| 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 | 42.4 | Very low | 45.6 | Very low | 237 Ų | 237 | 149.6 Ų | 149.6 | 100% | 1.167 | 88% | 0.881 | S | S | * | * | 0 | 149.3 | 0 | -66.7 | -70.8 | -176.4 | 0 | 0 | 108.3 | |||||
| 2 | L | 41.4 | Very low | 46.2 | Very low | 166 Ų | 166 | 150.5 Ų | 150.5 | 87% | 0.869 | 88% | 0.877 | S | S | * | * | trans | -73.1 | 156 | -142.9 | -80.2 | 73 | 0 | 0 | 0 | 118.3 | ||||
| 3 | R | 41.1 | Very low | 46.8 | Very low | 245 Ų | 245 | 150.5 Ų | 150.5 | 93% | 0.925 | 87% | 0.87 | S | S | * | * | trans | -52.4 | 147.6 | 157.9 | -59.2 | 168.1 | 125 | 140.3 | -1.8 | 112.1 | ||||
| 4 | A | 46.9 | Very low | 46.6 | Very low | 107 Ų | 107 | 148 Ų | 148 | 88% | 0.884 | 87% | 0.866 | S | S | * | * | trans | -157.6 | 121 | 140.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 5 | A | 51.9 | Low | 46.7 | Very low | 101 Ų | 101 | 154.1 Ų | 154.1 | 84% | 0.835 | 87% | 0.868 | S | S | * | * | trans | -80.5 | 153.7 | -175 | 0 | 0 | 0 | 0 | 0 | 112.4 | G7 | A5-G7 PolarHBondContact O-N 3.18Š| ||
| 6 | L | 52.3 | Low | 46.8 | Very low | 179 Ų | 179 | 151.9 Ų | 151.9 | 94% | 0.937 | 86% | 0.859 | S | S | * | * | trans | -54.3 | 114 | 173.6 | -61 | 158.6 | 0 | 0 | 0 | 111.2 | ||||
| 7 | G | 39.8 | Very low | 47 | Very low | 77 Ų | 77 | 153 Ų | 153 | 79% | 0.794 | 86% | 0.855 | S | S | * | * | trans | -79.2 | 153.8 | 153.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | A5 | A5-G7 PolarHBondContact O-N 3.18Š| ||
| 8 | G | 43.7 | Very low | 47.3 | Very low | 75 Ų | 75 | 150.2 Ų | 150.2 | 77% | 0.773 | 85% | 0.845 | S | S | * | * | cis | 177.6 | 127.5 | 0.3 | 0 | 0 | 0 | 0 | 0 | 103.9 | ||||
| 9 | A | 49.4 | Very low | 47.2 | Very low | 94 Ų | 94 | 155.3 Ų | 155.3 | 78% | 0.777 | 85% | 0.849 | S | S | * | * | trans | -106 | 122.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | R11 | A9-R11 PolarHBondContact O-N 3.14Š| ||
| 10 | P | 45.5 | Very low | 47.2 | Very low | 128 Ų | 128 | 151.2 Ų | 151.2 | 83% | 0.831 | 85% | 0.845 | S | S | * | * | trans | -80 | 121.3 | 169 | 28.6 | -27.6 | 0 | 0 | 0 | 109.9 | L12 | P10-L12 PolarHBondContact O-N 2.92Š| ||
| 11 | R | 46.8 | Very low | 47.3 | Very low | 237 Ų | 237 | 149.6 Ų | 149.6 | 89% | 0.894 | 84% | 0.841 | S | S | * | * | trans | -72.1 | 115.3 | 173.7 | -74.6 | 178.6 | 153.8 | 169.5 | -6 | 110 | A9 L13 | A9-R11 PolarHBondContact O-N 3.14Å; R11-L13 PolarHBondContact O-N 3.05Å | ||
| 12 | L | 53.8 | Low | 47.3 | Very low | 160 Ų | 160 | 143.5 Ų | 143.5 | 84% | 0.838 | 82% | 0.821 | S | S | * | * | trans | -62.4 | 116.7 | 159.4 | -74.2 | 161.4 | 0 | 0 | 0 | 109.7 | P10 | P10-L12 PolarHBondContact O-N 2.92Š| ||
| 13 | L | 53 | Low | 47.4 | Very low | 150 Ų | 150 | 142.3 Ų | 142.3 | 79% | 0.785 | 82% | 0.815 | S | S | * | * | trans | -148.8 | 81.1 | 156.9 | -77.1 | -179.6 | 0 | 0 | 0 | 109.9 | R11 | R11-L13 PolarHBondContact O-N 3.05Š| ||
| 14 | S | 45 | Very low | 47.5 | Very low | 116 Ų | 116 | 139.3 Ų | 139.3 | 81% | 0.811 | 80% | 0.803 | S | S | * | * | trans | -72.5 | 115.6 | 152.8 | 43 | 0 | 0 | 0 | 0 | 108 | ||||
| 15 | R | 47.8 | Very low | 47.4 | Very low | 239 Ų | 239 | 143.7 Ų | 143.7 | 90% | 0.902 | 80% | 0.797 | S | S | * | * | trans | -121.5 | 135.7 | 166.1 | -100.2 | -170.9 | 177.2 | -156.6 | 0.4 | 110.7 | ||||
| 16 | V | 48 | Very low | 47.4 | Very low | 119 Ų | 119 | 147 Ų | 147 | 72% | 0.721 | 80% | 0.8 | S | S | * | * | trans | -85 | 135.7 | -167.1 | 152.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 17 | Q | 50.4 | Low | 46.9 | Very low | 171 Ų | 171 | 151.5 Ų | 151.5 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | trans | 54.4 | 178.2 | 146.1 | -75 | 177.9 | 42.9 | 0 | 0 | 119.9 | ||||
| 18 | P | 52.2 | Low | 46.9 | Very low | 103 Ų | 103 | 150.9 Ų | 150.9 | 67% | 0.669 | 80% | 0.798 | S | S | * | * | cis | -129.6 | 178.6 | -30.2 | 24.1 | -2.9 | 0 | 0 | 0 | 110.9 | ||||
| 19 | R | 45.3 | Very low | 47.2 | Very low | 246 Ų | 246 | 159.7 Ų | 159.7 | 93% | 0.928 | 81% | 0.808 | S | S | * | * | trans | 177.1 | 107.2 | 137.8 | -99.6 | 161.8 | 170.8 | 157.8 | -0.8 | 110.8 | ||||
| 20 | G | 47.7 | Very low | 46.8 | Very low | 74 Ų | 74 | 159 Ų | 159 | 76% | 0.763 | 81% | 0.81 | S | S | * | * | trans | -70 | 172 | 164.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 21 | P | 48.9 | Very low | 46.8 | Very low | 118 Ų | 118 | 157.6 Ų | 157.6 | 77% | 0.766 | 81% | 0.809 | S | S | * | * | -140.2 | 146.9 | 118.9 | 16.4 | 5.8 | 0 | 0 | 0 | 115.7 | |||||
| 22 | C | 41.9 | Very low | 46.8 | Very low | 109 Ų | 109 | 157.9 Ų | 157.9 | 74% | 0.736 | 81% | 0.81 | S | S | * | * | trans | 63.5 | 106 | 134.5 | -58.8 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 23 | L | 43.6 | Very low | 46.3 | Very low | 141 Ų | 141 | 155.9 Ų | 155.9 | 74% | 0.738 | 81% | 0.807 | S | S | * | * | 75 | 106.1 | 89.5 | -82 | 162.7 | 0 | 0 | 0 | 115 | |||||
| 24 | R | 43.4 | Very low | 46 | Very low | 181 Ų | 181 | 157.4 Ų | 157.4 | 68% | 0.683 | 81% | 0.81 | S | S | * | * | 59 | 121.9 | 127 | -76.7 | -175.8 | -161.1 | -105.5 | -3 | 120.4 | |||||
| 25 | R | 44.6 | Very low | 46 | Very low | 199 Ų | 199 | 159 Ų | 159 | 75% | 0.751 | 81% | 0.814 | S | S | * | * | 64.9 | 106.4 | 122.7 | -65.9 | 177.5 | -176.6 | -131 | -4 | 117.9 | |||||
| 26 | L | 51.9 | Low | 46.1 | Very low | 172 Ų | 172 | 151.7 Ų | 151.7 | 90% | 0.901 | 81% | 0.806 | S | S | * | * | trans | -150.1 | 72 | 140.4 | -78.7 | 178.9 | 0 | 0 | 0 | 110.4 | ||||
| 27 | W | 43.2 | Very low | 45.8 | Very low | 272 Ų | 272 | 149 Ų | 149 | 100% | 1.03 | 80% | 0.802 | S | S | * | * | trans | -117.7 | 96.3 | 159 | -82.2 | 45.9 | 0 | 0 | 0 | 106.8 | ||||
| 28 | G | 38.2 | Very low | 45.8 | Very low | 64 Ų | 64 | 151.1 Ų | 151.1 | 66% | 0.66 | 80% | 0.802 | S | S | * | * | trans | -159.2 | 135.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 29 | R | 49.9 | Very low | 45.6 | Very low | 260 Ų | 260 | 156.1 Ų | 156.1 | 98% | 0.981 | 81% | 0.808 | S | S | * | * | trans | 85.4 | 120 | -172.4 | -51.1 | 178.5 | -169.3 | -80.2 | 0.3 | 111.9 | ||||
| 30 | G | 42.3 | Very low | 45.7 | Very low | 80 Ų | 80 | 154.9 Ų | 154.9 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | cis | 144.1 | 114.6 | 10.8 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 31 | A | 45.1 | Very low | 45.3 | Very low | 98 Ų | 98 | 155.9 Ų | 155.9 | 81% | 0.81 | 81% | 0.805 | S | S | * | * | trans | -154.2 | 100.7 | 160.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | P33 | A31-P33 WeakPolarHBondContact O-CD 3.37Š| ||
| 32 | R | 45.8 | Very low | 45.2 | Very low | 243 Ų | 243 | 160.6 Ų | 160.6 | 92% | 0.917 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 125.3 | 160 | -78 | 169.8 | 113.3 | -177.4 | 2.9 | 107.3 | ||
| 33 | P | 44.9 | Very low | 45.4 | Very low | 119 Ų | 119 | 159.7 Ų | 159.7 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 126.6 | 151.7 | 19.5 | -10.5 | 0 | 0 | 0 | 108.4 | A31 V35 | A31-P33 WeakPolarHBondContact O-CD 3.37Å; P33-V35 PolarHBondContact O-N 3.29Å |
| 34 | E | 45.3 | Very low | 45.6 | Very low | 182 Ų | 182 | 165.2 Ų | 165.2 | 85% | 0.85 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 124.3 | 177.7 | -162.6 | 175.1 | 102.7 | 0 | 0 | 110.4 | A36 | E34-A36 PolarHBondContact O-N 3.33Š|
| 35 | V | 45.9 | Very low | 45.7 | Very low | 148 Ų | 148 | 159.5 Ų | 159.5 | 90% | 0.897 | 82% | 0.817 | S | S | * | * | trans | -92.1 | 90.6 | 173.4 | -124.2 | 0 | 0 | 0 | 0 | 107.2 | P33 | P33-V35 PolarHBondContact O-N 3.29Š| ||
| 36 | A | 48.5 | Very low | 45.9 | Very low | 87 Ų | 87 | 161.6 Ų | 161.6 | 72% | 0.719 | 82% | 0.824 | S | S | * | * | trans | -92 | 98.4 | 165.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | E34 | E34-A36 PolarHBondContact O-N 3.33Š| ||
