CD1 4.13Å; L236-Y261 HydrophobicContact CD1-CE1 3.87Å; L236-Y261 HydrophobicContact CD2-CD1 4Å; L236-Y261 HydrophobicContact CD2-CE1 4.44Å; H255-Y261 WeakPolarHBondContact O-CA 3.45Å; R256-Y261 HydrophobicContact CB-CD1 4.2Å; R256-Y261 HydrophobicContact CB-CE1 4.36Å; R256-Y261 HydrophobicContact CG-CD1 4.36Å; R256-Y261 HydrophobicContact CG-CE1 4.23Å; R256-Y261 VanDerWaalsContact NE-CE1 3.3Å; R256-Y261 PolarHBondContact NH2-OH 2.87Å; R256-Y261 VanDerWaalsContact NH2-OH 3.11Å |
| 262 | V | 98.1 | Very high | 97.5 | Very high | 77 Ų | 77 | 98.8 Ų | 98.8 | 47% | 0.467 | 47% | 0.466 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.4 | 119.2 | -179.8 | -175.8 | 0 | 0 | 0 | 0 | 108.6 | T254 H255 | T254-V262 WeakPolarHBondContact CA-O 3.34Å; H255-V262 PolarHBondContact N-O 2.84Å; H255-V262 PolarHBondContact O-N 3.06Å |
| 263 | T | 98.2 | Very high | 97.5 | Very high | 25 Ų | 25 | 103.7 Ų | 103.7 | 15% | 0.153 | 49% | 0.488 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 112.6 | 171.6 | -56 | 0 | 0 | 0 | 0 | 108.4 | I214 L215 L228 S252 T254 L265 | I214-T263 HydrophobicContact CG2-CG2 4.48Å; L215-T263 HydrophobicContact CD1-CG2 4.01Å; L215-T263 HydrophobicContact CD2-CG2 3.89Å; L215-T263 HydrophobicContact CG-CG2 4.02Å; L228-T263 HydrophobicContact CD1-CG2 4.23Å; L228-T263 WeakPolarHBondContact CD1-OG1 3.4Å; S252-T263 VanDerWaalsContact OG-CG2 3.29Å; S252-T263 WeakPolarHBondContact OG-CG2 3.47Å; T254-T263 WeakPolarHBondContact CG2-OG1 3.18Å; T254-T263 PolarHBondContact OG1-OG1 3.07Å; T263-L265 HydrophobicContact CG2-CD1 4.1Å |
| 264 | T | 98.2 | Very high | 97.5 | Very high | 82 Ų | 82 | 108.9 Ų | 108.9 | 50% | 0.503 | 51% | 0.51 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.1 | 126.8 | -178.8 | -55.3 | 0 | 0 | 0 | 0 | 109.3 | S252 A253 | S252-T264 VanDerWaalsContact CA-O 3.28Å; S252-T264 WeakPolarHBondContact CA-O 3.36Å; A253-T264 PolarHBondContact N-O 3.31Å; A253-T264 PolarHBondContact O-N 2.94Å |
| 265 | L | 98.2 | Very high | 97.4 | Very high | 78 Ų | 78 | 115.7 Ų | 115.7 | 41% | 0.408 | 54% | 0.541 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.5 | 133.8 | 174 | -71.4 | 72.8 | 0 | 0 | 0 | 109.2 | L215 L251 T263 Y267 | L215-L265 HydrophobicContact CD1-CD1 3.97Å; L215-L265 HydrophobicContact CD1-CD2 4.22Å; L215-L265 HydrophobicContact CD1-CG 4.14Å; L215-L265 HydrophobicContact CD2-CD1 4.41Å; L251-L265 CarbonylContact O-C 3.44Å; L251-L265 WeakPolarHBondContact O-CA 3.38Å; T263-L265 HydrophobicContact CG2-CD1 4.1Å; L265-Y267 HydrophobicContact CB-CE2 4.15Å; L265-Y267 HydrophobicContact CD2-CE2 4.45Å |
