| 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 | 33.3 | Very low | 41.6 | Very low | 252 Ų | 252 | 136.9 Ų | 136.9 | 100% | 1.241 | 86% | 0.862 | S | S | * | * | 0 | 165.7 | 0 | -68.2 | 171.3 | 177.7 | 0 | 0 | 107.9 | |||||
| 2 | A | 47.1 | Very low | 41 | Very low | 88 Ų | 88 | 134.7 Ų | 134.7 | 73% | 0.727 | 86% | 0.855 | S | S | * | * | trans | -102 | -162.7 | -164 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 3 | T | 47.3 | Very low | 40.5 | Very low | 138 Ų | 138 | 142.5 Ų | 142.5 | 85% | 0.847 | 86% | 0.86 | S | S | * | * | trans | 75.8 | 151.6 | -179.9 | 76.4 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 4 | D | 44.5 | Very low | 40.2 | Very low | 137 Ų | 137 | 137.4 Ų | 137.4 | 73% | 0.733 | 85% | 0.85 | S | S | * | * | cis | -147.6 | 176.8 | 10.5 | -164.5 | -148.1 | 0 | 0 | 0 | 114.6 | ||||
| 5 | S | 48.8 | Very low | 40.1 | Very low | 104 Ų | 104 | 136.2 Ų | 136.2 | 73% | 0.727 | 85% | 0.85 | S | S | * | * | trans | -26.9 | 170.1 | 157 | -51.6 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 6 | G | 42.5 | Very low | 39.6 | Very low | 69 Ų | 69 | 141.7 Ų | 141.7 | 71% | 0.711 | 85% | 0.851 | S | S | * | * | cis | 165.7 | 171.6 | -2.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 7 | Y | 40.7 | Very low | 39.3 | Very low | 242 Ų | 242 | 138.1 Ų | 138.1 | 95% | 0.949 | 85% | 0.85 | S | S | * | * | trans | 8 | 122.6 | 166.8 | -82.3 | -95.7 | 0 | 0 | 0 | 123.3 | ||||
| 8 | G | 38.9 | Very low | 39.2 | Very low | 81 Ų | 81 | 134.3 Ų | 134.3 | 84% | 0.835 | 84% | 0.843 | S | S | * | * | 76 | 153.9 | 102.7 | 0 | 0 | 0 | 0 | 0 | 122.5 | |||||
| 9 | G | 37.9 | Very low | 39.1 | Very low | 86 Ų | 86 | 136.4 Ų | 136.4 | 89% | 0.887 | 84% | 0.841 | S | S | * | * | trans | 159.7 | 141.2 | 168.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 10 | A | 39.1 | Very low | 39.1 | Very low | 107 Ų | 107 | 137 Ų | 137 | 88% | 0.884 | 83% | 0.834 | S | S | * | * | trans | -141.9 | 177 | -174.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 11 | Q | 37.8 | Very low | 38.8 | Very low | 202 Ų | 202 | 136.4 Ų | 136.4 | 94% | 0.944 | 84% | 0.836 | S | S | * | * | trans | -90.7 | 173.5 | -168.2 | -60.9 | 169.9 | -64.5 | 0 | 0 | 114.5 | ||||
| 12 | S | 34.7 | Very low | 39 | Very low | 110 Ų | 110 | 127.6 Ų | 127.6 | 77% | 0.769 | 81% | 0.81 | S | S | * | * | trans | -153.1 | 178.3 | -177.8 | -168 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 13 | Y | 34 | Very low | 38.5 | Very low | 237 Ų | 237 | 133 Ų | 133 | 93% | 0.929 | 82% | 0.82 | S | S | * | * | trans | 82 | 132.5 | -172.7 | -70.3 | -89.2 | 0 | 0 | 0 | 117.4 | ||||
| 14 | G | 36.3 | Very low | 37.8 | Very low | 70 Ų | 70 | 129.6 Ų | 129.6 | 72% | 0.722 | 81% | 0.812 | S | S | * | * | cis | 165.2 | 135.6 | -15.5 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 15 | S | 38.3 | Very low | 37.2 | Very low | 120 Ų | 120 | 134 Ų | 134 | 84% | 0.839 | 82% | 0.821 | S | S | * | * | trans | 65.9 | 149.9 | 162.5 | -115.2 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 16 | Y | 33.1 | Very low | 36.5 | Very low | 224 Ų | 224 | 132.7 Ų | 132.7 | 88% | 0.878 | 82% | 0.823 | S | S | * | * | cis | -153.1 | 166.1 | 12.4 | 51.5 | -90.7 | 0 | 0 | 0 | 111.8 | ||||
| 17 | G | 34.3 | Very low | 36.1 | Very low | 80 Ų | 80 | 139.6 Ų | 139.6 | 83% | 0.825 | 84% | 0.837 | S | S | * | * | cis | 169.4 | 8.5 | -7.2 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 18 | G | 36 | Very low | 35.6 | Very low | 71 Ų | 71 | 131.7 Ų | 131.7 | 73% | 0.732 | 83% | 0.829 | S | S | * | * | trans | -169.8 | 161.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 19 | Q | 38.8 | Very low | 35.5 | Very low | 173 Ų | 173 | 136.3 Ų | 136.3 | 81% | 0.808 | 84% | 0.835 | S | S | * | * | cis | -158.5 | 165.9 | 2.5 | -58.6 | -179.4 | -96.2 | 0 | 0 | 108.2 | ||||
| 20 | Q | 38.8 | Very low | 35.1 | Very low | 148 Ų | 148 | 135.7 Ų | 135.7 | 69% | 0.692 | 83% | 0.828 | S | S | * | * | cis | -167.6 | 153.9 | -22.4 | -107.3 | 170 | -113.9 | 0 | 0 | 110 | ||||
| 21 | S | 33.3 | Very low | 34.7 | Very low | 126 Ų | 126 | 134.3 Ų | 134.3 | 88% | 0.881 | 82% | 0.824 | S | S | * | * | trans | 59.7 | 147.4 | 158.6 | 55.9 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 22 | G | 35.8 | Very low | 34.5 | Very low | 67 Ų | 67 | 129.5 Ų | 129.5 | 69% | 0.691 | 82% | 0.819 | S | S | * | * | cis | 155.4 | 94.4 | -12.8 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 23 | Q | 37 | Very low | 34.4 | Very low | 200 Ų | 200 | 131.6 Ų | 131.6 | 94% | 0.935 | 83% | 0.827 | S | S | * | * | trans | 45.2 | 146.3 | 136.4 | -63.3 | 175 | -27.2 | 0 | 0 | 124.8 | ||||
| 24 | G | 32.6 | Very low | 34.4 | Very low | 67 Ų | 67 | 123.9 Ų | 123.9 | 69% | 0.691 | 82% | 0.82 | S | S | * | * | trans | 100.6 | 157.3 | 155 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 25 | Y | 32.7 | Very low | 34.2 | Very low | 231 Ų | 231 | 126.1 Ų | 126.1 | 91% | 0.906 | 82% | 0.824 | S | S | * | * | cis | -164.6 | 177.9 | -7.5 | 25.9 | -110.9 | 0 | 0 | 0 | 107.8 | ||||
| 26 | G | 33.8 | Very low | 33.9 | Very low | 75 Ų | 75 | 131.5 Ų | 131.5 | 77% | 0.773 | 83% | 0.828 | S | S | * | * | trans | -140.7 | -159.5 | -174.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 27 | Q | 33.7 | Very low | 33.9 | Very low | 214 Ų | 214 | 124.3 Ų | 124.3 | 100% | 1 | 82% | 0.822 | S | S | * | * | trans | 95.1 | 135.1 | 176.5 | -160.2 | 176.9 | 96.8 | 0 | 0 | 117.2 | ||||
| 28 | G | 30.8 | Very low | 33.9 | Very low | 76 Ų | 76 | 124.3 Ų | 124.3 | 78% | 0.784 | 82% | 0.822 | S | S | * | * | trans | 162.6 | 147 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 29 | N | 36.1 | Very low | 33.7 | Very low | 179 Ų | 179 | 130.3 Ų | 130.3 | 96% | 0.957 | 83% | 0.831 | S | S | * | * | trans | -152.9 | 154.7 | -170.6 | -169.5 | 11.3 | 0 | 0 | 0 | 113.8 | ||||
| 30 | G | 29.9 | Very low | 33.3 | Very low | 73 Ų | 73 | 129.3 Ų | 129.3 | 75% | 0.753 | 83% | 0.831 | S | S | * | * | trans | 106 | 148 | 174 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 31 | G | 30.7 | Very low | 33.1 | Very low | 78 Ų | 78 | 132 Ų | 132 | 80% | 0.804 | 84% | 0.836 | S | S | * | * | cis | 174.6 | 109.2 | -8.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 32 | A | 33.8 | Very low | 33.6 | Very low | 100 Ų | 100 | 130.5 Ų | 130.5 | 83% | 0.826 | 82% | 0.823 | S | S | * | * | trans | 61.2 | 112.1 | 149.1 | 0 | 0 | 0 | 0 | 0 | 124 | ||||
| 33 | T | 31.6 | Very low | 33.3 | Very low | 154 Ų | 154 | 129.9 Ų | 129.9 | 95% | 0.945 | 82% | 0.817 | S | S | * | * | trans | 179.3 | 141.7 | 137.1 | 18 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 34 | G | 34.3 | Very low | 33 | Very low | 76 Ų | 76 | 130.7 Ų | 130.7 | 78% | 0.784 | 81% | 0.813 | S | S | * | * | cis | 119.8 | 137.2 | 15.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 35 | S | 32.8 | Very low | 32.9 | Very low | 116 Ų | 116 | 131 Ų | 131 | 81% | 0.811 | 82% | 0.816 | S | S | * | * | cis | -172.2 | 119 | -12 | 175.8 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 36 | Y | 31.4 | Very low | 32.9 | Very low | 234 Ų | 234 | 127.3 Ų | 127.3 | 92% | 0.918 | 81% | 0.807 | S | S | * | * | trans | -179.3 | 145.3 | 152.8 | 61.2 | -89.7 | 0 | 0 | 0 | 109.1 | ||||
| 37 | G | 32.9 | Very low | 32.9 | Very low | 73 Ų | 73 | 131.9 Ų | 131.9 | 75% | 0.753 | 81% | 0.808 | S | S | * | * | cis | -170.5 | 133.9 | -14.2 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 38 | G | 34.6 | Very low | 32.7 | Very low | 79 Ų | 79 | 125.5 Ų | 125.5 | 81% | 0.814 | 80% | 0.8 | S | S | * | * | 79.4 | 129.4 | 92.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 39 | Q | 33 | Very low | 33.1 | Very low | 198 Ų | 198 | 126.7 Ų | 126.7 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | cis | -157.7 | 179.2 | 20.5 | -58.9 | 173.8 | -0.6 | 0 | 0 | 109.6 | ||||
| 40 | N | 29.5 | Very low | 33.5 | Very low | 152 Ų | 152 | 124.2 Ų | 124.2 | 81% | 0.813 | 80% | 0.796 | S | S | * | * | -159.4 | 165.7 | -53.3 | -167.7 | 22.3 | 0 | 0 | 0 | 110.4 | |||||
| 41 | Y | 34.1 | Very low | 33.4 | Very low | 205 Ų | 205 | 130.2 Ų | 130.2 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | -73.2 | 171.2 | 176.4 | -94.3 | -93.4 | 0 | 0 | 0 | 114 | ||||
| 42 | P | 43.9 | Very low | 33.3 | Very low | 93 Ų | 93 | 130.2 Ų | 130.2 | 60% | 0.604 | 81% | 0.805 | S | S | * | * | cis | -124.8 | -179.5 | 45.6 | 19 | 7.4 | 0 | 0 | 0 | 114.8 | Y44 | P42-Y44 HydrophobicContact CB-CD2 4.49Å; P42-Y44 HydrophobicContact CB-CE1 4.26Å; P42-Y44 HydrophobicContact CB-CE2 3.73Å; P42-Y44 HydrophobicContact CG-CE2 4.45Å | ||
| 43 | G | 29.8 | Very low | 33.3 | Very low | 54 Ų | 54 | 131.1 Ų | 131.1 | 56% | 0.557 | 81% | 0.805 | S | S | * | * | cis | 93.7 | 142.8 | 30.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 44 | Y | 30.3 | Very low | 33.1 | Very low | 218 Ų | 218 | 131 Ų | 131 | 86% | 0.855 | 79% | 0.793 | S | S | * | * | cis | -162.2 | 171.3 | 9 | -37 | -99.9 | 0 | 0 | 0 | 109.4 | P42 | P42-Y44 HydrophobicContact CB-CD2 4.49Å; P42-Y44 HydrophobicContact CB-CE1 4.26Å; P42-Y44 HydrophobicContact CB-CE2 3.73Å; P42-Y44 HydrophobicContact CG-CE2 4.45Å | ||
| 45 | G | 30.5 | Very low | 32.9 | Very low | 72 Ų | 72 | 129.9 Ų | 129.9 | 74% | 0.742 | 78% | 0.782 | S | S | * | * | trans | 98.5 | 119.4 | 141.9 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 46 | Q | 33 | Very low | 32.9 | Very low | 155 Ų | 155 | 134.3 Ų | 134.3 | 72% | 0.724 | 78% | 0.783 | S | S | * | * | 26.5 | 132.5 | 129.8 | -69.5 | -81.4 | 63.7 | 0 | 0 | 122.4 | |||||
| 47 | Q | 35 | Very low | 33 | Very low | 170 Ų | 170 | 126.8 Ų | 126.8 | 79% | 0.794 | 78% | 0.776 | S | S | * | * | trans | 43.5 | 123.3 | 133.5 | -63.1 | 172.1 | -2.4 | 0 | 0 | 120.8 | ||||
| 48 | G | 29.4 | Very low | 33.1 | Very low | 80 Ų | 80 | 131.1 Ų | 131.1 | 83% | 0.825 | 78% | 0.777 | S | S | * | * | trans | 158.4 | 125 | 152.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 49 | A | 38 | Very low | 33.1 | Very low | 102 Ų | 102 | 132.4 Ų | 132.4 | 84% | 0.843 | 77% | 0.773 | S | S | * | * | trans | -111.5 | 136 | 160.7 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 50 | P | 44.1 | Very low | 33.2 | Very low | 127 Ų | 127 | 129.3 Ų | 129.3 | 83% | 0.825 | 76% | 0.759 | S | S | * | * | trans | -110.9 | 171.3 | 160.6 | 35.2 | -26 | 0 | 0 | 0 | 112.4 | ||||
| 51 | Q | 28.7 | Very low | 33.3 | Very low | 199 Ų | 199 | 128.8 Ų | 128.8 | 93% | 0.93 | 75% | 0.752 | S | S | * | * | trans | -122.5 | 166.7 | -172.2 | -61.3 | 171.9 | -33.8 | 0 | 0 | 112 | ||||
| 52 | G | 29.6 | Very low | 33.2 | Very low | 78 Ų | 78 | 127.3 Ų | 127.3 | 80% | 0.804 | 75% | 0.752 | S | S | * | * | trans | 89.1 | 154.9 | 168.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 53 | S | 32.1 | Very low | 32.6 | Very low | 119 Ų | 119 | 128.3 Ų | 128.3 | 83% | 0.832 | 76% | 0.761 | S | S | * | * | cis | -164.8 | 170.7 | -9.8 | 57.7 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 54 | E | 29 | Very low | 32.5 | Very low | 151 Ų | 151 | 136.6 Ų | 136.6 | 71% | 0.706 | 78% | 0.777 | S | S | * | * | cis | -135.4 | 178.6 | 5.4 | -98.1 | -157.7 | 108.2 | 0 | 0 | 108.5 | Y56 | E54-Y56 WeakPolarHBondContact OE1-CE2 3.46Å; E54-Y56 PolarHBondContact OE1-OH 2.92Å; E54-Y56 VanDerWaalsContact OE1-OH 3.1Å | ||