| 37 | G | 43.7 | Very low | 46.1 | Very low | 62 Ų | 62 | 163.4 Ų | 163.4 | 64% | 0.639 | 82% | 0.819 | S | S | * | * | trans | -66.8 | 161.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 38 | R | 48.7 | Very low | 46.2 | Very low | 216 Ų | 216 | 161.3 Ų | 161.3 | 82% | 0.815 | 81% | 0.811 | S | S | * | * | -168.6 | 131 | 126 | -104.1 | 173.8 | -137.3 | -92.4 | 8 | 111.7 | |||||
| 39 | R | 48 | Very low | 46.8 | Very low | 208 Ų | 208 | 162.9 Ų | 162.9 | 79% | 0.785 | 81% | 0.812 | S | S | * | * | trans | 75.4 | 105.9 | 143.4 | -63.3 | -178.1 | -172.4 | -74.9 | 1.9 | 118 | ||||
| 40 | R | 48.3 | Very low | 46.8 | Very low | 219 Ų | 219 | 155.1 Ų | 155.1 | 83% | 0.826 | 80% | 0.798 | S | S | * | * | trans | -42.5 | 130.5 | 143.5 | -57.6 | 171.4 | -168.4 | -97.9 | -1 | 110.1 | ||||
| 41 | A | 39.5 | Very low | 47.3 | Very low | 96 Ų | 96 | 156.8 Ų | 156.8 | 79% | 0.793 | 80% | 0.797 | S | S | * | * | trans | -132.7 | 111 | 150.3 | 0 | 0 | 0 | 0 | 0 | 106.5 | A43 | A41-A43 PolarHBondContact O-N 3.38Š| ||
| 42 | W | 46.3 | Very low | 47.7 | Very low | 216 Ų | 216 | 160.7 Ų | 160.7 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -76.8 | 113.9 | 172.2 | -24.4 | -54 | 0 | 0 | 0 | 105.7 | ||||
| 43 | A | 45.6 | Very low | 48.1 | Very low | 90 Ų | 90 | 155.2 Ų | 155.2 | 74% | 0.744 | 79% | 0.794 | S | S | * | * | trans | -144.9 | 89 | 166 | 0 | 0 | 0 | 0 | 0 | 107.7 | A41 G45 | A41-A43 PolarHBondContact O-N 3.38Å; A43-G45 PolarHBondContact O-N 3.46Å; A43-G45 VanDerWaalsContact O-N 3.11Å | ||
| 44 | W | 48.5 | Very low | 48.2 | Very low | 257 Ų | 257 | 152.4 Ų | 152.4 | 97% | 0.973 | 79% | 0.787 | S | S | * | * | trans | -56.9 | 109.2 | 157.4 | -67.6 | 86.7 | 0 | 0 | 0 | 107.3 | ||||
| 45 | G | 45.3 | Very low | 48.8 | Very low | 62 Ų | 62 | 150.4 Ų | 150.4 | 64% | 0.639 | 79% | 0.79 | S | S | * | * | trans | -161.1 | 71.5 | -172.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | A43 | A43-G45 PolarHBondContact O-N 3.46Å; A43-G45 VanDerWaalsContact O-N 3.11Å | ||
| 46 | W | 48.2 | Very low | 49.1 | Very low | 242 Ų | 242 | 146 Ų | 146 | 92% | 0.917 | 78% | 0.775 | S | S | * | * | trans | 26 | 112.1 | 145.9 | -70.9 | 63.5 | 0 | 0 | 0 | 118.6 | ||||
| 47 | R | 56.1 | Low | 49.5 | Very low | 210 Ų | 210 | 148.1 Ų | 148.1 | 79% | 0.792 | 78% | 0.781 | S | S | * | * | trans | 42.3 | 100.4 | 136.2 | -171 | -174.4 | -69.6 | -90.7 | 2.7 | 116.6 | ||||
| 48 | R | 46.8 | Very low | 50.1 | Low | 229 Ų | 229 | 149.5 Ų | 149.5 | 86% | 0.864 | 79% | 0.786 | S | S | * | * | trans | -118.4 | 96.3 | 143.9 | -170.1 | 169.3 | -70.5 | -95.5 | -0.4 | 108 | S50 | R48-S50 PolarHBondContact O-N 2.96Å; R48-S50 VanDerWaalsContact O-N 3.14Å | ||
| 49 | S | 50.5 | Low | 50.7 | Low | 96 Ų | 96 | 143.7 Ų | 143.7 | 67% | 0.671 | 78% | 0.784 | S | S | * | * | trans | -63.5 | 105.8 | 161.9 | -82.8 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 50 | S | 49 | Very low | 51.5 | Low | 98 Ų | 98 | 138.1 Ų | 138.1 | 69% | 0.685 | 78% | 0.783 | S | S | * | * | trans | -122.2 | 104.2 | 160.2 | -90.2 | 0 | 0 | 0 | 0 | 107 | R48 E52 | R48-S50 PolarHBondContact O-N 2.96Å; R48-S50 VanDerWaalsContact O-N 3.14Å; S50-E52 PolarHBondContact O-N 3.33Å | ||
| 51 | S | 54.1 | Low | 52 | Low | 115 Ų | 115 | 136 Ų | 136 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | trans | -70.4 | 101.2 | 173.9 | -44.1 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 52 | E | 53.2 | Low | 52.9 | Low | 179 Ų | 179 | 134.4 Ų | 134.4 | 84% | 0.836 | 78% | 0.78 | S | S | * | * | trans | -136.6 | 97.2 | 158.8 | -67.7 | -160.2 | 107.9 | 0 | 0 | 108.8 | S50 G54 | S50-E52 PolarHBondContact O-N 3.33Å; E52-G54 PolarHBondContact O-N 3.09Å; E52-G54 VanDerWaalsContact O-N 3.12Å | ||
| 53 | P | 53.3 | Low | 53.8 | Low | 129 Ų | 129 | 134.7 Ų | 134.7 | 84% | 0.838 | 78% | 0.781 | S | S | * | * | trans | -74.7 | 96.2 | 164.7 | 19.9 | -10.3 | 0 | 0 | 0 | 107.6 | ||||
| 54 | G | 48.4 | Very low | 54.8 | Low | 60 Ų | 60 | 137.1 Ų | 137.1 | 62% | 0.619 | 79% | 0.786 | S | S | * | * | trans | -60.5 | 140.8 | 168.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | E52 G56 | E52-G54 PolarHBondContact O-N 3.09Å; E52-G54 VanDerWaalsContact O-N 3.12Å; G54-G56 PolarHBondContact O-N 2.89Å | ||
| 55 | P | 56 | Low | 55.7 | Low | 140 Ų | 140 | 130.9 Ų | 130.9 | 91% | 0.909 | 77% | 0.767 | S | S | * | * | trans | -77.2 | 72 | 175.6 | 32 | -32.2 | 0 | 0 | 0 | 109.4 | ||||
| 56 | G | 53.8 | Low | 56.8 | Low | 56 Ų | 56 | 131.2 Ų | 131.2 | 58% | 0.577 | 76% | 0.764 | S | S | * | * | trans | -75.4 | 138.9 | 161.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | G54 A58 | G54-G56 PolarHBondContact O-N 2.89Å; G56-A58 VanDerWaalsContact C-N 3.3Å; G56-A58 PolarHBondContact O-N 3.19Å | ||
| 57 | P | 56.1 | Low | 58.5 | Low | 131 Ų | 131 | 122.7 Ų | 122.7 | 85% | 0.851 | 75% | 0.745 | S | S | * | * | trans | -63.8 | 100.2 | 170.6 | 27.3 | -30.3 | 0 | 0 | 0 | 106.7 | A59 | P57-A59 VanDerWaalsContact C-N 3.35Å; P57-A59 PolarHBondContact O-N 2.95Å | ||
| 58 | A | 55.7 | Low | 60 | Low | 91 Ų | 91 | 118 Ų | 118 | 75% | 0.752 | 73% | 0.732 | S | S | * | * | trans | -53.8 | 109 | 164.1 | 0 | 0 | 0 | 0 | 0 | 105.1 | G56 A60 | G56-A58 VanDerWaalsContact C-N 3.3Å; G56-A58 PolarHBondContact O-N 3.19Å; A58-A60 PolarHBondContact O-N 3.15Å | ||
| 59 | A | 62.5 | Low | 62 | Low | 94 Ų | 94 | 111.2 Ų | 111.2 | 78% | 0.777 | 71% | 0.707 | S | S | * | * | trans | -57.7 | 93.7 | 169.7 | 0 | 0 | 0 | 0 | 0 | 105.7 | P57 L61 | P57-A59 VanDerWaalsContact C-N 3.35Å; P57-A59 PolarHBondContact O-N 2.95Å; A59-L61 PolarHBondContact O-N 3.38Å | ||
| 60 | A | 63.7 | Low | 63.9 | Low | 91 Ų | 91 | 111.3 Ų | 111.3 | 75% | 0.752 | 70% | 0.697 | S | S | * | * | trans | -59.2 | 106.5 | -179.3 | 0 | 0 | 0 | 0 | 0 | 105.9 | A58 G62 | A58-A60 PolarHBondContact O-N 3.15Å; A60-G62 PolarHBondContact O-N 3.37Å | ||
| 61 | L | 58.8 | Low | 65.8 | Low | 174 Ų | 174 | 108 Ų | 108 | 91% | 0.911 | 67% | 0.672 | S | S | * | * | trans | -53 | 114.8 | 171 | -64.2 | 174.4 | 0 | 0 | 0 | 105.9 | A59 R63 | A59-L61 PolarHBondContact O-N 3.38Å; L61-R63 PolarHBondContact O-N 3.38Å | ||
| 62 | G | 59.6 | Low | 67.6 | Low | 62 Ų | 62 | 105.2 Ų | 105.2 | 64% | 0.639 | 65% | 0.65 | S | S | * | * | trans | -49.8 | 133.3 | -162.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | A60 V64 | A60-G62 PolarHBondContact O-N 3.37Å; G62-V64 PolarHBondContact O-N 3.18Å | ||
| 63 | R | 65 | Low | 69.2 | Low | 223 Ų | 223 | 98 Ų | 98 | 84% | 0.842 | 62% | 0.615 | S | S | * | * | trans | -50.7 | 116 | 171.9 | -170.3 | 178 | -137.8 | 179.7 | 4 | 108.2 | L61 E65 | L61-R63 PolarHBondContact O-N 3.38Å; R63-E65 VanDerWaalsContact C-N 3.29Å; R63-E65 PolarHBondContact O-N 2.8Å | ||
| 64 | V | 66 | Low | 71.1 | Confident | 141 Ų | 141 | 96 Ų | 96 | 86% | 0.855 | 60% | 0.6 | S | S | * | * | trans | -69.7 | 93.6 | 174.7 | -178.5 | 0 | 0 | 0 | 0 | 106.6 | G62 | G62-V64 PolarHBondContact O-N 3.18Š| ||
| 65 | E | 67.8 | Low | 73.1 | Confident | 125 Ų | 125 | 93.2 Ų | 93.2 | 58% | 0.584 | 57% | 0.572 | S | S | * | * | trans | -65 | 138.4 | 172.6 | -63.8 | -158.8 | 116.7 | 0 | 0 | 109.3 | R63 A67 K88 | R63-E65 VanDerWaalsContact C-N 3.29Å; R63-E65 PolarHBondContact O-N 2.8Å; E65-A67 PolarHBondContact O-N 2.98Å; E65-K88 IonicContact OE1-NZ 3.12Å; E65-K88 PolarHBondContact OE1-NZ 3.38Å; E65-K88 IonicContact OE2-NZ 2.84Å; E65-K88 PolarHBondContact OE2-NZ 2.74Å | ||
| 66 | A | 69 | Low | 74.5 | Confident | 70 Ų | 70 | 92.5 Ų | 92.5 | 58% | 0.579 | 55% | 0.554 | S | S | * | * | trans | -55.1 | 113 | 175.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | H68 | A66-H68 PolarHBondContact O-N 3.36Š| ||