| 266 | L | 98 | Very high | 97.4 | Very high | 96 Ų | 96 | 117.4 Ų | 117.4 | 50% | 0.503 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 123.1 | 176.3 | 176.2 | 65.6 | 0 | 0 | 0 | 109.6 | V250 L251 | V250-L266 WeakPolarHBondContact CA-O 3.42Å; L251-L266 PolarHBondContact N-O 3.45Å; L251-L266 PolarHBondContact O-N 3.03Å |
| 267 | Y | 97.9 | Very high | 97.3 | Very high | 147 Ų | 147 | 116.9 Ų | 116.9 | 58% | 0.576 | 56% | 0.555 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -102.9 | 119.9 | 171.5 | -68.9 | -103.7 | 0 | 0 | 0 | 108.4 | V248 V250 L265 | V248-Y267 HydrophobicContact CG1-CD1 4.13Å; V250-Y267 HydrophobicContact CB-CD1 4.43Å; V250-Y267 HydrophobicContact CB-CE1 4.29Å; V250-Y267 HydrophobicContact CG1-CD1 4.21Å; V250-Y267 HydrophobicContact CG1-CD2 4.42Å; V250-Y267 HydrophobicContact CG1-CE1 3.83Å; V250-Y267 HydrophobicContact CG1-CE2 4.06Å; V250-Y267 HydrophobicContact CG1-CG 4.48Å; V250-Y267 HydrophobicContact CG2-CD1 3.49Å; V250-Y267 VanDerWaalsContact CG2-CD1 3.49Å; V250-Y267 HydrophobicContact CG2-CE1 3.43Å; V250-Y267 VanDerWaalsContact CG2-CE1 3.43Å; V250-Y267 HydrophobicContact CG2-CG 4.32Å; L265-Y267 HydrophobicContact CB-CE2 4.15Å; L265-Y267 HydrophobicContact CD2-CE2 4.45Å |
| 268 | K | 97.3 | Very high | 97.3 | Very high | 133 Ų | 133 | 113.7 Ų | 113.7 | 58% | 0.578 | 55% | 0.55 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -132.6 | 125.6 | -178.8 | -172.8 | 179.3 | 177.1 | -179.4 | 0 | 110.6 | M249 | M249-K268 PolarHBondContact N-O 3.39Å; M249-K268 PolarHBondContact O-N 3.41Å |
| 269 | P | 96.5 | Very high | 97.4 | Very high | 104 Ų | 104 | 109.4 Ų | 109.4 | 68% | 0.675 | 54% | 0.536 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -66 | 148.3 | 173.2 | 28.5 | -33.6 | 0 | 0 | 0 | 111.1 | G247 | G247-P269 WeakPolarHBondContact O-CA 3.37Å |
| 270 | I | 92.6 | Very high | 97.4 | Very high | 150 Ų | 150 | 101.5 Ų | 101.5 | 77% | 0.769 | 51% | 0.507 | S | S | * | . | trans | -104.7 | 0 | 175.7 | -55.1 | -176 | 0 | 0 | 0 | 110 | I244 G247 M249 | I244-I270 HydrophobicContact CB-CD1 4.41Å; I244-I270 HydrophobicContact CD1-CD1 3.52Å; I244-I270 HydrophobicContact CG1-CD1 3.89Å; I244-I270 HydrophobicContact CG2-CD1 3.62Å; G247-I270 PolarHBondContact O-N 3.43Å; M249-I270 HydrophobicContact CB-CD1 3.99Å; M249-I270 HydrophobicContact CB-CG1 4.06Å; M249-I270 HydrophobicContact CE-CD1 3.76Å; M249-I270 HydrophobicContact CE-CG1 4.28Å |
Retrieved 270 of 270 residues in 381.2 ms
(Link to these results)