| 55 | G | 29.9 | Very low | 32.5 | Very low | 53 Ų | 53 | 129.5 Ų | 129.5 | 55% | 0.546 | 77% | 0.771 | S | S | . | * | cis | 166.7 | 159.5 | -3.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 56 | Y | 31.4 | Very low | 32.3 | Very low | 209 Ų | 209 | 130.4 Ų | 130.4 | 82% | 0.82 | 77% | 0.766 | S | S | * | * | trans | 60.7 | 136.5 | 174.1 | -45.4 | -84.3 | 0 | 0 | 0 | 117.6 | E54 | E54-Y56 WeakPolarHBondContact OE1-CE2 3.46Å; E54-Y56 PolarHBondContact OE1-OH 2.92Å; E54-Y56 VanDerWaalsContact OE1-OH 3.1Å | ||
| 57 | G | 34.5 | Very low | 32.1 | Very low | 76 Ų | 76 | 133.7 Ų | 133.7 | 78% | 0.784 | 77% | 0.773 | S | S | * | * | cis | 163.2 | 157 | -5.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 58 | Q | 35.2 | Very low | 31.9 | Very low | 163 Ų | 163 | 128.4 Ų | 128.4 | 76% | 0.762 | 76% | 0.764 | S | S | * | * | cis | -115.3 | -113 | -1.1 | -161.7 | -165.9 | 102 | 0 | 0 | 109.9 | ||||
| 59 | S | 33.3 | Very low | 32 | Very low | 106 Ų | 106 | 134.1 Ų | 134.1 | 74% | 0.741 | 77% | 0.769 | S | S | * | * | cis | -141.8 | -134.6 | -4.3 | 66 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 60 | Q | 35 | Very low | 31.5 | Very low | 134 Ų | 134 | 136.1 Ų | 136.1 | 63% | 0.626 | 77% | 0.766 | S | S | * | * | trans | -151.2 | 152.2 | -161.2 | -75.2 | -180 | 65.2 | 0 | 0 | 108.9 | ||||
| 61 | Q | 32.2 | Very low | 30.8 | Very low | 141 Ų | 141 | 134.4 Ų | 134.4 | 66% | 0.659 | 76% | 0.757 | S | S | * | * | cis | -149.5 | 146.6 | 2.2 | -107.6 | 153.9 | -11.3 | 0 | 0 | 106.9 | ||||
| 62 | Q | 32.4 | Very low | 31 | Very low | 173 Ų | 173 | 130.7 Ų | 130.7 | 81% | 0.808 | 75% | 0.753 | S | S | * | * | 53.2 | 139.6 | 87.2 | -54.2 | 180 | -5.5 | 0 | 0 | 114.6 | |||||
| 63 | S | 30.4 | Very low | 31 | Very low | 114 Ų | 114 | 130.8 Ų | 130.8 | 80% | 0.797 | 75% | 0.754 | S | S | * | * | cis | -149.4 | -177.5 | 18.4 | -155.7 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 64 | Y | 29.7 | Very low | 30.8 | Very low | 228 Ų | 228 | 136.4 Ų | 136.4 | 89% | 0.894 | 76% | 0.759 | S | S | * | * | trans | -74 | 156.4 | -162.7 | -92.9 | -110.3 | 0 | 0 | 0 | 119.5 | ||||
| 65 | G | 29.1 | Very low | 31 | Very low | 70 Ų | 70 | 132.4 Ų | 132.4 | 72% | 0.722 | 76% | 0.758 | S | S | * | * | 113.9 | 161 | 121 | 0 | 0 | 0 | 0 | 0 | 118.4 | |||||
| 66 | S | 26.5 | Very low | 31 | Very low | 91 Ų | 91 | 136.2 Ų | 136.2 | 64% | 0.636 | 77% | 0.766 | S | S | * | * | cis | -170.5 | 138.3 | -20.8 | -160.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 67 | Y | 28.2 | Very low | 31.1 | Very low | 223 Ų | 223 | 134.1 Ų | 134.1 | 88% | 0.875 | 76% | 0.761 | S | S | * | * | trans | 51.3 | 158.8 | 174.5 | 64.5 | -99.1 | 0 | 0 | 0 | 117.9 | ||||
| 68 | G | 30.9 | Very low | 30.8 | Very low | 60 Ų | 60 | 136.5 Ų | 136.5 | 62% | 0.619 | 77% | 0.766 | S | S | * | * | cis | 153.8 | 141.8 | -9.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 69 | Q | 31.9 | Very low | 30.9 | Very low | 199 Ų | 199 | 133.6 Ų | 133.6 | 93% | 0.93 | 77% | 0.77 | S | S | * | * | trans | 64.9 | 171.1 | -178.9 | -68.8 | 176.5 | 61.9 | 0 | 0 | 114.9 | ||||
| 70 | D | 28 | Very low | 30.7 | Very low | 144 Ų | 144 | 133.6 Ų | 133.6 | 77% | 0.77 | 77% | 0.77 | S | S | * | * | -160.4 | 170.2 | -56.2 | 115.1 | -46.8 | 0 | 0 | 0 | 107.1 | |||||
| 71 | S | 29.9 | Very low | 30.4 | Very low | 92 Ų | 92 | 138.4 Ų | 138.4 | 64% | 0.643 | 78% | 0.784 | S | S | * | * | cis | -167.8 | -173.3 | -20.3 | -178.3 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 72 | S | 31.6 | Very low | 30.3 | Very low | 120 Ų | 120 | 135.7 Ų | 135.7 | 84% | 0.839 | 79% | 0.793 | S | S | * | * | trans | 67.7 | 123.4 | 164.9 | -58.3 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 73 | G | 30.4 | Very low | 30.4 | Very low | 80 Ų | 80 | 135.8 Ų | 135.8 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | trans | -160.3 | 126.8 | 166.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 74 | Y | 27.9 | Very low | 31.4 | Very low | 238 Ų | 238 | 136 Ų | 136 | 93% | 0.933 | 79% | 0.792 | S | S | * | * | trans | -110.9 | 147.7 | -167.8 | -120.6 | -95 | 0 | 0 | 0 | 112.9 | ||||
| 75 | G | 32.2 | Very low | 31.4 | Very low | 67 Ų | 67 | 129.3 Ų | 129.3 | 69% | 0.691 | 78% | 0.784 | S | S | * | * | trans | 83.3 | 160.4 | 161.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 76 | D | 30.9 | Very low | 31.6 | Very low | 133 Ų | 133 | 130.6 Ų | 130.6 | 71% | 0.711 | 79% | 0.788 | S | S | * | * | cis | -150.5 | -170.2 | -20.2 | -153.4 | -81 | 0 | 0 | 0 | 109.4 | ||||
| 77 | K | 32.5 | Very low | 31.8 | Very low | 164 Ų | 164 | 131.5 Ų | 131.5 | 71% | 0.713 | 80% | 0.801 | S | S | * | * | trans | -81 | 145.6 | -163.6 | -53.1 | 156.5 | -153.2 | 75.7 | 0 | 112.4 | ||||
| 78 | S | 29.4 | Very low | 32 | Very low | 127 Ų | 127 | 126.4 Ų | 126.4 | 89% | 0.888 | 80% | 0.798 | S | S | * | * | 157.6 | 164.1 | 110.9 | 56.2 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 79 | A | 36.9 | Very low | 31.8 | Very low | 102 Ų | 102 | 134.5 Ų | 134.5 | 84% | 0.843 | 81% | 0.811 | S | S | * | * | trans | -123.9 | 153.2 | -175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 80 | S | 29.1 | Very low | 31.8 | Very low | 106 Ų | 106 | 128.1 Ų | 128.1 | 74% | 0.741 | 80% | 0.799 | S | S | * | * | trans | -155.9 | 125.1 | 168.6 | -164 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 81 | Y | 29.2 | Very low | 31.9 | Very low | 235 Ų | 235 | 124.9 Ų | 124.9 | 92% | 0.922 | 80% | 0.8 | S | S | * | * | trans | 20.7 | 140.4 | 148.6 | -66.1 | -96.5 | 0 | 0 | 0 | 123 | ||||
| 82 | G | 29.6 | Very low | 32 | Very low | 83 Ų | 83 | 129.3 Ų | 129.3 | 86% | 0.856 | 81% | 0.81 | S | S | * | * | trans | 168.4 | 105.8 | 155.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 83 | Q | 34.2 | Very low | 32.1 | Very low | 176 Ų | 176 | 127.9 Ų | 127.9 | 82% | 0.822 | 80% | 0.801 | S | S | * | * | trans | -111.1 | 152.7 | 167.2 | -105.8 | -88.4 | -24.8 | 0 | 0 | 108.3 | ||||
| 84 | P | 50.4 | Low | 32 | Very low | 118 Ų | 118 | 133.5 Ų | 133.5 | 77% | 0.766 | 81% | 0.805 | S | S | * | * | -157.1 | 157.7 | 93.8 | 40 | -20.6 | 0 | 0 | 0 | 118.9 | |||||
| 85 | A | 31.7 | Very low | 32 | Very low | 87 Ų | 87 | 126.1 Ų | 126.1 | 72% | 0.719 | 80% | 0.801 | S | S | * | * | trans | 18.4 | 167.8 | 130.8 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 86 | A | 32 | Very low | 31.9 | Very low | 98 Ų | 98 | 127 Ų | 127 | 81% | 0.81 | 81% | 0.811 | S | S | * | * | cis | 177.8 | 147.2 | -31.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 87 | A | 31.3 | Very low | 31.8 | Very low | 109 Ų | 109 | 124.7 Ų | 124.7 | 90% | 0.901 | 82% | 0.818 | S | S | * | * | trans | -163.4 | 161.5 | 169.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 88 | S | 32 | Very low | 31.7 | Very low | 116 Ų | 116 | 120.1 Ų | 120.1 | 81% | 0.811 | 82% | 0.818 | S | S | * | * | trans | -158.8 | 134.9 | 178.6 | 179.6 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 89 | Y | 27.5 | Very low | 31.8 | Very low | 230 Ų | 230 | 124.6 Ų | 124.6 | 90% | 0.902 | 82% | 0.822 | S | S | * | * | trans | -177.3 | 153.9 | 161.9 | -123.1 | -85.8 | 0 | 0 | 0 | 110.3 | ||||
| 90 | G | 31.6 | Very low | 31.7 | Very low | 65 Ų | 65 | 122.9 Ų | 122.9 | 67% | 0.67 | 81% | 0.814 | S | S | * | * | cis | 146.9 | 67.3 | -19.9 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 91 | G | 30.6 | Very low | 31.9 | Very low | 77 Ų | 77 | 125.9 Ų | 125.9 | 79% | 0.794 | 82% | 0.816 | S | S | * | * | trans | -177.6 | 113.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 92 | Q | 31.6 | Very low | 32.1 | Very low | 184 Ų | 184 | 122.3 Ų | 122.3 | 86% | 0.86 | 81% | 0.808 | S | S | * | * | 61.8 | 95.7 | 122.8 | -162 | 159.6 | -2.9 | 0 | 0 | 125.1 | |||||
| 93 | S | 32.6 | Very low | 32.2 | Very low | 91 Ų | 91 | 123.2 Ų | 123.2 | 64% | 0.636 | 80% | 0.801 | S | S | * | * | 66.2 | 134.9 | 126.1 | 80.4 | 0 | 0 | 0 | 0 | 127 | |||||
| 94 | Q | 29.8 | Very low | 32.2 | Very low | 198 Ų | 198 | 118.9 Ų | 118.9 | 93% | 0.925 | 79% | 0.79 | S | S | * | * | trans | 75.1 | 131.6 | 146.6 | -71.5 | -179.1 | 15.8 | 0 | 0 | 122.7 | ||||
| 95 | G | 28 | Very low | 31.2 | Very low | 82 Ų | 82 | 124.3 Ų | 124.3 | 85% | 0.845 | 80% | 0.797 | S | S | * | * | trans | 148.3 | 98.8 | 146 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 96 | G | 29.4 | Very low | 31.2 | Very low | 86 Ų | 86 | 124 Ų | 124 | 89% | 0.887 | 80% | 0.803 | S | S | * | * | trans | 88.3 | 131.7 | 136.4 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 97 | G | 29.1 | Very low | 31.1 | Very low | 84 Ų | 84 | 122.5 Ų | 122.5 | 87% | 0.866 | 80% | 0.797 | S | S | * | * | trans | 81.4 | 144.3 | 163.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 98 | G | 29.6 | Very low | 31.1 | Very low | 69 Ų | 69 | 126.7 Ų | 126.7 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | cis | 107.4 | 122.2 | 9.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 99 | F | 31.8 | Very low | 30.9 | Very low | 221 Ų | 221 | 126.6 Ų | 126.6 | 97% | 0.969 | 80% | 0.797 | S | S | * | * | cis | -150.4 | 172.3 | 20.5 | -79.5 | -101.8 | 0 | 0 | 0 | 112.4 | ||||
| 100 | G | 35.1 | Very low | 31.1 | Very low | 66 Ų | 66 | 119.8 Ų | 119.8 | 68% | 0.68 | 80% | 0.797 | S | S | * | * | trans | 87.1 | 110.8 | 167.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 101 | Q | 33.4 | Very low | 30.9 | Very low | 168 Ų | 168 | 120.4 Ų | 120.4 | 79% | 0.785 | 80% | 0.803 | S | S | * | * | cis | 67.1 | 136 | 22.5 | -58.5 | -165.5 | 10.3 | 0 | 0 | 113.9 | ||||
| 102 | Q | 32.9 | Very low | 30.8 | Very low | 160 Ų | 160 | 127.4 Ų | 127.4 | 75% | 0.748 | 81% | 0.807 | S | S | * | * | cis | -169.6 | 177.8 | 4.5 | -119.6 | 176.8 | 9.9 | 0 | 0 | 109.1 | ||||
| 103 | S | 31.8 | Very low | 30.7 | Very low | 103 Ų | 103 | 123.4 Ų | 123.4 | 72% | 0.72 | 81% | 0.806 | S | S | * | * | cis | -160.7 | -174.7 | -12.3 | -155.9 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 104 | S | 34 | Very low | 30.6 | Very low | 84 Ų | 84 | 123 Ų | 123 | 59% | 0.587 | 82% | 0.816 | S | S | * | * | trans | -123.3 | 171.1 | 159.7 | -174.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 105 | Y | 28.6 | Very low | 30.6 | Very low | 232 Ų | 232 | 118.3 Ų | 118.3 | 91% | 0.91 | 81% | 0.811 | S | S | * | * | trans | 67.8 | 156.4 | 179.1 | -54.2 | -85.1 | 0 | 0 | 0 | 116.2 | ||||
| 106 | G | 32.2 | Very low | 30.6 | Very low | 81 Ų | 81 | 123.3 Ų | 123.3 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | cis | 165.6 | 168.2 | -6.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 107 | G | 29.7 | Very low | 30.6 | Very low | 67 Ų | 67 | 123.6 Ų | 123.6 | 69% | 0.691 | 81% | 0.806 | S | S | * | * | trans | 173.4 | 134.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 108 | Q | 31.7 | Very low | 30.6 | Very low | 196 Ų | 196 | 128.8 Ų | 128.8 | 92% | 0.916 | 81% | 0.808 | S | S | * | * | 78.7 | 136.7 | 60.3 | -71.9 | -178.4 | -4.1 | 0 | 0 | 113.4 | |||||
| 109 | S | 29 | Very low | 30.6 | Very low | 114 Ų | 114 | 129.5 Ų | 129.5 | 80% | 0.797 | 82% | 0.815 | S | S | * | * | cis | -166.5 | 155.4 | 2.8 | 48.1 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 110 | G | 30 | Very low | 30.5 | Very low | 87 Ų | 87 | 123.4 Ų | 123.4 | 90% | 0.897 | 81% | 0.806 | S | S | * | * | trans | 68 | 157.2 | 154.3 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 111 | G | 28.3 | Very low | 30.3 | Very low | 78 Ų | 78 | 126 Ų | 126 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | cis | 151.4 | 107.4 | -17.7 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 112 | Y | 28.7 | Very low | 30.1 | Very low | 224 Ų | 224 | 123.3 Ų | 123.3 | 88% | 0.878 | 81% | 0.813 | S | S | * | * | trans | -167.8 | 140.3 | 156.1 | 62.9 | -90.4 | 0 | 0 | 0 | 108.1 | ||||