| 67 | A | 83 | Confident | 76.2 | Confident | 62 Ų | 62 | 95.1 Ų | 95.1 | 51% | 0.512 | 56% | 0.559 | S | S | . | * | S | Bend | trans | -68.1 | -18 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | E65 S87 K88 | E65-A67 PolarHBondContact O-N 2.98Å; A67-S87 WeakPolarHBondContact O-CA 3.18Å; A67-K88 PolarHBondContact O-N 2.83Å |
| 68 | H | 87.3 | Confident | 77.9 | Confident | 113 Ų | 113 | 91.3 Ų | 91.3 | 52% | 0.523 | 53% | 0.534 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.7 | 138.7 | -172.4 | -56.5 | -79.1 | 0 | 0 | 0 | 112.7 | A66 I86 | A66-H68 PolarHBondContact O-N 3.36Å; H68-I86 CarbonylContact C-O 3.49Å; H68-I86 WeakPolarHBondContact CA-O 3.46Å |
| 69 | Y | 88.7 | Confident | 79.6 | Confident | 85 Ų | 85 | 89.8 Ų | 89.8 | 33% | 0.333 | 53% | 0.528 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.3 | 151.1 | 167.2 | -63 | -51 | 0 | 0 | 0 | 111.3 | R85 I86 K88 Y91 H92 | Y69-R85 WeakPolarHBondContact O-CA 3.17Å; Y69-I86 PolarHBondContact N-O 3.4Å; Y69-I86 PolarHBondContact O-N 2.97Å; Y69-K88 HydrophobicContact CD2-CB 4.3Å; Y69-K88 HydrophobicContact CE2-CB 3.86Å; Y69-K88 HydrophobicContact CE2-CG 3.71Å; Y69-K88 WeakPolarHBondContact OH-CE 3.43Å; Y69-K88 WeakPolarHBondContact OH-CG 3.42Å; Y69-Y91 HydrophobicContact CD2-CD1 4.49Å; Y69-Y91 HydrophobicContact CD2-CG 4.38Å; Y69-Y91 HydrophobicContact CE2-CD1 4.18Å; Y69-Y91 HydrophobicContact CE2-CG 4.46Å; Y69-H92 AromaticContact CE2-NE2 3.72Å; Y69-H92 AromaticContact CZ-NE2 3.85Å; Y69-H92 PolarHBondContact OH-NE2 2.88Å; Y69-H92 VanDerWaalsContact OH-NE2 3.07Å |
| 70 | Q | 90.2 | Very high | 81 | Confident | 99 Ų | 99 | 87.6 Ų | 87.6 | 46% | 0.463 | 51% | 0.505 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.4 | 109.5 | 167 | -174.5 | 69 | 15.3 | 0 | 0 | 108.5 | ||
| 71 | L | 89.6 | Confident | 82.4 | Confident | 29 Ų | 29 | 88.8 Ų | 88.8 | 15% | 0.152 | 49% | 0.49 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | 128.6 | 173.8 | 178.4 | 73 | 0 | 0 | 0 | 109.1 | Y73 S83 K84 I86 V98 I109 | L71-Y73 HydrophobicContact CD2-CD1 3.98Å; L71-Y73 HydrophobicContact CG-CD1 4.28Å; L71-S83 CarbonylContact O-C 3.47Å; L71-S83 WeakPolarHBondContact O-CA 3.15Å; L71-K84 PolarHBondContact N-O 2.84Å; L71-K84 PolarHBondContact O-N 2.86Å; L71-I86 HydrophobicContact CB-CD1 4.1Å; L71-I86 HydrophobicContact CB-CG1 4.42Å; L71-I86 HydrophobicContact CB-CG2 4.49Å; L71-V98 HydrophobicContact CD2-CG1 4.27Å; L71-I109 HydrophobicContact CD1-CG2 4.12Å; L71-I109 HydrophobicContact CD2-CB 4.35Å; L71-I109 HydrophobicContact CD2-CD1 3.96Å; L71-I109 HydrophobicContact CD2-CG1 3.74Å; L71-I109 HydrophobicContact CD2-CG2 3.73Å |
| 72 | V | 91.1 | Very high | 83.9 | Confident | 56 Ų | 56 | 81.3 Ų | 81.3 | 34% | 0.339 | 45% | 0.452 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 119.9 | 167.1 | -177.4 | 0 | 0 | 0 | 0 | 107.4 | R81 | V72-R81 HydrophobicContact CG1-CG 4.08Å; V72-R81 VanDerWaalsContact CG1-NE 3.27Å |
| 73 | Y | 88.4 | Confident | 85.4 | Confident | 26 Ų | 26 | 81.7 Ų | 81.7 | 10% | 0.102 | 45% | 0.445 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.8 | 155.6 | -177.5 | 76 | -80.5 | 0 | 0 | 0 | 111.2 | L71 R81 S82 K84 V98 C100 | L71-Y73 HydrophobicContact CD2-CD1 3.98Å; L71-Y73 HydrophobicContact CG-CD1 4.28Å; Y73-R81 CarbonylContact O-C 3.6Å; Y73-R81 WeakPolarHBondContact O-CA 3.38Å; Y73-S82 WeakPolarHBondContact CD1-O 3.37Å; Y73-S82 PolarHBondContact N-O 2.81Å; Y73-S82 PolarHBondContact O-N 2.82Å; Y73-K84 HydrophobicContact CE1-CG 4.26Å; Y73-V98 HydrophobicContact CD1-CG2 4.36Å; Y73-V98 HydrophobicContact CE1-CB 4.26Å; Y73-V98 HydrophobicContact CE1-CG2 3.64Å; Y73-V98 HydrophobicContact CE2-CG2 4.03Å; Y73-V98 VanDerWaalsContact CZ-CG2 3.44Å; Y73-V98 WeakPolarHBondContact OH-CG2 3Å; Y73-C100 WeakPolarHBondContact OH-CA 2.8Å |
| 74 | T | 92.1 | Very high | 86.7 | Confident | 87 Ų | 87 | 75.1 Ų | 75.1 | 53% | 0.534 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.7 | 127.1 | 171.8 | 47.3 | 0 | 0 | 0 | 0 | 108.9 | K76 R81 | T74-K76 PolarHBondContact O-N 2.97Å; T74-R81 HydrophobicContact CG2-CB 3.94Å; T74-R81 HydrophobicContact CG2-CG 3.88Å |
| 75 | C | 90.6 | Very high | 87.9 | Confident | 3 Ų | 3 | 77.9 Ų | 77.9 | 2% | 0.02 | 42% | 0.418 | C | S | . | . | trans | -71.6 | 123.6 | 176 | 175.7 | 0 | 0 | 0 | 0 | 110 | V77 C78 G79 T80 C100 C103 H107 | C75-V77 VanDerWaalsContact C-N 3.26Å; C75-V77 PolarHBondContact O-N 3.4Å; C75-V77 PolarHBondContact SG-N 3.05Å; C75-V77 VanDerWaalsContact SG-N 3.38Å; C75-C78 VanDerWaalsContact CB-SG 3.56Å; C75-C78 PolarHBondContact SG-SG 2.79Å; C75-G79 WeakPolarHBondContact O-CA 3.39Å; C75-G79 PolarHBondContact O-N 2.91Å; C75-T80 PolarHBondContact N-O 2.99Å; C75-C100 HydrophobicContact CB-CB 4.45Å; C75-C100 VanDerWaalsContact CB-SG 3.56Å; C75-C103 VanDerWaalsContact SG-SG 3.69Å; C75-H107 PolarHBondContact SG-CE1 3.47Å; C75-H107 PolarHBondContact SG-NE2 3.34Å | ||
| 76 | K | 86.6 | Confident | 89.1 | Confident | 124 Ų | 124 | 72.7 Ų | 72.7 | 54% | 0.539 | 39% | 0.394 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.9 | -20.9 | 177.6 | -63.9 | -163.5 | 175.1 | -163.8 | 0 | 113.5 | T74 E134 | T74-K76 PolarHBondContact O-N 2.97Å; K76-E134 VanDerWaalsContact NZ-CD 3.29Å; K76-E134 IonicContact NZ-OE1 2.8Å; K76-E134 PolarHBondContact NZ-OE1 3.04Å; K76-E134 IonicContact NZ-OE2 2.87Å; K76-E134 PolarHBondContact NZ-OE2 3.21Å |
| 77 | V | 89 | Confident | 90.1 | Very high | 112 Ų | 112 | 71.5 Ų | 71.5 | 68% | 0.679 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.5 | -44.2 | -179.5 | -176.1 | 0 | 0 | 0 | 0 | 111.8 | C75 | C75-V77 VanDerWaalsContact C-N 3.26Å; C75-V77 PolarHBondContact O-N 3.4Å; C75-V77 PolarHBondContact SG-N 3.05Å; C75-V77 VanDerWaalsContact SG-N 3.38Å |
| 78 | C | 92.3 | Very high | 90.4 | Very high | 50 Ų | 50 | 70.8 Ų | 70.8 | 34% | 0.338 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119.3 | 2.8 | -174 | 63.4 | 0 | 0 | 0 | 0 | 114.6 | C75 T80 C103 | C75-C78 VanDerWaalsContact CB-SG 3.56Å; C75-C78 PolarHBondContact SG-SG 2.79Å; C78-T80 PolarHBondContact O-N 3.17Å; C78-T80 PolarHBondContact SG-OG1 3.3Å; C78-C103 HydrophobicContact CB-CB 4.18Å |
| 79 | G | 90 | Very high | 90.6 | Very high | 59 Ų | 59 | 71.2 Ų | 71.2 | 61% | 0.608 | 37% | 0.372 | S | S | * | . | trans | 67.9 | -4.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | C75 R81 | C75-G79 WeakPolarHBondContact O-CA 3.39Å; C75-G79 PolarHBondContact O-N 2.91Å; G79-R81 PolarHBondContact O-N 2.86Å | ||
| 80 | T | 93.1 | Very high | 90.6 | Very high | 49 Ų | 49 | 68.5 Ų | 68.5 | 30% | 0.301 | 37% | 0.367 | S | S | . | . | trans | -70.1 | 126.7 | -174.5 | -56.6 | 0 | 0 | 0 | 0 | 111 | C75 C78 P101 | C75-T80 PolarHBondContact N-O 2.99Å; C78-T80 PolarHBondContact O-N 3.17Å; C78-T80 PolarHBondContact SG-OG1 3.3Å; T80-P101 HydrophobicContact CG2-CG 4.09Å | ||
| 81 | R | 92.4 | Very high | 90.4 | Very high | 115 Ų | 115 | 65.2 Ų | 65.2 | 43% | 0.434 | 35% | 0.351 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.4 | 130.3 | 173 | -168 | 176.1 | -176.3 | -168.6 | -1 | 110 | V72 Y73 T74 G79 | V72-R81 HydrophobicContact CG1-CG 4.08Å; V72-R81 VanDerWaalsContact CG1-NE 3.27Å; Y73-R81 CarbonylContact O-C 3.6Å; Y73-R81 WeakPolarHBondContact O-CA 3.38Å; T74-R81 HydrophobicContact CG2-CB 3.94Å; T74-R81 HydrophobicContact CG2-CG 3.88Å; G79-R81 PolarHBondContact O-N 2.86Å |
| 82 | S | 89.7 | Confident | 90.3 | Very high | 18 Ų | 18 | 68 Ų | 68 | 13% | 0.126 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.5 | 150.3 | 177.1 | -165.4 | 0 | 0 | 0 | 0 | 111.4 | Y73 | Y73-S82 WeakPolarHBondContact CD1-O 3.37Å; Y73-S82 PolarHBondContact N-O 2.81Å; Y73-S82 PolarHBondContact O-N 2.82Å |
| 83 | S | 91.7 | Very high | 90 | Very high | 69 Ų | 69 | 72 Ų | 72 | 48% | 0.483 | 38% | 0.378 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 129.7 | 177.5 | 69.1 | 0 | 0 | 0 | 0 | 110.8 | L71 | L71-S83 CarbonylContact O-C 3.47Å; L71-S83 WeakPolarHBondContact O-CA 3.15Å |
| 84 | K | 92.3 | Very high | 89.9 | Confident | 85 Ų | 85 | 71.3 Ų | 71.3 | 37% | 0.37 | 38% | 0.379 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.3 | 145.6 | -178.3 | -62.3 | -67.3 | -177.8 | 175.5 | 0 | 110.4 | L71 Y73 V98 | L71-K84 PolarHBondContact N-O 2.84Å; L71-K84 PolarHBondContact O-N 2.86Å; Y73-K84 HydrophobicContact CE1-CG 4.26Å; K84-V98 HydrophobicContact CG-CG1 4.38Å |
| 85 | R | 91.6 | Very high | 89.8 | Confident | 200 Ų | 200 | 68.9 Ų | 68.9 | 76% | 0.755 | 36% | 0.364 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -91.1 | 125.3 | 172.4 | -69.1 | 176.6 | 93.4 | 159.9 | 5.4 | 108.9 | Y69 | Y69-R85 WeakPolarHBondContact O-CA 3.17Å |
| 86 | I | 92 | Very high | 89.8 | Confident | 16 Ų | 16 | 69.2 Ų | 69.2 | 8% | 0.082 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125 | 149.4 | -178.3 | 64 | 174.3 | 0 | 0 | 0 | 109.4 | H68 Y69 L71 Y91 V96 | H68-I86 CarbonylContact C-O 3.49Å; H68-I86 WeakPolarHBondContact CA-O 3.46Å; Y69-I86 PolarHBondContact N-O 3.4Å; Y69-I86 PolarHBondContact O-N 2.97Å; L71-I86 HydrophobicContact CB-CD1 4.1Å; L71-I86 HydrophobicContact CB-CG1 4.42Å; L71-I86 HydrophobicContact CB-CG2 4.49Å; I86-Y91 HydrophobicContact CD1-CD2 3.8Å; I86-Y91 HydrophobicContact CD1-CG 4.38Å; I86-V96 HydrophobicContact CB-CG1 4.39Å; I86-V96 HydrophobicContact CG2-CG1 3.87Å |
| 87 | S | 90.6 | Very high | 90 | Very high | 45 Ų | 45 | 67 Ų | 67 | 32% | 0.315 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77 | 145.3 | 176.7 | 58 | 0 | 0 | 0 | 0 | 111.3 | A67 L89 A90 Y91 | A67-S87 WeakPolarHBondContact O-CA 3.18Å; S87-L89 VanDerWaalsContact C-N 3.31Å; S87-L89 PolarHBondContact O-N 3.23Å; S87-A90 PolarHBondContact O-N 2.9Å; S87-A90 WeakPolarHBondContact OG-CB 3.21Å; S87-A90 PolarHBondContact OG-N 2.86Å; S87-Y91 PolarHBondContact O-N 3.14Å |
| 88 | K | 89.9 | Confident | 90.1 | Very high | 46 Ų | 46 | 62.2 Ų | 62.2 | 20% | 0.2 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -58.6 | -44.5 | 177.6 | 176.7 | 173.2 | -178.3 | -165.7 | 0 | 111.4 | E65 A67 Y69 Y91 H92 | E65-K88 IonicContact OE1-NZ 3.12Å; E65-K88 PolarHBondContact OE1-NZ 3.38Å; E65-K88 IonicContact OE2-NZ 2.84Å; E65-K88 PolarHBondContact OE2-NZ 2.74Å; A67-K88 PolarHBondContact O-N 2.83Å; Y69-K88 HydrophobicContact CD2-CB 4.3Å; Y69-K88 HydrophobicContact CE2-CB 3.86Å; Y69-K88 HydrophobicContact CE2-CG 3.71Å; Y69-K88 WeakPolarHBondContact OH-CE 3.43Å; Y69-K88 WeakPolarHBondContact OH-CG 3.42Å; K88-Y91 PolarHBondContact O-N 3.11Å; K88-H92 PolarHBondContact O-CD2 3.04Å; K88-H92 PolarHBondContact O-N 2.96Å |
| 89 | L | 89.7 | Confident | 90.2 | Very high | 122 Ų | 122 | 63 Ų | 63 | 64% | 0.639 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -62.9 | -43.6 | 179.9 | -64.5 | 178.4 | 0 | 0 | 0 | 112.5 | S87 Y91 H92 Q93 | S87-L89 VanDerWaalsContact C-N 3.31Å; S87-L89 PolarHBondContact O-N 3.23Å; L89-Y91 VanDerWaalsContact C-N 3.28Å; L89-Y91 PolarHBondContact O-N 3.24Å; L89-H92 PolarHBondContact O-N 3.39Å; L89-Q93 WeakPolarHBondContact O-CB 3.25Å; L89-Q93 PolarHBondContact O-N 2.92Å |
| 90 | A | 88.8 | Confident | 90.3 | Very high | 28 Ų | 28 | 60.1 Ų | 60.1 | 23% | 0.231 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -65.2 | -35 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | S87 G94 V96 | S87-A90 PolarHBondContact O-N 2.9Å; S87-A90 WeakPolarHBondContact OG-CB 3.21Å; S87-A90 PolarHBondContact OG-N 2.86Å; A90-G94 CarbonylContact O-C 3.36Å; A90-G94 VanDerWaalsContact O-CA 3.27Å; A90-G94 WeakPolarHBondContact O-CA 3.25Å; A90-G94 PolarHBondContact O-N 2.87Å; A90-G94 VanDerWaalsContact O-N 3.07Å; A90-V96 HydrophobicContact CB-CG2 3.8Å |
| 91 | Y | 87.8 | Confident | 90.3 | Very high | 30 Ų | 30 | 61.6 Ų | 61.6 | 12% | 0.118 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -66.8 | -39.2 | 177.3 | -175.1 | -97.6 | 0 | 0 | 0 | 113 | Y69 I86 S87 K88 L89 I109 A110 N112 I125 | Y69-Y91 HydrophobicContact CD2-CD1 4.49Å; Y69-Y91 HydrophobicContact CD2-CG 4.38Å; Y69-Y91 HydrophobicContact CE2-CD1 4.18Å; Y69-Y91 HydrophobicContact CE2-CG 4.46Å; I86-Y91 HydrophobicContact CD1-CD2 3.8Å; I86-Y91 HydrophobicContact CD1-CG 4.38Å; S87-Y91 PolarHBondContact O-N 3.14Å; K88-Y91 PolarHBondContact O-N 3.11Å; L89-Y91 VanDerWaalsContact C-N 3.28Å; L89-Y91 PolarHBondContact O-N 3.24Å; Y91-I109 HydrophobicContact CE2-CG2 4.42Å; Y91-A110 HydrophobicContact CD2-CB 4.22Å; Y91-A110 HydrophobicContact CE2-CB 4.5Å; Y91-N112 PolarHBondContact O-ND2 3.42Å; Y91-I125 HydrophobicContact CE2-CD1 4.49Å |
| 92 | H | 85.9 | Confident | 90.4 | Very high | 89 Ų | 89 | 57.9 Ų | 57.9 | 41% | 0.412 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -91.3 | -34 | -176 | -70.6 | -66.9 | 0 | 0 | 0 | 114.6 | Y69 K88 L89 N112 | Y69-H92 AromaticContact CE2-NE2 3.72Å; Y69-H92 AromaticContact CZ-NE2 3.85Å; Y69-H92 PolarHBondContact OH-NE2 2.88Å; Y69-H92 VanDerWaalsContact OH-NE2 3.07Å; K88-H92 PolarHBondContact O-CD2 3.04Å; K88-H92 PolarHBondContact O-N 2.96Å; L89-H92 PolarHBondContact O-N 3.39Å; H92-N112 VanDerWaalsContact C-ND2 3.35Å; H92-N112 PolarHBondContact O-ND2 2.9Å |
| 93 | Q | 86.3 | Confident | 90.5 | Very high | 138 Ų | 138 | 58.3 Ų | 58.3 | 65% | 0.645 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -121.3 | -6.1 | -170 | -62.6 | -177.7 | -44.5 | 0 | 0 | 113.2 | L89 | L89-Q93 WeakPolarHBondContact O-CB 3.25Å; L89-Q93 PolarHBondContact O-N 2.92Å |
| 94 | G | 86.6 | Confident | 90.4 | Very high | 13 Ų | 13 | 62.4 Ų | 62.4 | 13% | 0.134 | 33% | 0.326 | C | S | . | . | S | Bend | trans | -128.6 | -161.6 | -174 | 0 | 0 | 0 | 0 | 0 | 113.6 | A90 N112 | A90-G94 CarbonylContact O-C 3.36Å; A90-G94 VanDerWaalsContact O-CA 3.27Å; A90-G94 WeakPolarHBondContact O-CA 3.25Å; A90-G94 PolarHBondContact O-N 2.87Å; A90-G94 VanDerWaalsContact O-N 3.07Å; G94-N112 PolarHBondContact O-N 3.07Å; G94-N112 PolarHBondContact O-ND2 3.19Å |
| 95 | V | 88.3 | Confident | 90.3 | Very high | 35 Ų | 35 | 62.9 Ų | 62.9 | 21% | 0.212 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 132.4 | 175.1 | -172.4 | 0 | 0 | 0 | 0 | 108.7 | I97 A110 D111 L113 F116 | V95-I97 HydrophobicContact CG1-CD1 4.3Å; V95-I97 HydrophobicContact CG1-CG1 4.02Å; V95-A110 CarbonylContact C-O 3.42Å; V95-A110 WeakPolarHBondContact CA-O 3.5Å; V95-A110 WeakPolarHBondContact CG1-O 3.46Å; V95-D111 HydrophobicContact CG1-CB 4.32Å; V95-D111 VanDerWaalsContact CG2-OD1 3.29Å; V95-D111 WeakPolarHBondContact CG2-OD1 3.38Å; V95-L113 HydrophobicContact CG2-CB 3.99Å; V95-L113 HydrophobicContact CG2-CD1 4.2Å; V95-L113 HydrophobicContact CG2-CG 4.25Å; V95-F116 HydrophobicContact CG1-CE2 4.12Å |
| 96 | V | 91 | Very high | 90.2 | Very high | 11 Ų | 11 | 59.7 Ų | 59.7 | 7% | 0.067 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 117.1 | 177.5 | -179.4 | 0 | 0 | 0 | 0 | 108.9 | I86 A90 V98 I109 A110 | I86-V96 HydrophobicContact CB-CG1 4.39Å; I86-V96 HydrophobicContact CG2-CG1 3.87Å; A90-V96 HydrophobicContact CB-CG2 3.8Å; V96-V98 HydrophobicContact CG1-CG1 4.35Å; V96-I109 HydrophobicContact CB-CB 4.2Å; V96-I109 HydrophobicContact CG1-CB 4.06Å; V96-I109 HydrophobicContact CG1-CG1 4.44Å; V96-I109 HydrophobicContact CG1-CG2 4.49Å; V96-I109 PolarHBondContact O-N 3.39Å; V96-A110 HydrophobicContact CB-CB 4.34Å; V96-A110 HydrophobicContact CG2-CB 4.36Å; V96-A110 PolarHBondContact N-O 3.05Å; V96-A110 PolarHBondContact O-N 2.98Å |