| 113 | A | 28.9 | Very low | 29.9 | Very low | 100 Ų | 100 | 119.8 Ų | 119.8 | 83% | 0.826 | 82% | 0.82 | S | S | * | * | cis | 91.1 | 112.5 | 46.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 114 | G | 30.1 | Very low | 29.8 | Very low | 83 Ų | 83 | 118.4 Ų | 118.4 | 86% | 0.856 | 82% | 0.822 | S | S | * | * | trans | 170.7 | 148.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 115 | A | 31.4 | Very low | 29.7 | Very low | 100 Ų | 100 | 119.4 Ų | 119.4 | 83% | 0.826 | 84% | 0.835 | S | S | * | * | trans | -144.4 | 149.6 | -165.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 116 | Q | 28.1 | Very low | 29.7 | Very low | 187 Ų | 187 | 113.8 Ų | 113.8 | 87% | 0.874 | 83% | 0.83 | S | S | * | * | trans | 45 | 99 | 141.6 | -170.2 | 178.1 | -22.7 | 0 | 0 | 121.3 | ||||
| 117 | A | 29.1 | Very low | 29.6 | Very low | 91 Ų | 91 | 121.1 Ų | 121.1 | 75% | 0.752 | 83% | 0.834 | S | S | * | * | trans | -161.8 | 138.6 | 141.9 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 118 | Q | 29.1 | Very low | 29.7 | Very low | 194 Ų | 194 | 120.9 Ų | 120.9 | 91% | 0.907 | 83% | 0.831 | S | S | * | * | 59.9 | 99.9 | 51.7 | -71.1 | -165.2 | -7.7 | 0 | 0 | 114.5 | |||||
| 119 | G | 29.1 | Very low | 29.5 | Very low | 84 Ų | 84 | 119.5 Ų | 119.5 | 87% | 0.866 | 83% | 0.825 | S | S | * | * | trans | -175.7 | 139.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 120 | A | 28.7 | Very low | 29.4 | Very low | 93 Ų | 93 | 121.5 Ų | 121.5 | 77% | 0.769 | 82% | 0.821 | S | S | * | * | trans | -148.3 | 170.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 121 | S | 31.3 | Very low | 29.3 | Very low | 119 Ų | 119 | 122.2 Ų | 122.2 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | 71.8 | 153.7 | 176.9 | 85.2 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 122 | S | 29.9 | Very low | 29.3 | Very low | 113 Ų | 113 | 124.2 Ų | 124.2 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | cis | -170.6 | 156.7 | -12.3 | 36.6 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 123 | G | 28.1 | Very low | 29.2 | Very low | 85 Ų | 85 | 124.5 Ų | 124.5 | 88% | 0.876 | 81% | 0.811 | S | S | * | * | trans | 87 | 158.1 | 152.9 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 124 | G | 29.5 | Very low | 29.2 | Very low | 75 Ų | 75 | 123.4 Ų | 123.4 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | cis | 165 | 161.3 | -8.2 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 125 | A | 31.7 | Very low | 29.2 | Very low | 104 Ų | 104 | 122.7 Ų | 122.7 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | trans | 68.2 | 142.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 126 | S | 29.7 | Very low | 29.2 | Very low | 114 Ų | 114 | 127.6 Ų | 127.6 | 80% | 0.797 | 81% | 0.807 | S | S | * | * | cis | 107.5 | 103.4 | -2.4 | -172.5 | 0 | 0 | 0 | 0 | 119 | ||||
| 127 | Y | 29.6 | Very low | 29.3 | Very low | 236 Ų | 236 | 123.9 Ų | 123.9 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | trans | -177.7 | 158.3 | 141.8 | 55.5 | -100.3 | 0 | 0 | 0 | 109 | ||||
| 128 | G | 31 | Very low | 29.4 | Very low | 61 Ų | 61 | 125.2 Ų | 125.2 | 63% | 0.629 | 81% | 0.805 | S | S | * | * | cis | -149.6 | 170.1 | -7.4 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 129 | Q | 28.7 | Very low | 29.4 | Very low | 168 Ų | 168 | 120.1 Ų | 120.1 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | 65.8 | 132.8 | 54.4 | -59.6 | -76.8 | 30.1 | 0 | 0 | 112.2 | |||||
| 130 | Q | 27 | Very low | 29.4 | Very low | 155 Ų | 155 | 118.9 Ų | 118.9 | 72% | 0.724 | 79% | 0.793 | S | S | * | * | cis | -169.5 | -178.1 | 3.4 | -149.1 | 163.1 | -3 | 0 | 0 | 112.7 | ||||
| 131 | S | 28 | Very low | 29.5 | Very low | 103 Ų | 103 | 125.1 Ų | 125.1 | 72% | 0.72 | 80% | 0.798 | S | S | * | * | trans | 76.8 | 130 | 160.7 | -54.8 | 0 | 0 | 0 | 0 | 119 | ||||
| 132 | T | 26.8 | Very low | 29.3 | Very low | 119 Ų | 119 | 127.1 Ų | 127.1 | 73% | 0.73 | 80% | 0.799 | S | S | * | * | cis | 100.1 | 139.8 | 0.6 | -34.7 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 133 | Y | 28.1 | Very low | 29.4 | Very low | 231 Ų | 231 | 124.9 Ų | 124.9 | 91% | 0.906 | 79% | 0.794 | S | S | * | * | trans | 73.3 | 140.1 | 179.9 | -75 | -81.8 | 0 | 0 | 0 | 117.7 | ||||
| 134 | G | 27.3 | Very low | 29.7 | Very low | 76 Ų | 76 | 126 Ų | 126 | 78% | 0.784 | 79% | 0.788 | S | S | * | * | cis | -173 | -178.8 | -4.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 135 | G | 30.4 | Very low | 29.9 | Very low | 68 Ų | 68 | 131.7 Ų | 131.7 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | cis | 168.4 | 169.8 | -3.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 136 | Q | 32.5 | Very low | 29.9 | Very low | 204 Ų | 204 | 130 Ų | 130 | 95% | 0.953 | 79% | 0.787 | S | S | * | * | trans | 72.2 | 155 | 174.7 | -52.8 | 173.5 | -10.3 | 0 | 0 | 118 | ||||
| 137 | S | 29 | Very low | 30.1 | Very low | 108 Ų | 108 | 134.5 Ų | 134.5 | 76% | 0.755 | 80% | 0.796 | S | S | * | * | cis | -176.3 | 138 | -32.8 | -174.8 | 0 | 0 | 0 | 0 | 111 | ||||
| 138 | S | 31.5 | Very low | 30.2 | Very low | 119 Ų | 119 | 127 Ų | 127 | 83% | 0.832 | 79% | 0.79 | S | S | * | * | trans | 164.3 | 128.8 | 135.6 | 46.1 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 139 | G | 29.8 | Very low | 30.2 | Very low | 87 Ų | 87 | 128.4 Ų | 128.4 | 90% | 0.897 | 80% | 0.804 | S | S | * | * | trans | 69.3 | 138.4 | 156.9 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 140 | G | 29.8 | Very low | 30.3 | Very low | 59 Ų | 59 | 124.2 Ų | 124.2 | 61% | 0.608 | 81% | 0.806 | S | S | * | * | cis | 158.6 | 112 | -14.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 141 | Y | 30.1 | Very low | 30.5 | Very low | 224 Ų | 224 | 121 Ų | 121 | 88% | 0.878 | 82% | 0.815 | S | S | * | * | trans | 53.7 | 148.9 | 156.3 | 73.7 | -94.7 | 0 | 0 | 0 | 121.5 | ||||
| 142 | D | 26.8 | Very low | 30.6 | Very low | 160 Ų | 160 | 120.1 Ų | 120.1 | 86% | 0.856 | 82% | 0.822 | S | S | * | * | cis | -167.3 | 168.2 | -24.8 | -104.1 | 127.5 | 0 | 0 | 0 | 108.7 | ||||
| 143 | G | 31.9 | Very low | 30.8 | Very low | 67 Ų | 67 | 118.5 Ų | 118.5 | 69% | 0.691 | 83% | 0.829 | S | S | * | * | cis | 163.9 | -2.5 | -3.6 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 144 | S | 33.9 | Very low | 31.2 | Very low | 107 Ų | 107 | 113.9 Ų | 113.9 | 75% | 0.748 | 83% | 0.831 | S | S | * | * | trans | -88.9 | 113.5 | -161.6 | 61.1 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 145 | Q | 33.6 | Very low | 31.3 | Very low | 196 Ų | 196 | 113.9 Ų | 113.9 | 92% | 0.916 | 83% | 0.831 | S | S | * | * | trans | 51.9 | 136.1 | 134.3 | -52.1 | 179.7 | 19 | 0 | 0 | 121.1 | ||||
| 146 | G | 32.8 | Very low | 31.4 | Very low | 67 Ų | 67 | 121.7 Ų | 121.7 | 69% | 0.691 | 84% | 0.84 | S | S | * | * | cis | 159.2 | 157.4 | -7.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 147 | Q | 34.3 | Very low | 31.2 | Very low | 210 Ų | 210 | 115.8 Ų | 115.8 | 98% | 0.981 | 83% | 0.834 | S | S | * | * | trans | 71.8 | 134.1 | 173.2 | -48 | 176.9 | 26 | 0 | 0 | 117 | ||||
| 148 | G | 31.1 | Very low | 31 | Very low | 78 Ų | 78 | 120 Ų | 120 | 80% | 0.804 | 83% | 0.834 | S | S | * | * | cis | 169.2 | 129.2 | -13.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 149 | G | 31.2 | Very low | 30.7 | Very low | 90 Ų | 90 | 123.9 Ų | 123.9 | 93% | 0.928 | 83% | 0.83 | S | S | * | * | trans | 83.3 | 143.6 | 160.6 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 150 | G | 29.5 | Very low | 30.6 | Very low | 80 Ų | 80 | 124.7 Ų | 124.7 | 83% | 0.825 | 82% | 0.822 | S | S | * | * | cis | 156.1 | 108.8 | -14.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 151 | G | 31.3 | Very low | 30.6 | Very low | 88 Ų | 88 | 131.6 Ų | 131.6 | 91% | 0.907 | 84% | 0.838 | S | S | * | * | trans | 71.7 | 156.9 | 163.5 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 152 | G | 30.4 | Very low | 30.5 | Very low | 85 Ų | 85 | 123.9 Ų | 123.9 | 88% | 0.876 | 83% | 0.827 | S | S | * | * | cis | 136.9 | 132.7 | -9.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 153 | G | 31.9 | Very low | 30.6 | Very low | 84 Ų | 84 | 126.5 Ų | 126.5 | 87% | 0.866 | 83% | 0.834 | S | S | * | * | trans | 124.9 | 133.9 | 164.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 154 | S | 35.3 | Very low | 30.4 | Very low | 135 Ų | 135 | 127.2 Ų | 127.2 | 94% | 0.944 | 84% | 0.841 | S | S | * | * | trans | -96.5 | 152.8 | 172 | -54.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 155 | G | 29.5 | Very low | 30.2 | Very low | 76 Ų | 76 | 126.2 Ų | 126.2 | 78% | 0.784 | 85% | 0.848 | S | S | * | * | trans | -166.1 | 150 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 156 | Y | 32.6 | Very low | 30.2 | Very low | 232 Ų | 232 | 120.7 Ų | 120.7 | 91% | 0.91 | 84% | 0.844 | S | S | * | * | trans | -121.2 | 146.4 | -179.8 | 43.4 | -96.8 | 0 | 0 | 0 | 109.5 | ||||
| 157 | G | 29.9 | Very low | 30.3 | Very low | 80 Ų | 80 | 127.2 Ų | 127.2 | 83% | 0.825 | 86% | 0.856 | S | S | * | * | trans | -177.6 | 111.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 158 | R | 24.3 | Very low | 30.2 | Very low | 197 Ų | 197 | 120.9 Ų | 120.9 | 74% | 0.743 | 85% | 0.847 | S | S | * | * | trans | -76.6 | 151.8 | 157.8 | -135.8 | 171.5 | 173 | -173.7 | 0.7 | 107.1 | ||||
| 159 | W | 24.3 | Very low | 30.6 | Very low | 200 Ų | 200 | 120.9 Ų | 120.9 | 76% | 0.758 | 85% | 0.847 | S | S | * | * | cis | -158.3 | -171.3 | 45.8 | -83.5 | 103.1 | 0 | 0 | 0 | 112.4 | ||||
| 160 | S | 29 | Very low | 30.5 | Very low | 103 Ų | 103 | 128.4 Ų | 128.4 | 72% | 0.72 | 85% | 0.848 | S | S | * | * | trans | -96.7 | 151.1 | -169.5 | -32 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 161 | E | 29 | Very low | 30.7 | Very low | 204 Ų | 204 | 135 Ų | 135 | 95% | 0.953 | 85% | 0.854 | S | S | * | * | trans | -172.2 | 145.7 | 138.6 | -102 | 177.6 | 141.7 | 0 | 0 | 106.7 | ||||
| 162 | G | 28 | Very low | 30.6 | Very low | 63 Ų | 63 | 134.4 Ų | 134.4 | 65% | 0.649 | 85% | 0.848 | S | S | * | * | cis | -167.8 | 173.8 | -7 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 163 | E | 27.7 | Very low | 30.5 | Very low | 215 Ų | 215 | 140.8 Ų | 140.8 | 100% | 1.005 | 85% | 0.846 | S | S | * | * | trans | 65.3 | 154.6 | 176.1 | -55 | -169.6 | 82.8 | 0 | 0 | 118.3 | ||||
| 164 | G | 29 | Very low | 30.5 | Very low | 81 Ų | 81 | 143.3 Ų | 143.3 | 84% | 0.835 | 84% | 0.84 | S | S | * | * | trans | 153.6 | -34.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 165 | G | 29.5 | Very low | 30.4 | Very low | 86 Ų | 86 | 140.6 Ų | 140.6 | 89% | 0.887 | 83% | 0.833 | S | S | * | * | trans | 77.8 | 122.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 166 | G | 33.2 | Very low | 30.5 | Very low | 80 Ų | 80 | 141.4 Ų | 141.4 | 83% | 0.825 | 83% | 0.832 | S | S | * | * | trans | -175.6 | 66.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 167 | Q | 34.3 | Very low | 30.6 | Very low | 205 Ų | 205 | 138.2 Ų | 138.2 | 96% | 0.958 | 83% | 0.831 | S | S | * | * | trans | -79.3 | 145.5 | 177.3 | -54.2 | 171.4 | 27.5 | 0 | 0 | 110.3 | ||||