| 97 | I | 91.4 | Very high | 90 | Very high | 78 Ų | 78 | 60.8 Ų | 60.8 | 40% | 0.4 | 33% | 0.331 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.9 | 129.1 | 178.1 | -55.3 | 176.1 | 0 | 0 | 0 | 108 | V95 H106 H107 F116 | V95-I97 HydrophobicContact CG1-CD1 4.3Å; V95-I97 HydrophobicContact CG1-CG1 4.02Å; I97-H106 HydrophobicContact CG2-CB 3.63Å; I97-H107 WeakPolarHBondContact CA-O 3.01Å; I97-F116 HydrophobicContact CD1-CE2 4.03Å; I97-F116 HydrophobicContact CD1-CZ 3.91Å |
| 98 | V | 91.6 | Very high | 89.8 | Confident | 10 Ų | 10 | 61.6 Ų | 61.6 | 6% | 0.061 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.9 | 136.2 | 178.9 | -60.6 | 0 | 0 | 0 | 0 | 110.6 | L71 Y73 K84 V96 H107 I109 | L71-V98 HydrophobicContact CD2-CG1 4.27Å; Y73-V98 HydrophobicContact CD1-CG2 4.36Å; Y73-V98 HydrophobicContact CE1-CB 4.26Å; Y73-V98 HydrophobicContact CE1-CG2 3.64Å; Y73-V98 HydrophobicContact CE2-CG2 4.03Å; Y73-V98 VanDerWaalsContact CZ-CG2 3.44Å; Y73-V98 WeakPolarHBondContact OH-CG2 3Å; K84-V98 HydrophobicContact CG-CG1 4.38Å; V96-V98 HydrophobicContact CG1-CG1 4.35Å; V98-H107 HydrophobicContact CG2-CB 3.97Å; V98-H107 PolarHBondContact N-O 3.45Å; V98-H107 PolarHBondContact O-N 2.79Å; V98-I109 HydrophobicContact CB-CG1 4.36Å; V98-I109 HydrophobicContact CG1-CG1 3.88Å; V98-I109 HydrophobicContact CG2-CD1 3.69Å; V98-I109 HydrophobicContact CG2-CG1 3.6Å |
| 99 | T | 93.5 | Very high | 89.7 | Confident | 66 Ų | 66 | 60.1 Ų | 60.1 | 41% | 0.405 | 33% | 0.325 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.4 | 122.2 | 172.4 | -50.1 | 0 | 0 | 0 | 0 | 109.4 | H106 | T99-H106 PolarHBondContact OG1-CE1 3Å; T99-H106 PolarHBondContact OG1-ND1 2.7Å |
| 100 | C | 92.9 | Very high | 89.5 | Confident | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 30% | 0.295 | C | S | . | . | trans | -76.9 | 132.6 | 174.9 | 180 | 0 | 0 | 0 | 0 | 110.5 | Y73 C75 G102 C103 Q104 N105 H107 | Y73-C100 WeakPolarHBondContact OH-CA 2.8Å; C75-C100 HydrophobicContact CB-CB 4.45Å; C75-C100 VanDerWaalsContact CB-SG 3.56Å; C100-G102 PolarHBondContact O-N 2.8Å; C100-G102 PolarHBondContact SG-N 3.12Å; C100-G102 VanDerWaalsContact SG-N 3.38Å; C100-C103 VanDerWaalsContact CB-SG 3.6Å; C100-Q104 WeakPolarHBondContact O-CA 3.47Å; C100-Q104 PolarHBondContact O-N 2.87Å; C100-N105 PolarHBondContact N-O 2.85Å; C100-H107 WeakPolarHBondContact CB-CD2 3.37Å; C100-H107 WeakPolarHBondContact CB-NE2 3.17Å | ||
| 101 | P | 93.2 | Very high | 89.3 | Confident | 79 Ų | 79 | 54.1 Ų | 54.1 | 51% | 0.513 | 29% | 0.29 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.6 | -21.5 | 176.7 | 28 | -34.7 | 0 | 0 | 0 | 113.6 | T80 | T80-P101 HydrophobicContact CG2-CG 4.09Š|
| 102 | G | 92.6 | Very high | 88.9 | Confident | 38 Ų | 38 | 55.4 Ų | 55.4 | 39% | 0.392 | 30% | 0.299 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80 | -58.7 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113 | C100 | C100-G102 PolarHBondContact O-N 2.8Å; C100-G102 PolarHBondContact SG-N 3.12Å; C100-G102 VanDerWaalsContact SG-N 3.38Å |
| 103 | C | 91.7 | Very high | 88.5 | Confident | 27 Ų | 27 | 56.3 Ų | 56.3 | 18% | 0.182 | 31% | 0.306 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.9 | -4 | -178.5 | 59.1 | 0 | 0 | 0 | 0 | 114.4 | C75 C78 C100 N105 H107 | C75-C103 VanDerWaalsContact SG-SG 3.69Å; C78-C103 HydrophobicContact CB-CB 4.18Å; C100-C103 VanDerWaalsContact CB-SG 3.6Å; C103-N105 PolarHBondContact O-N 3.15Å; C103-H107 PolarHBondContact SG-NE2 2.82Å |
| 104 | Q | 90.7 | Very high | 87.7 | Confident | 154 Ų | 154 | 52 Ų | 52 | 72% | 0.72 | 30% | 0.299 | S | S | * | . | trans | 56.8 | 3.7 | -176.8 | -61.6 | 172 | 24.3 | 0 | 0 | 115.1 | C100 | C100-Q104 WeakPolarHBondContact O-CA 3.47Å; C100-Q104 PolarHBondContact O-N 2.87Å | ||
| 105 | N | 89.6 | Confident | 86.8 | Confident | 96 Ų | 96 | 60.6 Ų | 60.6 | 51% | 0.513 | 33% | 0.327 | S | S | . | . | trans | -83.3 | 159.4 | 176.3 | -68.1 | -35.1 | 0 | 0 | 0 | 111.1 | C100 C103 H107 | C100-N105 PolarHBondContact N-O 2.85Å; C103-N105 PolarHBondContact O-N 3.15Å; N105-H107 PolarHBondContact O-CD2 2.83Å | ||
| 106 | H | 89.8 | Confident | 85.5 | Confident | 133 Ų | 133 | 62.4 Ų | 62.4 | 62% | 0.616 | 33% | 0.332 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86.1 | 123.9 | 176.8 | -63.1 | -64.3 | 0 | 0 | 0 | 110.3 | I97 T99 | I97-H106 HydrophobicContact CG2-CB 3.63Å; T99-H106 PolarHBondContact OG1-CE1 3Å; T99-H106 PolarHBondContact OG1-ND1 2.7Å |
| 107 | H | 88 | Confident | 83.8 | Confident | 38 Ų | 38 | 66.7 Ų | 66.7 | 18% | 0.176 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.6 | 130.1 | 173 | -64.3 | -84.5 | 0 | 0 | 0 | 109.7 | C75 I97 V98 C100 C103 N105 | C75-H107 PolarHBondContact SG-CE1 3.47Å; C75-H107 PolarHBondContact SG-NE2 3.34Å; I97-H107 WeakPolarHBondContact CA-O 3.01Å; V98-H107 HydrophobicContact CG2-CB 3.97Å; V98-H107 PolarHBondContact N-O 3.45Å; V98-H107 PolarHBondContact O-N 2.79Å; C100-H107 WeakPolarHBondContact CB-CD2 3.37Å; C100-H107 WeakPolarHBondContact CB-NE2 3.17Å; C103-H107 PolarHBondContact SG-NE2 2.82Å; N105-H107 PolarHBondContact O-CD2 2.83Å |
| 108 | I | 87.5 | Confident | 82.1 | Confident | 63 Ų | 63 | 70.3 Ų | 70.3 | 32% | 0.323 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.3 | 127.7 | 176.2 | -59.4 | 159.8 | 0 | 0 | 0 | 108.1 | D111 F116 L119 | I108-D111 HydrophobicContact CG2-CB 4.15Å; I108-F116 HydrophobicContact CD1-CB 4.18Å; I108-F116 HydrophobicContact CD1-CD1 3.74Å; I108-F116 HydrophobicContact CD1-CD2 3.46Å; I108-F116 VanDerWaalsContact CD1-CD2 3.46Å; I108-F116 HydrophobicContact CD1-CE1 3.93Å; I108-F116 HydrophobicContact CD1-CE2 3.66Å; I108-F116 HydrophobicContact CD1-CG 3.5Å; I108-F116 HydrophobicContact CD1-CZ 3.89Å; I108-F116 HydrophobicContact CG1-CD2 4.14Å; I108-F116 HydrophobicContact CG1-CE2 3.94Å; I108-F116 HydrophobicContact CG1-CZ 4.25Å; I108-F116 HydrophobicContact CG2-CD2 4.49Å; I108-L119 HydrophobicContact CD1-CD1 4.13Å |
| 109 | I | 87.4 | Confident | 80.4 | Confident | 15 Ų | 15 | 74.1 Ų | 74.1 | 8% | 0.077 | 40% | 0.403 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.1 | -45.5 | -179.7 | -56.6 | -56.7 | 0 | 0 | 0 | 109.8 | L71 Y91 V96 V98 I125 | L71-I109 HydrophobicContact CD1-CG2 4.12Å; L71-I109 HydrophobicContact CD2-CB 4.35Å; L71-I109 HydrophobicContact CD2-CD1 3.96Å; L71-I109 HydrophobicContact CD2-CG1 3.74Å; L71-I109 HydrophobicContact CD2-CG2 3.73Å; Y91-I109 HydrophobicContact CE2-CG2 4.42Å; V96-I109 HydrophobicContact CB-CB 4.2Å; V96-I109 HydrophobicContact CG1-CB 4.06Å; V96-I109 HydrophobicContact CG1-CG1 4.44Å; V96-I109 HydrophobicContact CG1-CG2 4.49Å; V96-I109 PolarHBondContact O-N 3.39Å; V98-I109 HydrophobicContact CB-CG1 4.36Å; V98-I109 HydrophobicContact CG1-CG1 3.88Å; V98-I109 HydrophobicContact CG2-CD1 3.69Å; V98-I109 HydrophobicContact CG2-CG1 3.6Å; I109-I125 HydrophobicContact CB-CD1 4.35Å; I109-I125 HydrophobicContact CG2-CD1 3.47Å; I109-I125 VanDerWaalsContact CG2-CD1 3.47Å; I109-I125 WeakPolarHBondContact O-CD1 3.47Å; I109-I125 WeakPolarHBondContact O-CG1 3.46Å |
| 110 | A | 85.4 | Confident | 78.4 | Confident | 1 Ų | 1 | 78.1 Ų | 78.1 | 1% | 0.008 | 42% | 0.422 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138 | 137.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | Y91 V95 V96 | Y91-A110 HydrophobicContact CD2-CB 4.22Å; Y91-A110 HydrophobicContact CE2-CB 4.5Å; V95-A110 CarbonylContact C-O 3.42Å; V95-A110 WeakPolarHBondContact CA-O 3.5Å; V95-A110 WeakPolarHBondContact CG1-O 3.46Å; V96-A110 HydrophobicContact CB-CB 4.34Å; V96-A110 HydrophobicContact CG2-CB 4.36Å; V96-A110 PolarHBondContact N-O 3.05Å; V96-A110 PolarHBondContact O-N 2.98Å |
| 111 | D | 83.9 | Confident | 76.4 | Confident | 23 Ų | 23 | 80.9 Ų | 80.9 | 12% | 0.123 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.6 | 85.1 | 170.2 | -179.4 | 14 | 0 | 0 | 0 | 109.1 | V95 I108 L113 G114 W115 F116 | V95-D111 HydrophobicContact CG1-CB 4.32Å; V95-D111 VanDerWaalsContact CG2-OD1 3.29Å; V95-D111 WeakPolarHBondContact CG2-OD1 3.38Å; I108-D111 HydrophobicContact CG2-CB 4.15Å; D111-L113 VanDerWaalsContact C-N 3.3Å; D111-L113 PolarHBondContact OD1-N 3.43Å; D111-G114 PolarHBondContact OD1-N 2.97Å; D111-W115 PolarHBondContact OD1-N 3.22Å; D111-W115 PolarHBondContact OD2-N 3.31Å; D111-F116 HydrophobicContact CB-CD2 4.41Å; D111-F116 WeakPolarHBondContact OD2-CD2 3.23Å; D111-F116 PolarHBondContact OD2-N 3.31Å |
| 112 | N | 79.3 | Confident | 74.5 | Confident | 57 Ų | 57 | 81.8 Ų | 81.8 | 31% | 0.305 | 45% | 0.446 | S | S | . | . | S | Bend | trans | -85.9 | -4.7 | 178.4 | -53.6 | -63.2 | 0 | 0 | 0 | 112.5 | Y91 H92 G94 | Y91-N112 PolarHBondContact O-ND2 3.42Å; H92-N112 VanDerWaalsContact C-ND2 3.35Å; H92-N112 PolarHBondContact O-ND2 2.9Å; G94-N112 PolarHBondContact O-N 3.07Å; G94-N112 PolarHBondContact O-ND2 3.19Å |
| 113 | L | 76.8 | Confident | 72.8 | Confident | 107 Ų | 107 | 88.6 Ų | 88.6 | 56% | 0.56 | 46% | 0.46 | S | S | * | . | S | Bend | trans | -107.4 | -3.7 | -176.1 | -61.3 | -179.8 | 0 | 0 | 0 | 113 | V95 D111 W115 | V95-L113 HydrophobicContact CG2-CB 3.99Å; V95-L113 HydrophobicContact CG2-CD1 4.2Å; V95-L113 HydrophobicContact CG2-CG 4.25Å; D111-L113 VanDerWaalsContact C-N 3.3Å; D111-L113 PolarHBondContact OD1-N 3.43Å; L113-W115 VanDerWaalsContact C-N 3.33Å; L113-W115 PolarHBondContact O-N 3.33Å |
| 114 | G | 69.9 | Low | 71.2 | Confident | 47 Ų | 47 | 88.4 Ų | 88.4 | 49% | 0.485 | 46% | 0.457 | S | S | . | . | trans | 67.3 | 32.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | D111 F116 | D111-G114 PolarHBondContact OD1-N 2.97Å; G114-F116 PolarHBondContact O-N 3.23Å | ||
| 115 | W | 67.4 | Low | 69.7 | Low | 194 Ų | 194 | 83.2 Ų | 83.2 | 74% | 0.735 | 43% | 0.434 | S | S | * | . | trans | -67.5 | -22.9 | 175 | -85.7 | 19.3 | 0 | 0 | 0 | 112.3 | D111 L113 | D111-W115 PolarHBondContact OD1-N 3.22Å; D111-W115 PolarHBondContact OD2-N 3.31Å; L113-W115 VanDerWaalsContact C-N 3.33Å; L113-W115 PolarHBondContact O-N 3.33Å | ||
| 116 | F | 61.9 | Low | 68.4 | Low | 73 Ų | 73 | 81.2 Ų | 81.2 | 32% | 0.32 | 42% | 0.422 | S | S | . | . | trans | -113 | 82.8 | 178.5 | -58.8 | -79.6 | 0 | 0 | 0 | 110.9 | V95 I97 I108 D111 G114 D118 L119 | V95-F116 HydrophobicContact CG1-CE2 4.12Å; I97-F116 HydrophobicContact CD1-CE2 4.03Å; I97-F116 HydrophobicContact CD1-CZ 3.91Å; I108-F116 HydrophobicContact CD1-CB 4.18Å; I108-F116 HydrophobicContact CD1-CD1 3.74Å; I108-F116 HydrophobicContact CD1-CD2 3.46Å; I108-F116 VanDerWaalsContact CD1-CD2 3.46Å; I108-F116 HydrophobicContact CD1-CE1 3.93Å; I108-F116 HydrophobicContact CD1-CE2 3.66Å; I108-F116 HydrophobicContact CD1-CG 3.5Å; I108-F116 HydrophobicContact CD1-CZ 3.89Å; I108-F116 HydrophobicContact CG1-CD2 4.14Å; I108-F116 HydrophobicContact CG1-CE2 3.94Å; I108-F116 HydrophobicContact CG1-CZ 4.25Å; I108-F116 HydrophobicContact CG2-CD2 4.49Å; D111-F116 HydrophobicContact CB-CD2 4.41Å; D111-F116 WeakPolarHBondContact OD2-CD2 3.23Å; D111-F116 PolarHBondContact OD2-N 3.31Å; G114-F116 PolarHBondContact O-N 3.23Å; F116-D118 PolarHBondContact O-N 3.38Å; F116-L119 HydrophobicContact CB-CD1 4.19Å | ||
| 117 | S | 54.3 | Low | 67.1 | Low | 102 Ų | 102 | 79.4 Ų | 79.4 | 71% | 0.713 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -17.6 | 179.2 | -48.9 | 0 | 0 | 0 | 0 | 114.4 | L119 | S117-L119 VanDerWaalsContact C-N 3.3Å; S117-L119 PolarHBondContact O-N 3.07Å |
| 118 | D | 57.3 | Low | 65.7 | Low | 154 Ų | 154 | 80.3 Ų | 80.3 | 82% | 0.824 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | -3.1 | -173.1 | -52.6 | -38.1 | 0 | 0 | 0 | 113.3 | F116 N120 | F116-D118 PolarHBondContact O-N 3.38Å; D118-N120 VanDerWaalsContact C-N 3.34Å; D118-N120 PolarHBondContact O-N 3.36Å |
| 119 | L | 55.8 | Low | 64.4 | Low | 90 Ų | 90 | 78.6 Ų | 78.6 | 47% | 0.471 | 41% | 0.41 | S | S | . | . | S | Bend | trans | -95.4 | 31.6 | 179.4 | -67.8 | 171.8 | 0 | 0 | 0 | 113.7 | I108 F116 S117 G121 K122 | I108-L119 HydrophobicContact CD1-CD1 4.13Å; F116-L119 HydrophobicContact CB-CD1 4.19Å; S117-L119 VanDerWaalsContact C-N 3.3Å; S117-L119 PolarHBondContact O-N 3.07Å; L119-G121 PolarHBondContact O-N 3.47Å; L119-K122 PolarHBondContact O-N 2.86Å |
| 120 | N | 51.1 | Low | 63 | Low | 149 Ų | 149 | 81.5 Ų | 81.5 | 80% | 0.797 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.3 | 26.5 | 165.1 | -123.3 | 97.4 | 0 | 0 | 0 | 115.6 | D118 K122 | D118-N120 VanDerWaalsContact C-N 3.34Å; D118-N120 PolarHBondContact O-N 3.36Å; N120-K122 PolarHBondContact O-N 2.83Å |
| 121 | G | 51.6 | Low | 61.8 | Low | 59 Ų | 59 | 84.4 Ų | 84.4 | 61% | 0.608 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.7 | 14.9 | 175 | 0 | 0 | 0 | 0 | 0 | 116 | L119 | L119-G121 PolarHBondContact O-N 3.47Š|
| 122 | K | 52.8 | Low | 60.8 | Low | 97 Ų | 97 | 91.2 Ų | 91.2 | 42% | 0.422 | 48% | 0.484 | S | S | . | . | trans | -88.2 | 113.2 | 175.6 | -59.9 | -178.7 | -177 | -177.4 | 0 | 109.3 | L119 N120 I128 | L119-K122 PolarHBondContact O-N 2.86Å; N120-K122 PolarHBondContact O-N 2.83Å; K122-I128 HydrophobicContact CB-CD1 4.46Å; K122-I128 HydrophobicContact CB-CG1 3.66Å; K122-I128 HydrophobicContact CD-CG1 4.28Å | ||
| 123 | R | 55.9 | Low | 59.5 | Low | 181 Ų | 181 | 91.9 Ų | 91.9 | 68% | 0.683 | 51% | 0.505 | S | S | * | . | trans | -92.9 | -9.6 | -159.7 | -62.9 | 179.6 | 177.7 | 133.1 | -1.3 | 113.9 | E127 | R123-E127 PolarHBondContact N-OE2 2.71Š| ||
| 124 | N | 57.8 | Low | 58.7 | Low | 24 Ų | 24 | 91.3 Ų | 91.3 | 13% | 0.128 | 50% | 0.5 | C | S | . | . | S | Bend | trans | -152.1 | 156.4 | -178.5 | -150.2 | -80.2 | 0 | 0 | 0 | 112.7 | E126 E127 I128 | N124-E126 PolarHBondContact O-N 3.42Å; N124-E126 VanDerWaalsContact O-N 3.15Å; N124-E127 HydrophobicContact CB-CG 4.45Å; N124-E127 PolarHBondContact O-N 3.23Å; N124-I128 WeakPolarHBondContact O-CG1 3.27Å; N124-I128 PolarHBondContact O-N 2.81Å |
| 125 | I | 61 | Low | 57.6 | Low | 44 Ų | 44 | 97.4 Ų | 97.4 | 23% | 0.226 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -56.9 | -32.1 | 177.1 | -39.5 | 177.3 | 0 | 0 | 0 | 110.6 | Y91 I109 I128 L129 | Y91-I125 HydrophobicContact CE2-CD1 4.49Å; I109-I125 HydrophobicContact CB-CD1 4.35Å; I109-I125 HydrophobicContact CG2-CD1 3.47Å; I109-I125 VanDerWaalsContact CG2-CD1 3.47Å; I109-I125 WeakPolarHBondContact O-CD1 3.47Å; I109-I125 WeakPolarHBondContact O-CG1 3.46Å; I125-I128 PolarHBondContact O-N 3.32Å; I125-L129 HydrophobicContact CG2-CD1 3.57Å; I125-L129 HydrophobicContact CG2-CG 3.96Å; I125-L129 VanDerWaalsContact O-CB 3.25Å; I125-L129 WeakPolarHBondContact O-CB 3.13Å; I125-L129 VanDerWaalsContact O-CG 3.25Å; I125-L129 WeakPolarHBondContact O-CG 3.21Å; I125-L129 PolarHBondContact O-N 2.84Å |
| 126 | E | 62 | Low | 57 | Low | 55 Ų | 55 | 91.4 Ų | 91.4 | 26% | 0.257 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.7 | -42.2 | 176 | -50.5 | -160.3 | 127.3 | 0 | 0 | 112.2 | N124 A130 R138 | N124-E126 PolarHBondContact O-N 3.42Å; N124-E126 VanDerWaalsContact O-N 3.15Å; E126-A130 WeakPolarHBondContact O-CA 3.43Å; E126-A130 WeakPolarHBondContact O-CB 3.49Å; E126-A130 PolarHBondContact O-N 2.84Å; E126-R138 IonicContact OE1-CZ 2.92Å; E126-R138 IonicContact OE1-NE 2.85Å; E126-R138 PolarHBondContact OE1-NE 3.47Å; E126-R138 VanDerWaalsContact OE1-NE 3.12Å; E126-R138 IonicContact OE1-NH1 2.7Å; E126-R138 PolarHBondContact OE1-NH1 2.9Å; E126-R138 IonicContact OE1-NH2 3.09Å; E126-R138 PolarHBondContact OE1-NH2 3.19Å; E126-R138 IonicContact OE2-CZ 2.86Å; E126-R138 IonicContact OE2-NH1 2.65Å; E126-R138 PolarHBondContact OE2-NH1 2.9Å; E126-R138 IonicContact OE2-NH2 2.79Å; E126-R138 PolarHBondContact OE2-NH2 3.4Å |