| 168 | G | 32.4 | Very low | 30.6 | Very low | 77 Ų | 77 | 146.2 Ų | 146.2 | 79% | 0.794 | 84% | 0.836 | S | S | * | * | cis | 157.7 | 99.7 | -4.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 169 | G | 39.6 | Very low | 30.9 | Very low | 78 Ų | 78 | 141.3 Ų | 141.3 | 80% | 0.804 | 83% | 0.832 | S | S | * | * | trans | -93.8 | 141.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 170 | R | 30.4 | Very low | 31.2 | Very low | 247 Ų | 247 | 140.3 Ų | 140.3 | 93% | 0.932 | 84% | 0.835 | S | S | * | * | trans | -143.2 | 160.3 | 167.6 | -69.3 | -167.3 | -172.2 | -97.3 | 3.2 | 111.2 | ||||
| 171 | F | 32.4 | Very low | 31.2 | Very low | 219 Ų | 219 | 139.2 Ų | 139.2 | 96% | 0.961 | 84% | 0.841 | S | S | * | * | trans | -101.6 | 161.4 | -172.3 | -63.1 | -98.6 | 0 | 0 | 0 | 113 | ||||
| 172 | G | 29.3 | Very low | 31.3 | Very low | 76 Ų | 76 | 133.5 Ų | 133.5 | 78% | 0.784 | 84% | 0.837 | S | S | * | * | trans | 124.1 | 144.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 173 | R | 28.5 | Very low | 31.5 | Very low | 218 Ų | 218 | 134.7 Ų | 134.7 | 82% | 0.823 | 85% | 0.849 | S | S | * | * | cis | -158.2 | 171.6 | 1.7 | -153.9 | -160 | -111.9 | -150.4 | -0.1 | 109.6 | ||||
| 174 | D | 32.2 | Very low | 31.6 | Very low | 138 Ų | 138 | 128.1 Ų | 128.1 | 74% | 0.738 | 84% | 0.838 | S | S | * | * | trans | 66 | 119.1 | 160.1 | -53.2 | -43.1 | 0 | 0 | 0 | 118.4 | ||||
| 175 | G | 33.9 | Very low | 31.9 | Very low | 78 Ų | 78 | 134 Ų | 134 | 80% | 0.804 | 84% | 0.842 | S | S | * | * | trans | -104.8 | 152.8 | 158.5 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 176 | A | 30.9 | Very low | 32.1 | Very low | 93 Ų | 93 | 142.1 Ų | 142.1 | 77% | 0.769 | 85% | 0.846 | S | S | * | * | trans | -153.3 | 100.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 177 | D | 34.2 | Very low | 32.1 | Very low | 165 Ų | 165 | 141.6 Ų | 141.6 | 88% | 0.882 | 84% | 0.84 | S | S | * | * | trans | -67.5 | 129.8 | 171.6 | -46.3 | -97.9 | 0 | 0 | 0 | 110.4 | ||||
| 178 | R | 30.6 | Very low | 32 | Very low | 248 Ų | 248 | 143.6 Ų | 143.6 | 94% | 0.936 | 84% | 0.839 | S | S | * | * | trans | -141 | 149.4 | 164.6 | -74.7 | -161.6 | 171.5 | 164.7 | 0.9 | 112 | ||||
| 179 | S | 31.6 | Very low | 32 | Very low | 93 Ų | 93 | 143.6 Ų | 143.6 | 65% | 0.65 | 84% | 0.839 | S | S | * | * | trans | -99.6 | 170.7 | -161.8 | -158.5 | 0 | 0 | 0 | 0 | 114 | ||||
| 180 | E | 30.2 | Very low | 31.8 | Very low | 179 Ų | 179 | 151.8 Ų | 151.8 | 84% | 0.836 | 85% | 0.846 | S | S | * | * | trans | 51.1 | 114.3 | 151.3 | -76.5 | 150.7 | 95.5 | 0 | 0 | 121 | ||||
| 181 | G | 28.4 | Very low | 31.9 | Very low | 81 Ų | 81 | 144 Ų | 144 | 84% | 0.835 | 84% | 0.842 | S | S | * | * | 102.3 | 156.8 | 106.2 | 0 | 0 | 0 | 0 | 0 | 119 | |||||
| 182 | G | 30.8 | Very low | 32.1 | Very low | 84 Ų | 84 | 136.5 Ų | 136.5 | 87% | 0.866 | 83% | 0.827 | S | S | * | * | trans | 92 | 112.7 | 164.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 183 | G | 32.4 | Very low | 32.4 | Very low | 87 Ų | 87 | 142.6 Ų | 142.6 | 90% | 0.897 | 83% | 0.832 | S | S | * | * | trans | -94.7 | 153 | 157 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 184 | G | 29.2 | Very low | 32.8 | Very low | 77 Ų | 77 | 139.6 Ų | 139.6 | 79% | 0.794 | 83% | 0.832 | S | S | * | * | trans | -177.8 | 127.9 | 177 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 185 | F | 36.5 | Very low | 32.8 | Very low | 205 Ų | 205 | 145.2 Ų | 145.2 | 90% | 0.899 | 84% | 0.843 | S | S | * | * | trans | -85.7 | 135 | 177.8 | -58.6 | -100.7 | 0 | 0 | 0 | 112.4 | ||||
| 186 | R | 33.7 | Very low | 32.7 | Very low | 257 Ų | 257 | 144.6 Ų | 144.6 | 97% | 0.97 | 84% | 0.837 | S | S | * | * | trans | 172.6 | 139.4 | 146 | -101.1 | 167.4 | -99.7 | -154.2 | -2.5 | 110 | ||||
| 187 | G | 33.2 | Very low | 33.2 | Very low | 69 Ų | 69 | 145.9 Ų | 145.9 | 71% | 0.711 | 84% | 0.841 | S | S | * | * | cis | 164.5 | 162.7 | -12.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 188 | R | 31.4 | Very low | 33.3 | Very low | 246 Ų | 246 | 148.2 Ų | 148.2 | 93% | 0.928 | 84% | 0.838 | S | S | * | * | trans | 58.2 | 100.3 | 159.5 | -171.9 | -177.9 | -74.8 | -147.3 | -2.5 | 118.7 | ||||
| 189 | G | 31.8 | Very low | 33.4 | Very low | 78 Ų | 78 | 142.7 Ų | 142.7 | 80% | 0.804 | 83% | 0.828 | S | S | * | * | trans | -130.5 | 142.5 | 151.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 190 | R | 35.4 | Very low | 33.3 | Very low | 250 Ų | 250 | 149.3 Ų | 149.3 | 94% | 0.943 | 84% | 0.838 | S | S | * | * | trans | -93 | 148.8 | -179.4 | -68.4 | -179 | -179.7 | -102.4 | 12.1 | 111.4 | ||||
| 191 | G | 33.7 | Very low | 33.4 | Very low | 83 Ų | 83 | 146.8 Ų | 146.8 | 86% | 0.856 | 84% | 0.84 | S | S | * | * | trans | 165.4 | 114.6 | 160.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 192 | G | 36.8 | Very low | 33.5 | Very low | 62 Ų | 62 | 147 Ų | 147 | 64% | 0.639 | 84% | 0.842 | S | S | * | * | trans | -175.3 | 134.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 193 | F | 35.1 | Very low | 33.5 | Very low | 204 Ų | 204 | 146.3 Ų | 146.3 | 90% | 0.895 | 84% | 0.836 | S | S | * | * | trans | -145.8 | 142.6 | 169.1 | -27.2 | -79.7 | 0 | 0 | 0 | 108.7 | ||||
| 194 | D | 37.5 | Very low | 33.6 | Very low | 155 Ų | 155 | 152.8 Ų | 152.8 | 83% | 0.829 | 84% | 0.835 | S | S | * | * | trans | -94 | -174.9 | -170.8 | -56.2 | -101.2 | 0 | 0 | 0 | 114.6 | ||||
| 195 | R | 31.8 | Very low | 33.9 | Very low | 255 Ų | 255 | 156.2 Ų | 156.2 | 96% | 0.962 | 84% | 0.835 | S | S | * | * | trans | 88.7 | 145.4 | 171.7 | -50.5 | 175.9 | -172.2 | -167.9 | 2.5 | 115.2 | ||||
| 196 | G | 31.4 | Very low | 33.9 | Very low | 66 Ų | 66 | 158.4 Ų | 158.4 | 68% | 0.68 | 84% | 0.837 | S | S | * | * | cis | 175.2 | 159.2 | -4.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 197 | S | 41.2 | Very low | 33.9 | Very low | 120 Ų | 120 | 149.8 Ų | 149.8 | 84% | 0.839 | 83% | 0.829 | S | S | * | * | trans | -70.6 | 140.3 | -177.2 | -174.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 198 | Y | 36.2 | Very low | 34 | Very low | 213 Ų | 213 | 149.6 Ų | 149.6 | 84% | 0.835 | 83% | 0.826 | S | S | * | * | trans | -161.5 | 170.2 | 145 | 60.7 | -94.1 | 0 | 0 | 0 | 112.1 | ||||
| 199 | D | 34.2 | Very low | 34.2 | Very low | 133 Ų | 133 | 147.6 Ų | 147.6 | 71% | 0.711 | 82% | 0.82 | S | S | * | * | trans | -96.8 | 154.9 | -156.8 | -57.5 | -120.3 | 0 | 0 | 0 | 116.1 | ||||
| 200 | R | 29.6 | Very low | 34.3 | Very low | 231 Ų | 231 | 150.9 Ų | 150.9 | 87% | 0.872 | 82% | 0.82 | S | S | * | * | 46.7 | 109.2 | 126.5 | -172.3 | -169.5 | -163.5 | 169.8 | 4.2 | 119.5 | |||||
| 201 | S | 32 | Very low | 34.5 | Very low | 126 Ų | 126 | 151 Ų | 151 | 88% | 0.881 | 82% | 0.82 | S | S | * | * | trans | -163.4 | 162.2 | 136 | -85.6 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 202 | G | 30.9 | Very low | 34.5 | Very low | 85 Ų | 85 | 150.2 Ų | 150.2 | 88% | 0.876 | 81% | 0.812 | S | S | * | * | trans | -73.4 | -177.4 | -171.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 203 | G | 30.5 | Very low | 34.5 | Very low | 71 Ų | 71 | 151.2 Ų | 151.2 | 73% | 0.732 | 82% | 0.823 | S | S | * | * | cis | 133.5 | 127.7 | 1.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 204 | Y | 34.5 | Very low | 34.6 | Very low | 222 Ų | 222 | 151.4 Ų | 151.4 | 87% | 0.871 | 82% | 0.819 | S | S | * | * | trans | -163.6 | 161.7 | 166.3 | 52.9 | -101.9 | 0 | 0 | 0 | 112.4 | ||||
| 205 | D | 33.7 | Very low | 34.8 | Very low | 150 Ų | 150 | 152 Ų | 152 | 80% | 0.802 | 82% | 0.822 | S | S | * | * | trans | -89.8 | 148.1 | -162.6 | -53.7 | -108.7 | 0 | 0 | 0 | 116.3 | ||||
| 206 | R | 37.5 | Very low | 35.1 | Very low | 250 Ų | 250 | 151.1 Ų | 151.1 | 94% | 0.943 | 82% | 0.819 | S | S | * | * | trans | 178.5 | 135 | 137 | -97.4 | 165.4 | -166.8 | -163.9 | 4.6 | 108.2 | ||||
| 207 | G | 33.2 | Very low | 35.4 | Very low | 77 Ų | 77 | 151.6 Ų | 151.6 | 79% | 0.794 | 82% | 0.824 | S | S | * | * | cis | 111.1 | 88.7 | 8.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 208 | G | 35.6 | Very low | 35.5 | Very low | 64 Ų | 64 | 149.3 Ų | 149.3 | 66% | 0.66 | 82% | 0.819 | S | S | * | * | trans | -172.6 | 58 | -168.3 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 209 | Y | 35.8 | Very low | 35.6 | Very low | 205 Ų | 205 | 151.4 Ų | 151.4 | 80% | 0.804 | 83% | 0.825 | S | S | * | * | trans | 12.8 | 129 | 158.9 | 54.3 | -91.8 | 0 | 0 | 0 | 122.4 | ||||
| 210 | D | 34.7 | Very low | 35.6 | Very low | 147 Ų | 147 | 149 Ų | 149 | 79% | 0.786 | 83% | 0.832 | S | S | * | * | 36.4 | 112 | 129.5 | -58.8 | -92.7 | 0 | 0 | 0 | 122.2 | |||||
| 211 | R | 38 | Very low | 36.5 | Very low | 251 Ų | 251 | 141.8 Ų | 141.8 | 95% | 0.947 | 83% | 0.829 | S | S | * | * | -160.6 | 116.9 | 98.1 | -107.8 | -178 | -173.3 | -170.9 | 3.4 | 112.3 | |||||
| 212 | G | 35.4 | Very low | 37.1 | Very low | 68 Ų | 68 | 142.1 Ų | 142.1 | 70% | 0.701 | 83% | 0.828 | S | S | * | * | trans | -84.6 | 134.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 213 | G | 35 | Very low | 37.6 | Very low | 83 Ų | 83 | 142.9 Ų | 142.9 | 86% | 0.856 | 83% | 0.827 | S | S | * | * | trans | -86.5 | 127.8 | 156.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 214 | Y | 37.9 | Very low | 38.4 | Very low | 207 Ų | 207 | 143.3 Ų | 143.3 | 81% | 0.812 | 83% | 0.83 | S | S | * | * | trans | -116.9 | 116.1 | 174.3 | 51.5 | -93.1 | 0 | 0 | 0 | 110.8 | R216 | Y214-R216 PolarHBondContact O-N 3.09Š| ||
| 215 | D | 42.4 | Very low | 38.8 | Very low | 169 Ų | 169 | 142.2 Ų | 142.2 | 90% | 0.904 | 84% | 0.836 | S | S | * | * | trans | -66.5 | 126.6 | 164.3 | -71.5 | -85.2 | 0 | 0 | 0 | 110.2 | ||||
| 216 | R | 38.2 | Very low | 39.1 | Very low | 236 Ų | 236 | 138.8 Ų | 138.8 | 89% | 0.891 | 84% | 0.836 | S | S | * | * | trans | -139.5 | 93 | 159.8 | -172.7 | -179.6 | -72.6 | -166.2 | -0.9 | 109.5 | Y214 | Y214-R216 PolarHBondContact O-N 3.09Š| ||
| 217 | G | 37.5 | Very low | 39.6 | Very low | 76 Ų | 76 | 130.7 Ų | 130.7 | 78% | 0.784 | 83% | 0.831 | S | S | * | * | trans | -78.5 | 153.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 218 | G | 43.3 | Very low | 39.9 | Very low | 71 Ų | 71 | 130.5 Ų | 130.5 | 73% | 0.732 | 83% | 0.828 | S | S | * | * | trans | 81.3 | 100.5 | 140.4 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 219 | R | 36.7 | Very low | 40.6 | Very low | 258 Ų | 258 | 135 Ų | 135 | 97% | 0.974 | 84% | 0.837 | S | S | * | * | 175.8 | 150.1 | 116.4 | -94 | 165.1 | -163.2 | -123.8 | 4.6 | 111 | |||||
| 220 | G | 34.2 | Very low | 41.1 | Very low | 83 Ų | 83 | 136.9 Ų | 136.9 | 86% | 0.856 | 84% | 0.843 | S | S | * | * | trans | 95.1 | 102.2 | 169.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 221 | G | 48.7 | Very low | 41.3 | Very low | 78 Ų | 78 | 133.2 Ų | 133.2 | 80% | 0.804 | 84% | 0.839 | S | S | * | * | trans | -107.4 | 145 | 164 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 222 | P | 45.9 | Very low | 41.6 | Very low | 133 Ų | 133 | 125.3 Ų | 125.3 | 86% | 0.864 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 172.5 | 169.7 | 36 | -31.9 | 0 | 0 | 0 | 112.5 | ||
| 223 | A | 40.2 | Very low | 41.9 | Very low | 102 Ų | 102 | 131.8 Ų | 131.8 | 84% | 0.843 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 162.2 | -174.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 224 | G | 48.4 | Very low | 42.6 | Very low | 79 Ų | 79 | 136.5 Ų | 136.5 | 81% | 0.814 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -81.5 | 134.6 | -177 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 225 | M | 42.8 | Very low | 42.8 | Very low | 199 Ų | 199 | 132.7 Ų | 132.7 | 98% | 0.98 | 83% | 0.832 | S | S | * | * | trans | -142.1 | 148.5 | 157.7 | -62.3 | -179.5 | -179.2 | 0 | 0 | 106.9 | ||||