| 127 | E | 62 | Low | 56.9 | Low | 95 Ų | 95 | 95.3 Ų | 95.3 | 44% | 0.444 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -72.9 | -35.3 | 178.3 | -61.6 | 179.5 | 177.6 | 0 | 0 | 111.2 | R123 N124 A131 | R123-E127 PolarHBondContact N-OE2 2.71Å; N124-E127 HydrophobicContact CB-CG 4.45Å; N124-E127 PolarHBondContact O-N 3.23Å; E127-A131 VanDerWaalsContact O-CB 3.23Å; E127-A131 WeakPolarHBondContact O-CB 3.4Å; E127-A131 PolarHBondContact O-N 3.12Å |
| 128 | I | 59.2 | Low | 57 | Low | 56 Ų | 56 | 97.8 Ų | 97.8 | 29% | 0.287 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -70.4 | -41.7 | 177.7 | -62.9 | 167.5 | 0 | 0 | 0 | 111 | K122 N124 I125 R132 | K122-I128 HydrophobicContact CB-CD1 4.46Å; K122-I128 HydrophobicContact CB-CG1 3.66Å; K122-I128 HydrophobicContact CD-CG1 4.28Å; N124-I128 WeakPolarHBondContact O-CG1 3.27Å; N124-I128 PolarHBondContact O-N 2.81Å; I125-I128 PolarHBondContact O-N 3.32Å; I128-R132 WeakPolarHBondContact O-CG 3.29Å; I128-R132 PolarHBondContact O-N 2.94Å |
| 129 | L | 58.4 | Low | 57 | Low | 28 Ų | 28 | 95.3 Ų | 95.3 | 15% | 0.147 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -78.8 | -35.8 | 179.3 | -67.2 | 175.1 | 0 | 0 | 0 | 112 | I125 A131 R132 G133 E134 V136 | I125-L129 HydrophobicContact CG2-CD1 3.57Å; I125-L129 HydrophobicContact CG2-CG 3.96Å; I125-L129 VanDerWaalsContact O-CB 3.25Å; I125-L129 WeakPolarHBondContact O-CB 3.13Å; I125-L129 VanDerWaalsContact O-CG 3.25Å; I125-L129 WeakPolarHBondContact O-CG 3.21Å; I125-L129 PolarHBondContact O-N 2.84Å; L129-A131 VanDerWaalsContact C-N 3.32Å; L129-A131 PolarHBondContact O-N 3.44Å; L129-R132 CarbonylContact O-C 3.15Å; L129-R132 WeakPolarHBondContact O-CA 3.39Å; L129-R132 PolarHBondContact O-N 3.3Å; L129-G133 PolarHBondContact O-N 3.24Å; L129-E134 HydrophobicContact CB-CB 4.19Å; L129-E134 HydrophobicContact CD2-CB 3.82Å; L129-E134 HydrophobicContact CD2-CG 4.41Å; L129-E134 WeakPolarHBondContact CD2-OE2 3.47Å; L129-E134 HydrophobicContact CG-CB 4.5Å; L129-E134 PolarHBondContact O-N 3.01Å; L129-V136 HydrophobicContact CB-CG2 4.13Å; L129-V136 HydrophobicContact CD1-CG2 3.33Å; L129-V136 HydrophobicContact CG-CG2 4.35Å |
| 130 | A | 59.7 | Low | 56.7 | Low | 76 Ų | 76 | 98 Ų | 98 | 63% | 0.628 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -60.1 | -42.5 | 170.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | E126 R132 G133 | E126-A130 WeakPolarHBondContact O-CA 3.43Å; E126-A130 WeakPolarHBondContact O-CB 3.49Å; E126-A130 PolarHBondContact O-N 2.84Å; A130-R132 PolarHBondContact O-N 3.22Å; A130-G133 PolarHBondContact O-N 3.45Å |
| 131 | A | 60 | Low | 56.4 | Low | 62 Ų | 62 | 93.7 Ų | 93.7 | 51% | 0.512 | 51% | 0.513 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.2 | -15.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | E127 L129 | E127-A131 VanDerWaalsContact O-CB 3.23Å; E127-A131 WeakPolarHBondContact O-CB 3.4Å; E127-A131 PolarHBondContact O-N 3.12Å; L129-A131 VanDerWaalsContact C-N 3.32Å; L129-A131 PolarHBondContact O-N 3.44Å |
| 132 | R | 63.2 | Low | 56.3 | Low | 165 Ų | 165 | 100.3 Ų | 100.3 | 62% | 0.623 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.2 | -1.2 | 178 | -74.1 | -177.4 | 160.7 | -168.4 | -5.5 | 113.5 | I128 L129 A130 | I128-R132 WeakPolarHBondContact O-CG 3.29Å; I128-R132 PolarHBondContact O-N 2.94Å; L129-R132 CarbonylContact O-C 3.15Å; L129-R132 WeakPolarHBondContact O-CA 3.39Å; L129-R132 PolarHBondContact O-N 3.3Å; A130-R132 PolarHBondContact O-N 3.22Å |
| 133 | G | 52.4 | Low | 56.2 | Low | 72 Ų | 72 | 99 Ų | 99 | 74% | 0.742 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.5 | 16.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | L129 A130 | L129-G133 PolarHBondContact O-N 3.24Å; A130-G133 PolarHBondContact O-N 3.45Å |
| 134 | E | 60 | Low | 55.9 | Low | 95 Ų | 95 | 94.5 Ų | 94.5 | 44% | 0.444 | 54% | 0.544 | S | S | . | . | trans | -96.8 | 133.5 | 178.5 | -72.2 | 173 | -143.9 | 0 | 0 | 110.2 | K76 L129 | K76-E134 VanDerWaalsContact NZ-CD 3.29Å; K76-E134 IonicContact NZ-OE1 2.8Å; K76-E134 PolarHBondContact NZ-OE1 3.04Å; K76-E134 IonicContact NZ-OE2 2.87Å; K76-E134 PolarHBondContact NZ-OE2 3.21Å; L129-E134 HydrophobicContact CB-CB 4.19Å; L129-E134 HydrophobicContact CD2-CB 3.82Å; L129-E134 HydrophobicContact CD2-CG 4.41Å; L129-E134 WeakPolarHBondContact CD2-OE2 3.47Å; L129-E134 HydrophobicContact CG-CB 4.5Å; L129-E134 PolarHBondContact O-N 3.01Å | ||
| 135 | Q | 45.1 | Very low | 55.3 | Low | 174 Ų | 174 | 99 Ų | 99 | 81% | 0.813 | 57% | 0.567 | S | S | * | * | trans | -86.1 | 132.4 | -176.8 | -76.7 | -176.3 | 70.5 | 0 | 0 | 113 | ||||
| 136 | V | 56.5 | Low | 54.7 | Low | 68 Ų | 68 | 104.8 Ų | 104.8 | 41% | 0.412 | 59% | 0.594 | S | S | . | * | trans | -101.8 | 112.5 | 172.3 | -178.3 | 0 | 0 | 0 | 0 | 109.5 | L129 | L129-V136 HydrophobicContact CB-CG2 4.13Å; L129-V136 HydrophobicContact CD1-CG2 3.33Å; L129-V136 HydrophobicContact CG-CG2 4.35Å | ||
| 137 | H | 58.7 | Low | 53.7 | Low | 156 Ų | 156 | 108.2 Ų | 108.2 | 72% | 0.722 | 61% | 0.608 | S | S | * | * | trans | -86.8 | 109.9 | 171 | -78.8 | -82.7 | 0 | 0 | 0 | 110.6 | V139 | H137-V139 PolarHBondContact O-N 3.41Š| ||
| 138 | R | 56.9 | Low | 53.2 | Low | 154 Ų | 154 | 109.3 Ų | 109.3 | 58% | 0.581 | 62% | 0.621 | S | S | * | * | trans | -80.8 | 104.5 | 165.4 | -74.9 | 179.5 | 160.3 | 136.9 | -1.7 | 108.9 | E126 | E126-R138 IonicContact OE1-CZ 2.92Å; E126-R138 IonicContact OE1-NE 2.85Å; E126-R138 PolarHBondContact OE1-NE 3.47Å; E126-R138 VanDerWaalsContact OE1-NE 3.12Å; E126-R138 IonicContact OE1-NH1 2.7Å; E126-R138 PolarHBondContact OE1-NH1 2.9Å; E126-R138 IonicContact OE1-NH2 3.09Å; E126-R138 PolarHBondContact OE1-NH2 3.19Å; E126-R138 IonicContact OE2-CZ 2.86Å; E126-R138 IonicContact OE2-NH1 2.65Å; E126-R138 PolarHBondContact OE2-NH1 2.9Å; E126-R138 IonicContact OE2-NH2 2.79Å; E126-R138 PolarHBondContact OE2-NH2 3.4Å | ||
| 139 | V | 56.3 | Low | 52.7 | Low | 102 Ų | 102 | 112.9 Ų | 112.9 | 62% | 0.618 | 64% | 0.64 | S | S | * | * | trans | -90.3 | 106.4 | 171.3 | -173.2 | 0 | 0 | 0 | 0 | 108.2 | H137 L145 | H137-V139 PolarHBondContact O-N 3.41Å; V139-L145 HydrophobicContact CB-CD2 4.37Å; V139-L145 HydrophobicContact CG1-CD2 4.04Å | ||
| 140 | V | 51 | Low | 51.9 | Low | 146 Ų | 146 | 120 Ų | 120 | 89% | 0.885 | 67% | 0.672 | S | S | * | * | trans | -94.8 | 98.4 | 168.8 | -176.9 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 141 | G | 43.3 | Very low | 51.4 | Low | 58 Ų | 58 | 121.1 Ų | 121.1 | 60% | 0.598 | 68% | 0.681 | S | S | * | * | trans | -140.8 | 121.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | G143 | G141-G143 PolarHBondContact O-N 2.85Š| ||
| 142 | E | 51.3 | Low | 50.4 | Low | 199 Ų | 199 | 122.6 Ų | 122.6 | 93% | 0.93 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -68 | 114.6 | 164 | -85.3 | -173.7 | 138.1 | 0 | 0 | 108.4 | ||
| 143 | G | 50.6 | Low | 49.1 | Very low | 69 Ų | 69 | 118.1 Ų | 118.1 | 71% | 0.711 | 70% | 0.699 | S | S | * | * | S | Bend | trans | 101.3 | 118.3 | 168.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | G141 | G141-G143 PolarHBondContact O-N 2.85Š|
| 144 | A | 48.3 | Very low | 48.6 | Very low | 87 Ų | 87 | 121.3 Ų | 121.3 | 72% | 0.719 | 70% | 0.704 | S | S | * | * | trans | 48.6 | 89.1 | 163.6 | 0 | 0 | 0 | 0 | 0 | 117 | E146 | A144-E146 VanDerWaalsContact C-N 3.34Å; A144-E146 PolarHBondContact O-N 2.89Å; A144-E146 VanDerWaalsContact O-N 3.09Å | ||