| 226 | G | 40.7 | Very low | 42.8 | Very low | 78 Ų | 78 | 134.1 Ų | 134.1 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | cis | 144.8 | 71.4 | -2.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 227 | G | 48 | Very low | 42.8 | Very low | 81 Ų | 81 | 126.6 Ų | 126.6 | 84% | 0.835 | 83% | 0.827 | S | S | * | * | trans | 79.2 | 158.4 | 177 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 228 | G | 38.6 | Very low | 42.7 | Very low | 72 Ų | 72 | 126.3 Ų | 126.3 | 74% | 0.742 | 82% | 0.824 | S | S | * | * | trans | 164.2 | 45.3 | -173.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 229 | D | 49.8 | Very low | 42.6 | Very low | 159 Ų | 159 | 127.2 Ų | 127.2 | 85% | 0.85 | 82% | 0.818 | S | S | * | * | trans | -60.2 | 129.6 | -168.9 | -59.7 | -108.3 | 0 | 0 | 0 | 114.7 | ||||
| 230 | R | 47 | Very low | 43.2 | Very low | 245 Ų | 245 | 125.7 Ų | 125.7 | 93% | 0.925 | 81% | 0.813 | S | S | * | * | trans | -141 | 115.7 | 159.6 | -75.1 | -167 | -179.6 | 172.9 | 2.2 | 112.3 | ||||
| 231 | G | 38.7 | Very low | 43.5 | Very low | 69 Ų | 69 | 128.1 Ų | 128.1 | 71% | 0.711 | 81% | 0.806 | S | S | * | * | trans | 74.3 | 52.7 | 143.9 | 0 | 0 | 0 | 0 | 0 | 117.7 | Y233 | G231-Y233 PolarHBondContact O-N 2.98Š| ||
| 232 | G | 44.7 | Very low | 43.3 | Very low | 86 Ų | 86 | 135 Ų | 135 | 89% | 0.887 | 81% | 0.809 | S | S | * | * | trans | -73.6 | 120.2 | 161.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 233 | Y | 41.6 | Very low | 42.9 | Very low | 203 Ų | 203 | 131.6 Ų | 131.6 | 80% | 0.796 | 80% | 0.798 | S | S | * | * | trans | -140.8 | 117.8 | 158.3 | 56.1 | -92.4 | 0 | 0 | 0 | 112.3 | G231 | G231-Y233 PolarHBondContact O-N 2.98Š| ||
| 234 | K | 49.9 | Very low | 43.1 | Very low | 182 Ų | 182 | 130.6 Ų | 130.6 | 79% | 0.791 | 79% | 0.785 | S | S | * | * | trans | 49.1 | 105.1 | 140.1 | -58.9 | 173.6 | -172.6 | 178.2 | 0 | 115.5 | ||||
| 235 | N | 41.3 | Very low | 43.2 | Very low | 128 Ų | 128 | 138.5 Ų | 138.5 | 68% | 0.684 | 79% | 0.79 | S | S | * | * | cis | -168.4 | 171.6 | 42.8 | -78.3 | -41.8 | 0 | 0 | 0 | 113.8 | ||||
| 236 | F | 42.4 | Very low | 43.5 | Very low | 198 Ų | 198 | 135.9 Ų | 135.9 | 87% | 0.868 | 78% | 0.781 | S | S | * | * | trans | 58.6 | 53.1 | 159.2 | -51.3 | -52.4 | 0 | 0 | 0 | 118.6 | G238 | F236-G238 PolarHBondContact O-N 2.97Š| ||
| 237 | G | 38.1 | Very low | 43.6 | Very low | 79 Ų | 79 | 140.2 Ų | 140.2 | 81% | 0.814 | 78% | 0.78 | S | S | * | * | trans | -73.7 | 109 | 148.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 238 | G | 36 | Very low | 43.3 | Very low | 70 Ų | 70 | 141.5 Ų | 141.5 | 72% | 0.722 | 78% | 0.776 | S | S | * | * | trans | -60.7 | 144.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | F236 | F236-G238 PolarHBondContact O-N 2.97Š| ||
| 239 | S | 40.8 | Very low | 44 | Very low | 89 Ų | 89 | 143.6 Ų | 143.6 | 62% | 0.622 | 79% | 0.786 | S | S | * | * | trans | -61.4 | 143 | -173.9 | -171 | 0 | 0 | 0 | 0 | 112 | D241 | S239-D241 VanDerWaalsContact CB-OD1 3.3Å; S239-D241 WeakPolarHBondContact CB-OD1 3.49Å; S239-D241 WeakPolarHBondContact CB-OD2 3.49Å; S239-D241 PolarHBondContact O-N 2.75Å; S239-D241 VanDerWaalsContact O-N 3.12Å; S239-D241 VanDerWaalsContact OG-CG 3.3Å; S239-D241 PolarHBondContact OG-OD1 2.85Å | ||
| 240 | R | 50.5 | Low | 44.1 | Very low | 227 Ų | 227 | 138 Ų | 138 | 86% | 0.857 | 77% | 0.766 | S | S | * | * | trans | -86.7 | 62.3 | 168.7 | -71.4 | -177.8 | 177.8 | 159.9 | 0.3 | 109.2 | Y242 | R240-Y242 VanDerWaalsContact C-N 3.33Å; R240-Y242 PolarHBondContact O-N 2.77Å | ||
| 241 | D | 39.8 | Very low | 44.4 | Very low | 134 Ų | 134 | 134 Ų | 134 | 72% | 0.717 | 76% | 0.763 | S | S | * | * | trans | -68.1 | 95.8 | 174.8 | -58.9 | -36.3 | 0 | 0 | 0 | 108.1 | S239 G243 | S239-D241 VanDerWaalsContact CB-OD1 3.3Å; S239-D241 WeakPolarHBondContact CB-OD1 3.49Å; S239-D241 WeakPolarHBondContact CB-OD2 3.49Å; S239-D241 PolarHBondContact O-N 2.75Å; S239-D241 VanDerWaalsContact O-N 3.12Å; S239-D241 VanDerWaalsContact OG-CG 3.3Å; S239-D241 PolarHBondContact OG-OD1 2.85Å; D241-G243 PolarHBondContact O-N 2.88Å | ||
| 242 | Y | 43.3 | Very low | 45.3 | Very low | 222 Ų | 222 | 138.7 Ų | 138.7 | 87% | 0.871 | 77% | 0.766 | S | S | * | * | trans | -68.8 | 78.2 | 165.5 | -94.7 | -92.9 | 0 | 0 | 0 | 108 | R240 | R240-Y242 VanDerWaalsContact C-N 3.33Å; R240-Y242 PolarHBondContact O-N 2.77Å | ||
| 243 | G | 38.9 | Very low | 45.8 | Very low | 61 Ų | 61 | 141 Ų | 141 | 63% | 0.629 | 76% | 0.758 | S | S | * | * | trans | -52.3 | 142.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111 | D241 R245 | D241-G243 PolarHBondContact O-N 2.88Å; G243-R245 PolarHBondContact O-N 2.96Å | ||
| 244 | S | 44.5 | Very low | 46.7 | Very low | 81 Ų | 81 | 132.7 Ų | 132.7 | 57% | 0.566 | 73% | 0.728 | S | S | * | * | trans | -27.8 | 109.6 | -171.3 | -166 | 0 | 0 | 0 | 0 | 114 | D246 E247 | S244-D246 VanDerWaalsContact C-N 3.31Å; S244-D246 PolarHBondContact OG-O 3.29Å; S244-E247 WeakPolarHBondContact CB-OE2 3.42Å; S244-E247 PolarHBondContact OG-OE2 3.35Å | ||
| 245 | R | 49.6 | Very low | 47.2 | Very low | 245 Ų | 245 | 126.7 Ų | 126.7 | 93% | 0.925 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -101.1 | 38.8 | 167.2 | -160.5 | -153.1 | 156.7 | 108.5 | 0.6 | 110.9 | G243 | G243-R245 PolarHBondContact O-N 2.96Š|
| 246 | D | 49.5 | Very low | 48.4 | Very low | 145 Ų | 145 | 127 Ų | 127 | 78% | 0.775 | 71% | 0.71 | S | S | * | * | trans | -151.8 | 78.5 | 165.9 | -167.1 | -134.3 | 0 | 0 | 0 | 109.4 | S244 | S244-D246 VanDerWaalsContact C-N 3.31Å; S244-D246 PolarHBondContact OG-O 3.29Å | ||
| 247 | E | 41.8 | Very low | 50.2 | Low | 168 Ų | 168 | 117.7 Ų | 117.7 | 79% | 0.785 | 67% | 0.67 | S | S | * | * | trans | -146.4 | 154.9 | 167 | -114.1 | 157.7 | 129.1 | 0 | 0 | 110.3 | S244 | S244-E247 WeakPolarHBondContact CB-OE2 3.42Å; S244-E247 PolarHBondContact OG-OE2 3.35Å | ||
| 248 | S | 42.5 | Very low | 52.5 | Low | 109 Ų | 109 | 115.9 Ų | 115.9 | 76% | 0.762 | 64% | 0.641 | S | S | * | * | trans | -62.5 | 153.8 | -147.1 | -164.1 | 0 | 0 | 0 | 0 | 116 | G250 | S248-G250 PolarHBondContact O-N 3.19Š| ||
| 249 | A | 53.2 | Low | 55 | Low | 116 Ų | 116 | 114 Ų | 114 | 96% | 0.959 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -75.9 | 46.5 | 161 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 250 | G | 52.7 | Low | 57.4 | Low | 40 Ų | 40 | 109.7 Ų | 109.7 | 41% | 0.412 | 59% | 0.586 | S | S | . | * | trans | -103.1 | 151.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | S248 | S248-G250 PolarHBondContact O-N 3.19Š| ||
| 251 | D | 53.1 | Low | 59.4 | Low | 163 Ų | 163 | 101.4 Ų | 101.4 | 87% | 0.872 | 56% | 0.556 | S | S | * | * | trans | 41.4 | 79.5 | 159.9 | -54.3 | -66.1 | 0 | 0 | 0 | 116.2 | D253 | D251-D253 PolarHBondContact O-N 3.06Š| ||
| 252 | Q | 56.8 | Low | 61.8 | Low | 167 Ų | 167 | 95 Ų | 95 | 78% | 0.78 | 52% | 0.522 | S | S | * | . | trans | -56.6 | 122.5 | 150.4 | -70.9 | 178.6 | 37.2 | 0 | 0 | 107 | N254 | Q252-N254 VanDerWaalsContact C-N 3.34Å; Q252-N254 WeakPolarHBondContact O-CB 3.44Å; Q252-N254 PolarHBondContact O-N 3.28Å | ||
| 253 | D | 54.9 | Low | 64 | Low | 134 Ų | 134 | 88.5 Ų | 88.5 | 72% | 0.717 | 50% | 0.499 | S | S | * | . | trans | -61.6 | 96.6 | -178.9 | -159.7 | -40.1 | 0 | 0 | 0 | 109.6 | D251 S255 | D251-D253 PolarHBondContact O-N 3.06Å; D253-S255 PolarHBondContact O-N 3.32Å; D253-S255 VanDerWaalsContact OD1-CB 3.3Å; D253-S255 WeakPolarHBondContact OD1-CB 3.39Å; D253-S255 PolarHBondContact OD1-OG 2.93Å | ||
| 254 | N | 61.6 | Low | 66.3 | Low | 29 Ų | 29 | 86.7 Ų | 86.7 | 16% | 0.155 | 48% | 0.481 | C | S | . | . | trans | -90.8 | 9.2 | -164.1 | -147.6 | 32.6 | 0 | 0 | 0 | 111.3 | Q252 D256 N257 F341 A342 | Q252-N254 VanDerWaalsContact C-N 3.34Å; Q252-N254 WeakPolarHBondContact O-CB 3.44Å; Q252-N254 PolarHBondContact O-N 3.28Å; N254-D256 PolarHBondContact O-N 3.21Å; N254-N257 VanDerWaalsContact CG-ND2 3.31Å; N254-N257 PolarHBondContact ND2-ND2 3.38Å; N254-N257 WeakPolarHBondContact O-CB 3.35Å; N254-N257 PolarHBondContact O-N 2.81Å; N254-N257 VanDerWaalsContact OD1-CG 3.24Å; N254-N257 PolarHBondContact OD1-ND2 3.11Å; N254-F341 HydrophobicContact CB-CB 4.16Å; N254-F341 HydrophobicContact CB-CG 4.41Å; N254-F341 VanDerWaalsContact ND2-CB 3.34Å; N254-F341 WeakPolarHBondContact ND2-CB 3.33Å; N254-F341 WeakPolarHBondContact O-CD1 3.12Å; N254-A342 PolarHBondContact ND2-O 3.23Å | ||
| 255 | S | 60.1 | Low | 68.1 | Low | 55 Ų | 55 | 82.9 Ų | 82.9 | 39% | 0.385 | 45% | 0.454 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.7 | -26.7 | -172.7 | -59.4 | 0 | 0 | 0 | 0 | 114 | D253 N257 | D253-S255 PolarHBondContact O-N 3.32Å; D253-S255 VanDerWaalsContact OD1-CB 3.3Å; D253-S255 WeakPolarHBondContact OD1-CB 3.39Å; D253-S255 PolarHBondContact OD1-OG 2.93Å; S255-N257 VanDerWaalsContact C-N 3.31Å; S255-N257 PolarHBondContact O-N 2.06Å |
| 256 | D | 66 | Low | 69.4 | Low | 134 Ų | 134 | 71.5 Ų | 71.5 | 72% | 0.717 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.3 | -8 | 175.8 | -67.6 | -28.9 | 0 | 0 | 0 | 113.8 | N254 N258 | N254-D256 PolarHBondContact O-N 3.21Å; D256-N258 PolarHBondContact O-N 2.88Å |
| 257 | N | 80.1 | Confident | 70.8 | Confident | 4 Ų | 4 | 68.8 Ų | 68.8 | 2% | 0.021 | 40% | 0.396 | C | S | . | . | trans | -78.1 | 106.4 | 179.4 | -75.2 | 5.6 | 0 | 0 | 0 | 111.2 | N254 S255 T259 F341 A342 R344 | N254-N257 VanDerWaalsContact CG-ND2 3.31Å; N254-N257 PolarHBondContact ND2-ND2 3.38Å; N254-N257 WeakPolarHBondContact O-CB 3.35Å; N254-N257 PolarHBondContact O-N 2.81Å; N254-N257 VanDerWaalsContact OD1-CG 3.24Å; N254-N257 PolarHBondContact OD1-ND2 3.11Å; S255-N257 VanDerWaalsContact C-N 3.31Å; S255-N257 PolarHBondContact O-N 2.06Å; N257-T259 PolarHBondContact O-N 3.11Å; N257-F341 HydrophobicContact CB-CD1 4.33Å; N257-A342 PolarHBondContact ND2-O 3.45Å; N257-R344 PolarHBondContact ND2-NE 2.82Å; N257-R344 PolarHBondContact OD1-NE 3.12Å; N257-R344 PolarHBondContact OD1-NH2 3.09Å | ||
| 258 | N | 87.1 | Confident | 72.5 | Confident | 41 Ų | 41 | 65.3 Ų | 65.3 | 22% | 0.219 | 38% | 0.383 | C | S | . | . | trans | -66.2 | 13.8 | 164.8 | 66.8 | -4.7 | 0 | 0 | 0 | 114.7 | D256 F314 D315 P317 | D256-N258 PolarHBondContact O-N 2.88Å; N258-F314 PolarHBondContact ND2-O 3.41Å; N258-F314 VanDerWaalsContact ND2-O 3.13Å; N258-F314 WeakPolarHBondContact O-CA 3.36Å; N258-F314 WeakPolarHBondContact O-CB 3.48Å; N258-F314 PolarHBondContact O-N 2.75Å; N258-D315 PolarHBondContact ND2-O 3.19Å; N258-D315 VanDerWaalsContact ND2-O 3.11Å; N258-P317 HydrophobicContact CB-CB 4.41Å; N258-P317 HydrophobicContact CB-CG 4.14Å | ||
| 259 | T | 88.8 | Confident | 74.3 | Confident | 29 Ų | 29 | 60.7 Ų | 60.7 | 18% | 0.178 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.7 | 125.4 | 178.5 | -51.6 | 0 | 0 | 0 | 0 | 109.6 | N257 V312 A342 | N257-T259 PolarHBondContact O-N 3.11Å; T259-V312 WeakPolarHBondContact CA-O 3.24Å; T259-A342 HydrophobicContact CG2-CB 3.79Å; T259-A342 VanDerWaalsContact O-CB 3.24Å; T259-A342 WeakPolarHBondContact O-CB 3.28Å; T259-A342 PolarHBondContact O-N 3.43Å |
| 260 | I | 91.4 | Very high | 75.8 | Confident | 0 Ų | 0 | 58.2 Ų | 58.2 | 0% | 0 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 153.7 | 174.3 | 63.8 | 166.4 | 0 | 0 | 0 | 110.8 | V262 F278 T311 V312 F314 A320 A323 I324 V339 S340 | I260-V262 HydrophobicContact CD1-CG2 3.77Å; I260-V262 HydrophobicContact CG1-CG2 4.19Å; I260-F278 HydrophobicContact CD1-CD1 3.55Å; I260-F278 HydrophobicContact CD1-CE1 3.4Å; I260-F278 HydrophobicContact CD1-CG 4.33Å; I260-F278 HydrophobicContact CD1-CZ 4.09Å; I260-T311 WeakPolarHBondContact O-CA 3.21Å; I260-V312 HydrophobicContact CD1-CB 4.16Å; I260-V312 HydrophobicContact CG1-CB 3.75Å; I260-V312 HydrophobicContact CG1-CG2 4.43Å; I260-V312 PolarHBondContact N-O 3.48Å; I260-V312 PolarHBondContact O-N 2.65Å; I260-F314 HydrophobicContact CD1-CE2 3.69Å; I260-F314 HydrophobicContact CD1-CZ 4.24Å; I260-F314 HydrophobicContact CG1-CD2 4.48Å; I260-F314 HydrophobicContact CG1-CE2 3.82Å; I260-F314 HydrophobicContact CG2-CD2 4.38Å; I260-F314 HydrophobicContact CG2-CE2 4.02Å; I260-A320 HydrophobicContact CG2-CB 4.04Å; I260-A320 WeakPolarHBondContact CG2-O 3.32Å; I260-A323 HydrophobicContact CD1-CB 4.47Å; I260-I324 HydrophobicContact CG2-CD1 4.06Å; I260-I324 HydrophobicContact CG2-CG1 3.84Å; I260-V339 HydrophobicContact CB-CG1 4.21Å; I260-V339 HydrophobicContact CD1-CG1 3.75Å; I260-S340 CarbonylContact C-O 3.58Å; I260-S340 WeakPolarHBondContact CA-O 3.45Å; I260-S340 WeakPolarHBondContact CB-O 3.46Å |
| 261 | F | 91.5 | Very high | 77.4 | Confident | 52 Ų | 52 | 58.7 Ų | 58.7 | 23% | 0.228 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.4 | 133.6 | 166.9 | -175.7 | -94.6 | 0 | 0 | 0 | 108.4 | Q263 Y298 E309 T311 V339 S340 A342 | F261-Q263 HydrophobicContact CE1-CB 4.05Å; F261-Y298 HydrophobicContact CE2-CE2 4.39Å; F261-E309 HydrophobicContact CE1-CG 4.26Å; F261-E309 HydrophobicContact CE2-CB 4.47Å; F261-E309 HydrophobicContact CZ-CB 3.97Å; F261-E309 HydrophobicContact CZ-CG 3.81Å; F261-T311 HydrophobicContact CD2-CG2 3.74Å; F261-V339 WeakPolarHBondContact O-CA 3.32Å; F261-S340 PolarHBondContact N-O 3.13Å; F261-S340 PolarHBondContact O-N 2.59Å; F261-A342 HydrophobicContact CB-CB 4.16Å |
| 262 | V | 90.4 | Very high | 78.9 | Confident | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.8 | 130.9 | -178.2 | -171.9 | 0 | 0 | 0 | 0 | 107.7 | I260 L265 F278 E309 A310 V312 I337 K338 V339 | I260-V262 HydrophobicContact CD1-CG2 3.77Å; I260-V262 HydrophobicContact CG1-CG2 4.19Å; V262-L265 HydrophobicContact CB-CD1 4.07Å; V262-L265 HydrophobicContact CB-CG 4.49Å; V262-L265 HydrophobicContact CG1-CD1 3.8Å; V262-L265 HydrophobicContact CG1-CD2 3.88Å; V262-L265 HydrophobicContact CG1-CG 3.7Å; V262-F278 HydrophobicContact CB-CZ 4.4Å; V262-F278 HydrophobicContact CG1-CE2 4.23Å; V262-F278 HydrophobicContact CG1-CZ 3.97Å; V262-F278 HydrophobicContact CG2-CE1 4.18Å; V262-F278 HydrophobicContact CG2-CE2 3.84Å; V262-F278 HydrophobicContact CG2-CZ 3.5Å; V262-E309 CarbonylContact O-C 3.52Å; V262-E309 VanDerWaalsContact O-CA 3.26Å; V262-E309 WeakPolarHBondContact O-CA 3.26Å; V262-A310 PolarHBondContact N-O 3.33Å; V262-A310 PolarHBondContact O-N 3.02Å; V262-V312 HydrophobicContact CG2-CG2 4.25Å; V262-I337 HydrophobicContact CG1-CB 4.37Å; V262-I337 HydrophobicContact CG1-CG2 4.42Å; V262-K338 CarbonylContact C-O 3.47Å; V262-K338 WeakPolarHBondContact CA-O 3.26Å; V262-V339 HydrophobicContact CG1-CG2 4.23Å; V262-V339 HydrophobicContact CG2-CG1 4.39Å; V262-V339 HydrophobicContact CG2-CG2 4.43Å |
| 263 | Q | 89.7 | Confident | 80.4 | Confident | 85 Ų | 85 | 53.2 Ų | 53.2 | 40% | 0.397 | 29% | 0.288 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.9 | 149.4 | 177.5 | -179.4 | 172.2 | 62.7 | 0 | 0 | 109.2 | F261 G308 E309 I337 K338 | F261-Q263 HydrophobicContact CE1-CB 4.05Å; Q263-G308 CarbonylContact C-O 3.59Å; Q263-G308 WeakPolarHBondContact CA-O 3.26Å; Q263-E309 HydrophobicContact CB-CG 4.08Å; Q263-E309 HydrophobicContact CG-CG 3.85Å; Q263-E309 PolarHBondContact NE2-OE1 3.19Å; Q263-I337 CarbonylContact O-C 3.51Å; Q263-I337 WeakPolarHBondContact O-CA 3.5Å; Q263-I337 WeakPolarHBondContact O-CB 3.45Å; Q263-K338 HydrophobicContact CB-CB 4.45Å; Q263-K338 PolarHBondContact N-O 3.37Å; Q263-K338 PolarHBondContact O-N 3.23Å |
| 264 | G | 86.9 | Confident | 81.9 | Confident | 24 Ų | 24 | 46.8 Ų | 46.8 | 25% | 0.247 | 25% | 0.254 | C | S | . | . | trans | 96.4 | 2.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | G266 G308 K335 | G264-G266 PolarHBondContact O-N 3.2Å; G264-G308 PolarHBondContact N-O 3.38Å; G264-K335 WeakPolarHBondContact O-CB 3.35Å | ||
| 265 | L | 82.7 | Confident | 83.2 | Confident | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 25% | 0.249 | C | C | . | . | trans | -60.7 | -7.7 | -174.4 | -72.6 | 166.4 | 0 | 0 | 0 | 116 | V262 A269 V274 G308 A310 F332 I337 | V262-L265 HydrophobicContact CB-CD1 4.07Å; V262-L265 HydrophobicContact CB-CG 4.49Å; V262-L265 HydrophobicContact CG1-CD1 3.8Å; V262-L265 HydrophobicContact CG1-CD2 3.88Å; V262-L265 HydrophobicContact CG1-CG 3.7Å; L265-A269 HydrophobicContact CB-CB 3.76Å; L265-A269 WeakPolarHBondContact O-CB 3.45Å; L265-V274 HydrophobicContact CD1-CG2 4.09Å; L265-V274 HydrophobicContact CD2-CG2 4.11Å; L265-G308 WeakPolarHBondContact CB-O 3.22Å; L265-G308 PolarHBondContact N-O 2.82Å; L265-A310 HydrophobicContact CD1-CB 3.61Å; L265-F332 HydrophobicContact CB-CD1 4.43Å; L265-F332 HydrophobicContact CD2-CB 4.41Å; L265-F332 HydrophobicContact CD2-CD1 3.77Å; L265-F332 HydrophobicContact CD2-CD2 4.14Å; L265-F332 HydrophobicContact CD2-CE1 4Å; L265-F332 HydrophobicContact CD2-CE2 4.35Å; L265-F332 HydrophobicContact CD2-CG 3.85Å; L265-F332 HydrophobicContact CD2-CZ 4.29Å; L265-F332 WeakPolarHBondContact O-CD1 3.46Å; L265-I337 HydrophobicContact CD2-CG2 4Å; L265-I337 HydrophobicContact CG-CG2 4.25Å | ||
| 266 | G | 75.6 | Confident | 84.5 | Confident | 7 Ų | 7 | 47.4 Ų | 47.4 | 7% | 0.072 | 25% | 0.254 | C | S | . | . | trans | 82.5 | -170.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | G264 D268 G308 | G264-G266 PolarHBondContact O-N 3.2Å; G266-D268 VanDerWaalsContact C-N 3.34Å; G266-G308 WeakPolarHBondContact O-CA 3.3Å | ||
| 267 | E | 79.3 | Confident | 85.6 | Confident | 87 Ų | 87 | 43.7 Ų | 43.7 | 41% | 0.407 | 23% | 0.23 | S | C | . | . | S | Bend | trans | -91.1 | -6.9 | 179.4 | -64.1 | -171.1 | 154 | 0 | 0 | 111.5 | R305 P306 | E267-R305 WeakPolarHBondContact OE1-CB 3.27Å; E267-R305 WeakPolarHBondContact OE1-CD 3.33Å; E267-R305 VanDerWaalsContact OE1-CG 3.28Å; E267-R305 WeakPolarHBondContact OE1-CG 3.38Å; E267-R305 IonicContact OE1-CZ 3.92Å; E267-R305 IonicContact OE1-NE 3.66Å; E267-R305 IonicContact OE1-NH1 2.72Å; E267-R305 PolarHBondContact OE1-NH1 2.94Å; E267-R305 IonicContact OE2-NH1 2.98Å; E267-R305 PolarHBondContact OE2-NH1 2.86Å; E267-P306 WeakPolarHBondContact O-CG 3.37Å |
| 268 | D | 77.3 | Confident | 85.9 | Confident | 95 Ų | 95 | 43.5 Ų | 43.5 | 51% | 0.508 | 23% | 0.229 | S | C | . | . | S | Bend | trans | -106.4 | -5.8 | -164.7 | -34.9 | -89 | 0 | 0 | 0 | 112.1 | G266 T270 K335 | G266-D268 VanDerWaalsContact C-N 3.34Å; D268-T270 PolarHBondContact O-N 3.28Å; D268-K335 IonicContact OD2-NZ 3.85Å |
| 269 | A | 80.4 | Confident | 86 | Confident | 12 Ų | 12 | 46.8 Ų | 46.8 | 10% | 0.099 | 24% | 0.242 | C | C | . | . | trans | -75.1 | 113.5 | -171 | 0 | 0 | 0 | 0 | 0 | 113.6 | L265 V274 I297 F332 | L265-A269 HydrophobicContact CB-CB 3.76Å; L265-A269 WeakPolarHBondContact O-CB 3.45Å; A269-V274 HydrophobicContact CB-CG2 4.18Å; A269-I297 VanDerWaalsContact O-CD1 3.3Å; A269-I297 WeakPolarHBondContact O-CD1 3.36Å; A269-F332 HydrophobicContact CB-CE1 3.84Å; A269-F332 HydrophobicContact CB-CZ 4.47Å | ||
| 270 | T | 86.3 | Confident | 85.9 | Confident | 65 Ų | 65 | 50.6 Ų | 50.6 | 40% | 0.399 | 26% | 0.257 | S | S | . | . | trans | -88.3 | 157.9 | 171.3 | 72 | 0 | 0 | 0 | 0 | 112.8 | D268 Q272 E273 V274 | D268-T270 PolarHBondContact O-N 3.28Å; T270-Q272 PolarHBondContact O-N 2.72Å; T270-Q272 PolarHBondContact OG1-N 3.49Å; T270-E273 WeakPolarHBondContact CB-OE2 3.27Å; T270-E273 VanDerWaalsContact CG2-OE2 3.26Å; T270-E273 WeakPolarHBondContact CG2-OE2 3.22Å; T270-E273 PolarHBondContact N-OE2 2.98Å; T270-E273 PolarHBondContact O-N 2.83Å; T270-E273 VanDerWaalsContact OG1-CD 3.24Å; T270-E273 WeakPolarHBondContact OG1-CG 3.3Å; T270-E273 PolarHBondContact OG1-N 3Å; T270-E273 VanDerWaalsContact OG1-N 3.13Å; T270-E273 PolarHBondContact OG1-OE2 2.82Å; T270-V274 WeakPolarHBondContact O-CG2 3.47Å; T270-V274 PolarHBondContact O-N 2.79Å | ||
| 271 | V | 85 | Confident | 85.6 | Confident | 49 Ų | 49 | 53 Ų | 53 | 30% | 0.297 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -58.6 | -28.4 | 171.1 | 166.8 | 0 | 0 | 0 | 0 | 112.2 | G275 P293 I295 I297 | V271-G275 PolarHBondContact O-N 2.64Å; V271-G275 VanDerWaalsContact O-N 3.13Å; V271-P293 HydrophobicContact CG1-CG 4.19Å; V271-I295 HydrophobicContact CG1-CB 4.27Å; V271-I295 HydrophobicContact CG2-CG2 4.48Å; V271-I297 HydrophobicContact CG2-CD1 3.8Å; V271-I297 HydrophobicContact CG2-CG1 4.03Å |
| 272 | Q | 85.9 | Confident | 85.3 | Confident | 128 Ų | 128 | 51.1 Ų | 51.1 | 60% | 0.598 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -73.5 | -51.1 | 178.8 | -65.5 | -97.1 | -105.8 | 0 | 0 | 110.7 | T270 G275 D276 | T270-Q272 PolarHBondContact O-N 2.72Å; T270-Q272 PolarHBondContact OG1-N 3.49Å; Q272-G275 CarbonylContact O-C 3.57Å; Q272-G275 WeakPolarHBondContact O-CA 3.29Å; Q272-G275 PolarHBondContact O-N 2.83Å; Q272-G275 VanDerWaalsContact O-N 3.17Å; Q272-D276 WeakPolarHBondContact O-CB 3.38Å; Q272-D276 PolarHBondContact O-N 2.86Å |
| 273 | E | 87.6 | Confident | 85.2 | Confident | 87 Ų | 87 | 57.2 Ų | 57.2 | 41% | 0.407 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -66.7 | -40.7 | -179 | -64.4 | 150.9 | 138.9 | 0 | 0 | 112.2 | T270 G275 D276 Y277 F332 | T270-E273 WeakPolarHBondContact CB-OE2 3.27Å; T270-E273 VanDerWaalsContact CG2-OE2 3.26Å; T270-E273 WeakPolarHBondContact CG2-OE2 3.22Å; T270-E273 PolarHBondContact N-OE2 2.98Å; T270-E273 PolarHBondContact O-N 2.83Å; T270-E273 VanDerWaalsContact OG1-CD 3.24Å; T270-E273 WeakPolarHBondContact OG1-CG 3.3Å; T270-E273 PolarHBondContact OG1-N 3Å; T270-E273 VanDerWaalsContact OG1-N 3.13Å; T270-E273 PolarHBondContact OG1-OE2 2.82Å; E273-G275 VanDerWaalsContact C-N 3.28Å; E273-G275 PolarHBondContact O-N 3.45Å; E273-D276 PolarHBondContact O-N 2.98Å; E273-Y277 VanDerWaalsContact O-CB 3.25Å; E273-Y277 WeakPolarHBondContact O-CB 3.22Å; E273-Y277 PolarHBondContact O-N 2.75Å; E273-F332 HydrophobicContact CB-CZ 4.28Å |
| 274 | V | 87.2 | Confident | 85.3 | Confident | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62.6 | -40.3 | 173.5 | 178.4 | 0 | 0 | 0 | 0 | 109.9 | L265 A269 T270 F278 I295 I297 V312 F332 | L265-V274 HydrophobicContact CD1-CG2 4.09Å; L265-V274 HydrophobicContact CD2-CG2 4.11Å; A269-V274 HydrophobicContact CB-CG2 4.18Å; T270-V274 WeakPolarHBondContact O-CG2 3.47Å; T270-V274 PolarHBondContact O-N 2.79Å; V274-F278 HydrophobicContact CG1-CD2 3.74Å; V274-F278 HydrophobicContact CG1-CE2 4.02Å; V274-F278 VanDerWaalsContact O-CD2 3.31Å; V274-F278 WeakPolarHBondContact O-CD2 3.37Å; V274-F278 PolarHBondContact O-N 2.8Å; V274-I295 HydrophobicContact CB-CD1 4.21Å; V274-I295 HydrophobicContact CB-CG2 4.46Å; V274-I295 HydrophobicContact CG1-CD1 4.01Å; V274-I295 HydrophobicContact CG1-CG2 4.03Å; V274-I297 HydrophobicContact CG2-CD1 4.42Å; V274-V312 HydrophobicContact CG1-CG2 3.7Å; V274-F332 HydrophobicContact CG2-CZ 4.43Å |