| 145 | L | 46.5 | Very low | 47.9 | Very low | 117 Ų | 117 | 122.3 Ų | 122.3 | 61% | 0.613 | 72% | 0.719 | S | S | * | * | trans | -75 | 89.7 | 156.2 | -79.2 | 162.8 | 0 | 0 | 0 | 108.8 | V139 F147 | V139-L145 HydrophobicContact CB-CD2 4.37Å; V139-L145 HydrophobicContact CG1-CD2 4.04Å; L145-F147 PolarHBondContact O-N 3.48Å | ||
| 146 | E | 46.9 | Very low | 47.1 | Very low | 167 Ų | 167 | 120.9 Ų | 120.9 | 78% | 0.78 | 72% | 0.722 | S | S | * | * | trans | -76.2 | 103.6 | 164.7 | -65 | -165.3 | 154.2 | 0 | 0 | 109 | A144 V148 | A144-E146 VanDerWaalsContact C-N 3.34Å; A144-E146 PolarHBondContact O-N 2.89Å; A144-E146 VanDerWaalsContact O-N 3.09Å; E146-V148 PolarHBondContact O-N 3.44Å | ||
| 147 | F | 41.8 | Very low | 46.3 | Very low | 127 Ų | 127 | 122 Ų | 122 | 56% | 0.557 | 73% | 0.733 | S | S | * | * | trans | -81.2 | 93.5 | 160.7 | -91.1 | -84.8 | 0 | 0 | 0 | 107.6 | L145 L149 | L145-F147 PolarHBondContact O-N 3.48Å; F147-L149 PolarHBondContact O-N 3.4Å | ||
| 148 | V | 51.5 | Low | 45.3 | Very low | 117 Ų | 117 | 120.8 Ų | 120.8 | 71% | 0.709 | 74% | 0.736 | S | S | * | * | trans | -68.7 | 102.3 | 160.7 | -178.8 | 0 | 0 | 0 | 0 | 106.5 | E146 E150 | E146-V148 PolarHBondContact O-N 3.44Å; V148-E150 PolarHBondContact O-N 3.41Å; V148-E150 VanDerWaalsContact O-N 3.14Å | ||
| 149 | L | 48.4 | Very low | 44.2 | Very low | 131 Ų | 131 | 118 Ų | 118 | 69% | 0.686 | 75% | 0.747 | S | S | * | * | trans | -69.5 | 99.3 | 165.4 | -73.5 | 162.2 | 0 | 0 | 0 | 106.9 | F147 A151 | F147-L149 PolarHBondContact O-N 3.4Å; L149-A151 PolarHBondContact O-N 3.48Å | ||
| 150 | E | 41.4 | Very low | 43.3 | Very low | 178 Ų | 178 | 117.3 Ų | 117.3 | 83% | 0.832 | 75% | 0.752 | S | S | * | * | trans | -67.2 | 90.2 | 158.4 | -88.6 | -99.4 | 94.6 | 0 | 0 | 107.3 | V148 A152 | V148-E150 PolarHBondContact O-N 3.41Å; V148-E150 VanDerWaalsContact O-N 3.14Å; E150-A152 VanDerWaalsContact C-N 3.35Å; E150-A152 PolarHBondContact O-N 3.29Å | ||
| 151 | A | 48.9 | Very low | 42.9 | Very low | 99 Ų | 99 | 116.7 Ų | 116.7 | 82% | 0.818 | 75% | 0.751 | S | S | * | * | trans | -76.4 | 88.6 | 165.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | L149 | L149-A151 PolarHBondContact O-N 3.48Š| ||
| 152 | A | 40.4 | Very low | 42.6 | Very low | 94 Ų | 94 | 122.5 Ų | 122.5 | 78% | 0.777 | 76% | 0.762 | S | S | * | * | trans | -114.7 | 117.8 | 155.8 | 0 | 0 | 0 | 0 | 0 | 105.6 | E150 | E150-A152 VanDerWaalsContact C-N 3.35Å; E150-A152 PolarHBondContact O-N 3.29Å | ||
| 153 | G | 34.3 | Very low | 42 | Very low | 70 Ų | 70 | 117.4 Ų | 117.4 | 72% | 0.722 | 75% | 0.754 | S | S | * | * | cis | 142.9 | 114.5 | 18.6 | 0 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 154 | T | 41.9 | Very low | 41.4 | Very low | 139 Ų | 139 | 118.1 Ų | 118.1 | 85% | 0.853 | 76% | 0.762 | S | S | * | * | trans | -156.4 | 131.6 | 168.9 | -38.4 | 0 | 0 | 0 | 0 | 104.4 | ||||
| 155 | P | 45.1 | Very low | 41.1 | Very low | 116 Ų | 116 | 122.9 Ų | 122.9 | 75% | 0.753 | 77% | 0.769 | S | S | * | * | -153.9 | 153.7 | 56.7 | 38.4 | -16.7 | 0 | 0 | 0 | 117.6 | |||||
| 156 | T | 29.1 | Very low | 40.8 | Very low | 145 Ų | 145 | 124.7 Ų | 124.7 | 89% | 0.89 | 78% | 0.779 | S | S | * | * | trans | 167.1 | 140.6 | 158.6 | -92.6 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 157 | S | 39.3 | Very low | 40.6 | Very low | 91 Ų | 91 | 125.6 Ų | 125.6 | 64% | 0.636 | 78% | 0.784 | S | S | * | * | cis | -176 | 144.6 | -12.9 | -178.4 | 0 | 0 | 0 | 0 | 102.8 | ||||
| 158 | T | 37.2 | Very low | 40.2 | Very low | 130 Ų | 130 | 122.9 Ų | 122.9 | 80% | 0.798 | 79% | 0.791 | S | S | * | * | trans | 65.2 | 107.5 | 155.1 | -28.4 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 159 | A | 35.1 | Very low | 40.6 | Very low | 97 Ų | 97 | 123.3 Ų | 123.3 | 80% | 0.802 | 80% | 0.797 | S | S | * | * | 174.4 | 87.6 | 124 | 0 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 160 | A | 36.5 | Very low | 40.5 | Very low | 87 Ų | 87 | 123.3 Ų | 123.3 | 72% | 0.719 | 80% | 0.804 | S | S | * | * | trans | -110.1 | 125.8 | 149.5 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 161 | P | 43.7 | Very low | 40.2 | Very low | 133 Ų | 133 | 118.1 Ų | 118.1 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | trans | -86.8 | 106.3 | 160.9 | 30.7 | -23 | 0 | 0 | 0 | 107.6 | ||||
| 162 | E | 37 | Very low | 39.9 | Very low | 180 Ų | 180 | 125.5 Ų | 125.5 | 84% | 0.841 | 81% | 0.805 | S | S | * | * | trans | -93.4 | 137.1 | 162.5 | -63.9 | -126.2 | 108.3 | 0 | 0 | 109.1 | ||||
| 163 | A | 38.3 | Very low | 39.7 | Very low | 92 Ų | 92 | 124.1 Ų | 124.1 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | trans | 22.8 | 113.1 | 148 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 164 | G | 37 | Very low | 40.2 | Very low | 84 Ų | 84 | 131.8 Ų | 131.8 | 87% | 0.866 | 81% | 0.807 | S | S | * | * | trans | -98.7 | 114.3 | 158.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 165 | E | 43.8 | Very low | 40.2 | Very low | 186 Ų | 186 | 131.2 Ų | 131.2 | 87% | 0.869 | 80% | 0.803 | S | S | * | * | trans | -128.1 | 114.9 | 161.9 | -73.3 | 175.8 | 100.2 | 0 | 0 | 107.1 | ||||
| 166 | D | 39.5 | Very low | 39.9 | Very low | 155 Ų | 155 | 134.2 Ų | 134.2 | 83% | 0.829 | 81% | 0.807 | S | S | * | * | trans | -160.6 | 100.6 | 157.5 | -167.3 | -129.1 | 0 | 0 | 0 | 110.8 | ||||
| 167 | E | 41.8 | Very low | 41.7 | Very low | 187 Ų | 187 | 132.6 Ų | 132.6 | 87% | 0.874 | 80% | 0.8 | S | S | * | * | trans | 35 | 133.2 | 137.7 | -61.9 | -93.8 | 88.1 | 0 | 0 | 123 | ||||
| 168 | G | 34.2 | Very low | 42.3 | Very low | 70 Ų | 70 | 137.3 Ų | 137.3 | 72% | 0.722 | 83% | 0.832 | S | S | * | * | trans | 149.8 | 113.9 | 148.3 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 169 | P | 60.5 | Low | 42.5 | Very low | 126 Ų | 126 | 137.7 Ų | 137.7 | 82% | 0.818 | 83% | 0.834 | S | S | * | * | trans | -96.2 | 169.4 | -167.6 | 42.6 | -38.1 | 0 | 0 | 0 | 113.4 | ||||
| 170 | P | 45.4 | Very low | 42.9 | Very low | 131 Ų | 131 | 139.8 Ų | 139.8 | 85% | 0.851 | 84% | 0.836 | S | S | * | * | -152.3 | 156.3 | 80.1 | 36.7 | -15.8 | 0 | 0 | 0 | 117.3 | |||||
| 171 | G | 36.2 | Very low | 43.3 | Very low | 69 Ų | 69 | 142.7 Ų | 142.7 | 71% | 0.711 | 84% | 0.842 | S | S | * | * | 121.2 | 120.8 | 129.3 | 0 | 0 | 0 | 0 | 0 | 120 | |||||
| 172 | R | 41 | Very low | 43.3 | Very low | 254 Ų | 254 | 143.3 Ų | 143.3 | 96% | 0.958 | 84% | 0.841 | S | S | * | * | trans | 63 | 127 | 144.4 | -68.9 | 176.3 | 172 | -108.8 | -1.3 | 117.7 | ||||
| 173 | G | 37 | Very low | 43.7 | Very low | 64 Ų | 64 | 141 Ų | 141 | 66% | 0.66 | 84% | 0.841 | S | S | * | * | cis | 157.5 | 165.5 | 4.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 174 | R | 45.3 | Very low | 44 | Very low | 231 Ų | 231 | 144.3 Ų | 144.3 | 87% | 0.872 | 85% | 0.846 | S | S | * | * | trans | 72.4 | 134.9 | 163.3 | -54.6 | 179.8 | 171.3 | -101.8 | -1.5 | 114.4 | ||||
| 175 | T | 42.2 | Very low | 44.5 | Very low | 127 Ų | 127 | 148.6 Ų | 148.6 | 78% | 0.779 | 85% | 0.845 | S | S | * | * | cis | -170.4 | 139.3 | 14.6 | -4.4 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 176 | E | 38.7 | Very low | 44.6 | Very low | 179 Ų | 179 | 145.7 Ų | 145.7 | 84% | 0.836 | 84% | 0.843 | S | S | * | * | trans | -67.8 | -178.5 | 151.9 | -79.3 | -178.4 | 83.5 | 0 | 0 | 110.5 | ||||
| 177 | P | 66.3 | Low | 45 | Very low | 112 Ų | 112 | 144.9 Ų | 144.9 | 73% | 0.727 | 84% | 0.844 | S | S | * | * | cis | -127.3 | -169.8 | 1.1 | 33.5 | -9.8 | 0 | 0 | 0 | 110.9 | ||||
| 178 | S | 51.6 | Low | 45.3 | Very low | 189 Ų | 189 | 141.1 Ų | 141.1 | 100% | 1.322 | 84% | 0.841 | S | S | * | * | cis | -162 | 0 | 33.5 | -94.3 | 0 | 0 | 0 | 0 | 109.6 |
Retrieved 178 of 178 residues in 47 ms
(Link to these results)