| 275 | G | 87.9 | Confident | 85.3 | Confident | 4 Ų | 4 | 56.6 Ų | 56.6 | 4% | 0.041 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.5 | -44.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | V271 Q272 E273 K279 I284 I295 | V271-G275 PolarHBondContact O-N 2.64Å; V271-G275 VanDerWaalsContact O-N 3.13Å; Q272-G275 CarbonylContact O-C 3.57Å; Q272-G275 WeakPolarHBondContact O-CA 3.29Å; Q272-G275 PolarHBondContact O-N 2.83Å; Q272-G275 VanDerWaalsContact O-N 3.17Å; E273-G275 VanDerWaalsContact C-N 3.28Å; E273-G275 PolarHBondContact O-N 3.45Å; G275-K279 VanDerWaalsContact O-CB 3.24Å; G275-K279 WeakPolarHBondContact O-CB 3.28Å; G275-K279 WeakPolarHBondContact O-CG 3.38Å; G275-K279 PolarHBondContact O-N 2.87Å; G275-I284 WeakPolarHBondContact O-CD1 3.49Å; G275-I295 VanDerWaalsContact CA-CD1 3.43Å; G275-I295 VanDerWaalsContact N-CD1 3.31Å |
| 276 | D | 88.3 | Confident | 85.6 | Confident | 92 Ų | 92 | 60.2 Ų | 60.2 | 49% | 0.492 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -76.2 | -23.9 | -175.3 | -84.1 | 16.3 | 0 | 0 | 0 | 113.8 | Q272 E273 K279 | Q272-D276 WeakPolarHBondContact O-CB 3.38Å; Q272-D276 PolarHBondContact O-N 2.86Å; E273-D276 PolarHBondContact O-N 2.98Å; D276-K279 WeakPolarHBondContact O-CE 3.27Å; D276-K279 WeakPolarHBondContact O-CG 3.2Å; D276-K279 WeakPolarHBondContact OD1-CE 3.03Å; D276-K279 IonicContact OD1-NZ 2.72Å; D276-K279 PolarHBondContact OD1-NZ 3.08Å; D276-K279 IonicContact OD2-NZ 2.84Å; D276-K279 PolarHBondContact OD2-NZ 3.47Å |
| 277 | Y | 87.6 | Confident | 86 | Confident | 57 Ų | 57 | 62.9 Ų | 62.9 | 22% | 0.224 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -76.1 | -56.3 | 169.9 | -167.8 | -110.6 | 0 | 0 | 0 | 110.8 | E273 K279 Q280 F327 F332 I337 | E273-Y277 VanDerWaalsContact O-CB 3.25Å; E273-Y277 WeakPolarHBondContact O-CB 3.22Å; E273-Y277 PolarHBondContact O-N 2.75Å; Y277-K279 VanDerWaalsContact C-N 3.34Å; Y277-K279 PolarHBondContact O-N 3.35Å; Y277-Q280 WeakPolarHBondContact O-CG 3.26Å; Y277-Q280 PolarHBondContact O-N 2.82Å; Y277-Q280 PolarHBondContact O-NE2 3.42Å; Y277-F327 HydrophobicContact CD1-CD1 4.02Å; Y277-F327 AromaticContact CD1-CE1 3.66Å; Y277-F327 HydrophobicContact CD1-CE1 3.66Å; Y277-F327 HydrophobicContact CD1-CZ 4.01Å; Y277-F327 HydrophobicContact CD2-CE1 4.48Å; Y277-F327 AromaticContact CE1-CD1 3.21Å; Y277-F327 HydrophobicContact CE1-CD1 3.21Å; Y277-F327 AromaticContact CE1-CE1 3.18Å; Y277-F327 HydrophobicContact CE1-CE1 3.18Å; Y277-F327 HydrophobicContact CE1-CG 4.04Å; Y277-F327 AromaticContact CE1-CZ 3.99Å; Y277-F327 HydrophobicContact CE1-CZ 3.99Å; Y277-F327 HydrophobicContact CE2-CE1 4.09Å; Y277-F327 HydrophobicContact CG-CE1 4.3Å; Y277-F327 AromaticContact CZ-CD1 3.59Å; Y277-F327 AromaticContact CZ-CE1 3.43Å; Y277-F327 VanDerWaalsContact CZ-CE1 3.43Å; Y277-F332 HydrophobicContact CD1-CD2 4.33Å; Y277-F332 HydrophobicContact CE1-CD2 4.41Å; Y277-F332 HydrophobicContact CG-CD2 4.4Å; Y277-F332 HydrophobicContact CG-CE2 4.3Å; Y277-I337 HydrophobicContact CE1-CD1 4.05Å |
| 278 | F | 87.6 | Confident | 86 | Confident | 0 Ų | 0 | 69.1 Ų | 69.1 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -72.1 | -22 | -174.1 | -76.8 | -80 | 0 | 0 | 0 | 113.9 | I260 V262 V274 Q280 I281 I284 V312 F314 A323 F327 I337 V339 | I260-F278 HydrophobicContact CD1-CD1 3.55Å; I260-F278 HydrophobicContact CD1-CE1 3.4Å; I260-F278 HydrophobicContact CD1-CG 4.33Å; I260-F278 HydrophobicContact CD1-CZ 4.09Å; V262-F278 HydrophobicContact CB-CZ 4.4Å; V262-F278 HydrophobicContact CG1-CE2 4.23Å; V262-F278 HydrophobicContact CG1-CZ 3.97Å; V262-F278 HydrophobicContact CG2-CE1 4.18Å; V262-F278 HydrophobicContact CG2-CE2 3.84Å; V262-F278 HydrophobicContact CG2-CZ 3.5Å; V274-F278 HydrophobicContact CG1-CD2 3.74Å; V274-F278 HydrophobicContact CG1-CE2 4.02Å; V274-F278 VanDerWaalsContact O-CD2 3.31Å; V274-F278 WeakPolarHBondContact O-CD2 3.37Å; V274-F278 PolarHBondContact O-N 2.8Å; F278-Q280 PolarHBondContact O-N 2.69Å; F278-Q280 VanDerWaalsContact O-N 3.13Å; F278-I281 PolarHBondContact O-N 2.77Å; F278-I284 HydrophobicContact CB-CD1 3.78Å; F278-V312 HydrophobicContact CB-CG1 4.33Å; F278-V312 HydrophobicContact CD2-CG2 4.2Å; F278-F314 HydrophobicContact CB-CE1 4.4Å; F278-F314 HydrophobicContact CB-CZ 4.03Å; F278-F314 HydrophobicContact CD1-CZ 4.17Å; F278-A323 HydrophobicContact CD1-CB 4.44Å; F278-F327 AromaticContact CD1-CD2 3.4Å; F278-F327 HydrophobicContact CD1-CD2 3.4Å; F278-F327 AromaticContact CD1-CE2 3.44Å; F278-F327 HydrophobicContact CD1-CE2 3.44Å; F278-F327 VanDerWaalsContact CD1-CE2 3.44Å; F278-F327 HydrophobicContact CD1-CG 4.26Å; F278-F327 HydrophobicContact CD1-CZ 4.32Å; F278-F327 HydrophobicContact CE1-CB 3.92Å; F278-F327 AromaticContact CE1-CD2 3.27Å; F278-F327 HydrophobicContact CE1-CD2 3.27Å; F278-F327 AromaticContact CE1-CE2 3.82Å; F278-F327 HydrophobicContact CE1-CE2 3.82Å; F278-F327 AromaticContact CE1-CG 3.75Å; F278-F327 HydrophobicContact CE1-CG 3.75Å; F278-F327 HydrophobicContact CG-CD2 4.5Å; F278-F327 HydrophobicContact CG-CE2 4.22Å; F278-F327 HydrophobicContact CZ-CB 4.39Å; F278-F327 HydrophobicContact CZ-CD2 4.3Å; F278-F327 HydrophobicContact CZ-CG 4.41Å; F278-I337 HydrophobicContact CZ-CD1 4.4Å; F278-V339 HydrophobicContact CE1-CG1 4.45Å; F278-V339 HydrophobicContact CE1-CG2 4.32Å; F278-V339 HydrophobicContact CZ-CG2 4.18Å |
| 279 | K | 88.3 | Confident | 86 | Confident | 110 Ų | 110 | 74.4 Ų | 74.4 | 48% | 0.478 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.5 | -15.7 | 176.1 | 73.9 | -175.9 | 177.7 | -166 | 0 | 114.6 | G275 D276 Y277 I281 G282 I284 | G275-K279 VanDerWaalsContact O-CB 3.24Å; G275-K279 WeakPolarHBondContact O-CB 3.28Å; G275-K279 WeakPolarHBondContact O-CG 3.38Å; G275-K279 PolarHBondContact O-N 2.87Å; D276-K279 WeakPolarHBondContact O-CE 3.27Å; D276-K279 WeakPolarHBondContact O-CG 3.2Å; D276-K279 WeakPolarHBondContact OD1-CE 3.03Å; D276-K279 IonicContact OD1-NZ 2.72Å; D276-K279 PolarHBondContact OD1-NZ 3.08Å; D276-K279 IonicContact OD2-NZ 2.84Å; D276-K279 PolarHBondContact OD2-NZ 3.47Å; Y277-K279 VanDerWaalsContact C-N 3.34Å; Y277-K279 PolarHBondContact O-N 3.35Å; K279-I281 VanDerWaalsContact C-N 3.26Å; K279-I281 PolarHBondContact O-N 3.2Å; K279-G282 WeakPolarHBondContact CA-O 3.42Å; K279-I284 HydrophobicContact CB-CD1 4.31Å; K279-I284 HydrophobicContact CB-CG1 4.49Å |
| 280 | Q | 86.3 | Confident | 85.9 | Confident | 108 Ų | 108 | 77.9 Ų | 77.9 | 51% | 0.505 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.4 | -23 | -178.8 | 82.5 | -168 | -113.1 | 0 | 0 | 113 | Y277 F278 F327 | Y277-Q280 WeakPolarHBondContact O-CG 3.26Å; Y277-Q280 PolarHBondContact O-N 2.82Å; Y277-Q280 PolarHBondContact O-NE2 3.42Å; F278-Q280 PolarHBondContact O-N 2.69Å; F278-Q280 VanDerWaalsContact O-N 3.13Å; Q280-F327 HydrophobicContact CG-CE1 4.49Å; Q280-F327 HydrophobicContact CG-CZ 3.72Å |
| 281 | I | 86.7 | Confident | 85.5 | Confident | 51 Ų | 51 | 77.7 Ų | 77.7 | 26% | 0.262 | 40% | 0.395 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.6 | -29.3 | -179.4 | -58.6 | -57.7 | 0 | 0 | 0 | 112.2 | F278 K279 A322 A323 W326 F327 | F278-I281 PolarHBondContact O-N 2.77Å; K279-I281 VanDerWaalsContact C-N 3.26Å; K279-I281 PolarHBondContact O-N 3.2Å; I281-A322 HydrophobicContact CG2-CB 3.71Å; I281-A323 HydrophobicContact CB-CB 4.44Å; I281-A323 HydrophobicContact CG2-CB 4.21Å; I281-W326 HydrophobicContact CD1-CB 4.29Å; I281-W326 HydrophobicContact CD1-CD2 4.23Å; I281-W326 HydrophobicContact CD1-CG 3.8Å; I281-W326 HydrophobicContact CG1-CB 4.43Å; I281-W326 HydrophobicContact CG1-CG 4.23Å; I281-F327 HydrophobicContact CB-CE2 4.29Å; I281-F327 HydrophobicContact CG1-CD2 4.35Å; I281-F327 HydrophobicContact CG1-CE2 3.52Å; I281-F327 HydrophobicContact CG1-CZ 3.85Å |
| 282 | G | 85.4 | Confident | 85.2 | Confident | 13 Ų | 13 | 80.3 Ų | 80.3 | 13% | 0.134 | 41% | 0.405 | C | S | . | . | S | Bend | trans | -172.1 | 168.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | K279 I284 | K279-G282 WeakPolarHBondContact CA-O 3.42Å; G282-I284 PolarHBondContact O-N 3.49Å |
| 283 | I | 87.8 | Confident | 85.2 | Confident | 127 Ų | 127 | 75.4 Ų | 75.4 | 65% | 0.651 | 38% | 0.384 | S | S | * | . | trans | -69.1 | 114.6 | -175.6 | -58.7 | 176.2 | 0 | 0 | 0 | 109.5 | F314 D315 | I283-F314 WeakPolarHBondContact O-CA 3.45Å; I283-D315 HydrophobicContact CB-CB 4.48Å; I283-D315 HydrophobicContact CG2-CB 4.32Å; I283-D315 PolarHBondContact O-N 2.85Å | ||
| 284 | I | 90.3 | Very high | 85.1 | Confident | 13 Ų | 13 | 74 Ų | 74 | 7% | 0.067 | 38% | 0.378 | C | S | . | . | B | Isolated β-bridge | trans | -73.9 | 130.4 | 170.9 | -55.7 | 178.3 | 0 | 0 | 0 | 108.5 | G275 F278 K279 G282 V286 P293 I295 V312 S313 F314 | G275-I284 WeakPolarHBondContact O-CD1 3.49Å; F278-I284 HydrophobicContact CB-CD1 3.78Å; K279-I284 HydrophobicContact CB-CD1 4.31Å; K279-I284 HydrophobicContact CB-CG1 4.49Å; G282-I284 PolarHBondContact O-N 3.49Å; I284-V286 PolarHBondContact O-N 3.42Å; I284-P293 HydrophobicContact CB-CB 4.34Å; I284-P293 HydrophobicContact CG2-CB 3.64Å; I284-I295 HydrophobicContact CD1-CD1 4.44Å; I284-I295 HydrophobicContact CG2-CG1 4.49Å; I284-V312 HydrophobicContact CD1-CG1 4.02Å; I284-V312 HydrophobicContact CG1-CG1 4.24Å; I284-V312 HydrophobicContact CG2-CG1 4.02Å; I284-S313 WeakPolarHBondContact CG2-O 3.23Å; I284-F314 HydrophobicContact CG1-CD1 4.06Å; I284-F314 HydrophobicContact CG1-CE1 3.9Å |
| 285 | K | 88 | Confident | 85.2 | Confident | 83 Ų | 83 | 74.9 Ų | 74.9 | 36% | 0.361 | 38% | 0.382 | S | S | . | . | P | Polyproline II helix | trans | -62.9 | 133.1 | 179.8 | -175 | 174 | 178.7 | 170.7 | 0 | 109.9 | M294 S313 | K285-M294 HydrophobicContact CB-CB 4.4Å; K285-M294 HydrophobicContact CB-CG 4.43Å; K285-M294 HydrophobicContact CB-SD 4.37Å; K285-M294 HydrophobicContact CD-SD 3.69Å; K285-M294 HydrophobicContact CG-CG 4.27Å; K285-M294 HydrophobicContact CG-SD 3.71Å; K285-M294 VanDerWaalsContact O-CB 3.25Å; K285-M294 WeakPolarHBondContact O-CB 3.25Å; K285-M294 VanDerWaalsContact O-CG 3.32Å; K285-M294 WeakPolarHBondContact O-CG 3.39Å; K285-M294 PolarHBondContact O-N 2.92Å; K285-S313 VanDerWaalsContact CB-O 3.26Å; K285-S313 WeakPolarHBondContact CB-O 3.36Å; K285-S313 PolarHBondContact N-O 3.33Å |
| 286 | V | 88.4 | Confident | 85.3 | Confident | 77 Ų | 77 | 78.6 Ų | 78.6 | 47% | 0.467 | 40% | 0.401 | S | S | . | . | B | Isolated β-bridge | trans | -100.2 | 134.7 | -176 | 178.4 | 0 | 0 | 0 | 0 | 111.4 | I284 K288 G291 | I284-V286 PolarHBondContact O-N 3.42Å; V286-K288 PolarHBondContact O-N 2.92Å; V286-G291 VanDerWaalsContact CG1-C 3.43Å; V286-G291 WeakPolarHBondContact CG1-O 3.35Å |
| 287 | N | 84 | Confident | 85.3 | Confident | 63 Ų | 63 | 76.2 Ų | 76.2 | 34% | 0.337 | 39% | 0.388 | S | S | . | . | trans | -66.5 | 103.6 | 171.1 | -93.9 | -47.8 | 0 | 0 | 0 | 110 | K289 T290 G291 Q292 M294 | N287-K289 PolarHBondContact O-N 2.77Å; N287-T290 WeakPolarHBondContact CB-OG1 3.15Å; N287-T290 PolarHBondContact O-N 2.87Å; N287-G291 PolarHBondContact O-N 3.12Å; N287-Q292 WeakPolarHBondContact CB-O 3.39Å; N287-Q292 PolarHBondContact N-O 2.81Å; N287-M294 HydrophobicContact CB-CG 4.34Å | ||
| 288 | K | 79.1 | Confident | 85.2 | Confident | 217 Ų | 217 | 78.2 Ų | 78.2 | 94% | 0.943 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | -9.2 | 179.2 | -64.4 | -169.3 | 177.5 | -173 | 0 | 115.5 | V286 | V286-K288 PolarHBondContact O-N 2.92Š|
| 289 | K | 77.8 | Confident | 84.9 | Confident | 207 Ų | 207 | 81.4 Ų | 81.4 | 90% | 0.9 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.5 | -22.7 | 175.3 | -66.7 | -173 | 177.3 | -175.8 | 0 | 114.7 | N287 | N287-K289 PolarHBondContact O-N 2.77Š|
| 290 | T | 78.3 | Confident | 84.5 | Confident | 85 Ų | 85 | 78.9 Ų | 78.9 | 52% | 0.521 | 41% | 0.41 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -128.9 | -10.1 | -173.6 | 60.2 | 0 | 0 | 0 | 0 | 114 | N287 Q292 | N287-T290 WeakPolarHBondContact CB-OG1 3.15Å; N287-T290 PolarHBondContact O-N 2.87Å; T290-Q292 PolarHBondContact O-N 2.81Å; T290-Q292 VanDerWaalsContact O-N 3.16Å |
| 291 | G | 78.7 | Confident | 83.9 | Confident | 60 Ų | 60 | 83.3 Ų | 83.3 | 62% | 0.619 | 43% | 0.428 | S | S | * | . | S | Bend | trans | 71 | -0.3 | -174.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | V286 N287 | V286-G291 VanDerWaalsContact CG1-C 3.43Å; V286-G291 WeakPolarHBondContact CG1-O 3.35Å; N287-G291 PolarHBondContact O-N 3.12Å |
| 292 | Q | 78.9 | Confident | 83.2 | Confident | 105 Ų | 105 | 85.4 Ų | 85.4 | 49% | 0.491 | 45% | 0.452 | S | S | . | . | S | Bend | trans | -90.4 | 151.1 | -177.6 | -68 | 168 | -28.1 | 0 | 0 | 111.7 | N287 T290 | N287-Q292 WeakPolarHBondContact CB-O 3.39Å; N287-Q292 PolarHBondContact N-O 2.81Å; T290-Q292 PolarHBondContact O-N 2.81Å; T290-Q292 VanDerWaalsContact O-N 3.16Å |
| 293 | P | 86.2 | Confident | 82.7 | Confident | 24 Ų | 24 | 88.9 Ų | 88.9 | 16% | 0.156 | 47% | 0.471 | C | S | . | . | B | Isolated β-bridge | trans | -58.1 | 146.6 | 173.3 | 25.2 | -34.8 | 0 | 0 | 0 | 111.8 | V271 I284 I295 | V271-P293 HydrophobicContact CG1-CG 4.19Å; I284-P293 HydrophobicContact CB-CB 4.34Å; I284-P293 HydrophobicContact CG2-CB 3.64Å; P293-I295 HydrophobicContact CB-CD1 3.83Å; P293-I295 HydrophobicContact CB-CG1 4.08Å; P293-I295 HydrophobicContact CG-CD1 3.84Å; P293-I295 HydrophobicContact CG-CG1 4.42Å; P293-I295 PolarHBondContact O-N 3.4Å |
| 294 | M | 84.6 | Confident | 81.8 | Confident | 58 Ų | 58 | 85.6 Ų | 85.6 | 29% | 0.286 | 47% | 0.469 | S | S | . | . | S | Bend | trans | -76.7 | 73.2 | 178.2 | -73.9 | -162.3 | 71.6 | 0 | 0 | 110.7 | K285 N287 S313 | K285-M294 HydrophobicContact CB-CB 4.4Å; K285-M294 HydrophobicContact CB-CG 4.43Å; K285-M294 HydrophobicContact CB-SD 4.37Å; K285-M294 HydrophobicContact CD-SD 3.69Å; K285-M294 HydrophobicContact CG-CG 4.27Å; K285-M294 HydrophobicContact CG-SD 3.71Å; K285-M294 VanDerWaalsContact O-CB 3.25Å; K285-M294 WeakPolarHBondContact O-CB 3.25Å; K285-M294 VanDerWaalsContact O-CG 3.32Å; K285-M294 WeakPolarHBondContact O-CG 3.39Å; K285-M294 PolarHBondContact O-N 2.92Å; N287-M294 HydrophobicContact CB-CG 4.34Å; M294-S313 PolarHBondContact O-N 2.97Å; M294-S313 PolarHBondContact O-OG 2.88Å |
| 295 | I | 89.9 | Confident | 80.9 | Confident | 19 Ų | 19 | 91.6 Ų | 91.6 | 10% | 0.097 | 49% | 0.49 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.3 | 131 | 178.4 | -59.5 | 170 | 0 | 0 | 0 | 108.3 | V271 V274 G275 I284 P293 I297 A310 T311 V312 | V271-I295 HydrophobicContact CG1-CB 4.27Å; V271-I295 HydrophobicContact CG2-CG2 4.48Å; V274-I295 HydrophobicContact CB-CD1 4.21Å; V274-I295 HydrophobicContact CB-CG2 4.46Å; V274-I295 HydrophobicContact CG1-CD1 4.01Å; V274-I295 HydrophobicContact CG1-CG2 4.03Å; G275-I295 VanDerWaalsContact CA-CD1 3.43Å; G275-I295 VanDerWaalsContact N-CD1 3.31Å; I284-I295 HydrophobicContact CD1-CD1 4.44Å; I284-I295 HydrophobicContact CG2-CG1 4.49Å; P293-I295 HydrophobicContact CB-CD1 3.83Å; P293-I295 HydrophobicContact CB-CG1 4.08Å; P293-I295 HydrophobicContact CG-CD1 3.84Å; P293-I295 HydrophobicContact CG-CG1 4.42Å; P293-I295 PolarHBondContact O-N 3.4Å; I295-I297 HydrophobicContact CG2-CG1 3.97Å; I295-A310 HydrophobicContact CG2-CB 4.44Å; I295-T311 VanDerWaalsContact CA-O 3.29Å; I295-T311 WeakPolarHBondContact CA-O 3.12Å; I295-V312 HydrophobicContact CD1-CG1 4.5Å; I295-V312 HydrophobicContact CG1-CB 4.39Å; I295-V312 HydrophobicContact CG1-CG1 4.07Å; I295-V312 HydrophobicContact CG1-CG2 4.12Å; I295-V312 HydrophobicContact CG2-CG2 4.33Å |
| 296 | N | 88.5 | Confident | 80.3 | Confident | 81 Ų | 81 | 89.8 Ų | 89.8 | 43% | 0.433 | 49% | 0.488 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.7 | 106.3 | 176 | 177.6 | 75.4 | 0 | 0 | 0 | 109.3 | Y298 A310 T311 | N296-Y298 VanDerWaalsContact ND2-CE1 3.26Å; N296-Y298 WeakPolarHBondContact ND2-CE1 3.36Å; N296-Y298 WeakPolarHBondContact ND2-CE2 3.18Å; N296-Y298 PolarHBondContact ND2-OH 3.27Å; N296-A310 CarbonylContact O-C 3.55Å; N296-A310 VanDerWaalsContact O-CA 3.28Å; N296-A310 WeakPolarHBondContact O-CA 3.4Å; N296-T311 PolarHBondContact N-O 2.89Å; N296-T311 PolarHBondContact O-N 2.66Å |
| 297 | I | 88.3 | Confident | 79.8 | Confident | 42 Ų | 42 | 91.9 Ų | 91.9 | 22% | 0.215 | 49% | 0.49 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.1 | 130 | 179.3 | -52.1 | -173.9 | 0 | 0 | 0 | 109 | A269 V271 V274 I295 A310 | A269-I297 VanDerWaalsContact O-CD1 3.3Å; A269-I297 WeakPolarHBondContact O-CD1 3.36Å; V271-I297 HydrophobicContact CG2-CD1 3.8Å; V271-I297 HydrophobicContact CG2-CG1 4.03Å; V274-I297 HydrophobicContact CG2-CD1 4.42Å; I295-I297 HydrophobicContact CG2-CG1 3.97Å; I297-A310 HydrophobicContact CB-CB 4.41Å; I297-A310 HydrophobicContact CG1-CB 3.97Å |
| 298 | Y | 86.5 | Confident | 79.8 | Confident | 99 Ų | 99 | 89.1 Ų | 89.1 | 39% | 0.388 | 48% | 0.477 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.9 | 112.3 | 179.4 | -61.1 | -86.2 | 0 | 0 | 0 | 109.9 | F261 N296 K307 E309 T311 | F261-Y298 HydrophobicContact CE2-CE2 4.39Å; N296-Y298 VanDerWaalsContact ND2-CE1 3.26Å; N296-Y298 WeakPolarHBondContact ND2-CE1 3.36Å; N296-Y298 WeakPolarHBondContact ND2-CE2 3.18Å; N296-Y298 PolarHBondContact ND2-OH 3.27Å; Y298-K307 WeakPolarHBondContact O-CB 3.47Å; Y298-K307 PolarHBondContact O-N 2.81Å; Y298-E309 HydrophobicContact CD2-CB 4.39Å; Y298-E309 PolarHBondContact N-O 2.99Å; Y298-T311 HydrophobicContact CE2-CG2 4.18Å |
| 299 | S | 81 | Confident | 80.2 | Confident | 67 Ų | 67 | 79.8 Ų | 79.8 | 47% | 0.469 | 44% | 0.436 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | 147.7 | 163.8 | 51.7 | 0 | 0 | 0 | 0 | 111.6 | K301 | S299-K301 PolarHBondContact O-N 2.76Å |
| 300 | D | 80.6 | Confident | 80.8 | Confident | 58 Ų | 58 | 69.9 Ų | 69.9 | 31% | 0.31 | 39% | 0.393 | S | S | . | . | trans | -72.6 | 125.7 | 167.2 | 171.2 | 38.3 | 0 | 0 | 0 | 109.6 | A302 T303 G304 R305 | D300-A302 VanDerWaalsContact C-N 3.33Å; D300-A302 PolarHBondContact OD1-N 3.1Å; D300-A302 PolarHBondContact OD2-N 2.94Å; D300-T303 WeakPolarHBondContact OD2-CB 3.46Å; D300-T303 WeakPolarHBondContact OD2-CG2 3.15Å; D300-T303 PolarHBondContact OD2-N 2.79Å; D300-T303 PolarHBondContact OD2-OG1 2.9Å; D300-G304 VanDerWaalsContact O-CA 3.27Å; D300-G304 WeakPolarHBondContact O-CA 3.4Å; D300-G304 PolarHBondContact O-N 3.46Å; D300-R305 PolarHBondContact N-O 2.89Å | ||
| 301 | K | 72.1 | Confident | 81.4 | Confident | 201 Ų | 201 | 67 Ų | 67 | 87% | 0.874 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.8 | -13.8 | -179.2 | -60.8 | -173.6 | 179.4 | -173.6 | 0 | 113.1 | S299 | S299-K301 PolarHBondContact O-N 2.76Š|
| 302 | A | 72.7 | Confident | 81.9 | Confident | 94 Ų | 94 | 64.1 Ų | 64.1 | 78% | 0.777 | 35% | 0.346 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | -40.8 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | D300 | D300-A302 VanDerWaalsContact C-N 3.33Å; D300-A302 PolarHBondContact OD1-N 3.1Å; D300-A302 PolarHBondContact OD2-N 2.94Å |
| 303 | T | 74.8 | Confident | 82.5 | Confident | 86 Ų | 86 | 60.1 Ų | 60.1 | 53% | 0.528 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103 | -13.1 | -179.7 | 60.5 | 0 | 0 | 0 | 0 | 114.5 | D300 R305 | D300-T303 WeakPolarHBondContact OD2-CB 3.46Å; D300-T303 WeakPolarHBondContact OD2-CG2 3.15Å; D300-T303 PolarHBondContact OD2-N 2.79Å; D300-T303 PolarHBondContact OD2-OG1 2.9Å; T303-R305 PolarHBondContact O-N 2.92Å; T303-R305 PolarHBondContact OG1-N 3.19Å |
| 304 | G | 68.4 | Low | 82.7 | Confident | 59 Ų | 59 | 59 Ų | 59 | 61% | 0.608 | 32% | 0.322 | S | S | * | . | trans | 74.5 | -8 | -173 | 0 | 0 | 0 | 0 | 0 | 114.3 | D300 | D300-G304 VanDerWaalsContact O-CA 3.27Å; D300-G304 WeakPolarHBondContact O-CA 3.4Å; D300-G304 PolarHBondContact O-N 3.46Å | ||
| 305 | R | 71.9 | Confident | 82.9 | Confident | 138 Ų | 138 | 61 Ų | 61 | 52% | 0.521 | 33% | 0.334 | S | S | . | . | trans | -73 | 138.5 | 179.7 | -67 | 168.1 | 173.7 | -87.2 | -2.1 | 110.5 | E267 D300 T303 K307 | E267-R305 WeakPolarHBondContact OE1-CB 3.27Å; E267-R305 WeakPolarHBondContact OE1-CD 3.33Å; E267-R305 VanDerWaalsContact OE1-CG 3.28Å; E267-R305 WeakPolarHBondContact OE1-CG 3.38Å; E267-R305 IonicContact OE1-CZ 3.92Å; E267-R305 IonicContact OE1-NE 3.66Å; E267-R305 IonicContact OE1-NH1 2.72Å; E267-R305 PolarHBondContact OE1-NH1 2.94Å; E267-R305 IonicContact OE2-NH1 2.98Å; E267-R305 PolarHBondContact OE2-NH1 2.86Å; D300-R305 PolarHBondContact N-O 2.89Å; T303-R305 PolarHBondContact O-N 2.92Å; T303-R305 PolarHBondContact OG1-N 3.19Å; R305-K307 PolarHBondContact O-N 2.76Å | ||
| 306 | P | 74.7 | Confident | 82.9 | Confident | 46 Ų | 46 | 63.1 Ų | 63.1 | 30% | 0.299 | 35% | 0.346 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.2 | 134.6 | 168.9 | -25.3 | 37.9 | 0 | 0 | 0 | 110.2 | E267 G308 | E267-P306 WeakPolarHBondContact O-CG 3.37Å; P306-G308 PolarHBondContact O-N 3.16Å; P306-G308 VanDerWaalsContact O-N 3.1Å |
| 307 | K | 78.8 | Confident | 82.8 | Confident | 120 Ų | 120 | 61.3 Ų | 61.3 | 52% | 0.522 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.6 | 1.4 | -177.4 | -156.7 | -171.8 | 168.5 | -144 | 0 | 112.3 | Y298 R305 E309 | Y298-K307 WeakPolarHBondContact O-CB 3.47Å; Y298-K307 PolarHBondContact O-N 2.81Å; R305-K307 PolarHBondContact O-N 2.76Å; K307-E309 HydrophobicContact CB-CB 4.45Å; K307-E309 HydrophobicContact CD-CG 4.45Å; K307-E309 WeakPolarHBondContact CD-OE2 3.31Å; K307-E309 VanDerWaalsContact CE-OE1 3.29Å; K307-E309 WeakPolarHBondContact CE-OE1 3.49Å; K307-E309 WeakPolarHBondContact CE-OE2 3.28Å; K307-E309 IonicContact NZ-OE1 2.77Å; K307-E309 PolarHBondContact NZ-OE1 3.29Å; K307-E309 IonicContact NZ-OE2 2.69Å; K307-E309 PolarHBondContact NZ-OE2 2.85Å; K307-E309 PolarHBondContact O-N 2.84Å |
| 308 | G | 83.1 | Confident | 82.8 | Confident | 5 Ų | 5 | 63.5 Ų | 63.5 | 5% | 0.052 | 36% | 0.355 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 61.9 | 20.4 | -168.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q263 G264 L265 G266 P306 | Q263-G308 CarbonylContact C-O 3.59Å; Q263-G308 WeakPolarHBondContact CA-O 3.26Å; G264-G308 PolarHBondContact N-O 3.38Å; L265-G308 WeakPolarHBondContact CB-O 3.22Å; L265-G308 PolarHBondContact N-O 2.82Å; G266-G308 WeakPolarHBondContact O-CA 3.3Å; P306-G308 PolarHBondContact O-N 3.16Å; P306-G308 VanDerWaalsContact O-N 3.1Å |
| 309 | E | 88.4 | Confident | 83 | Confident | 21 Ų | 21 | 59.9 Ų | 59.9 | 10% | 0.098 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.2 | 137.8 | -177.4 | -76.4 | 175.1 | -165.2 | 0 | 0 | 111.1 | F261 V262 Q263 Y298 K307 | F261-E309 HydrophobicContact CE1-CG 4.26Å; F261-E309 HydrophobicContact CE2-CB 4.47Å; F261-E309 HydrophobicContact CZ-CB 3.97Å; F261-E309 HydrophobicContact CZ-CG 3.81Å; V262-E309 CarbonylContact O-C 3.52Å; V262-E309 VanDerWaalsContact O-CA 3.26Å; V262-E309 WeakPolarHBondContact O-CA 3.26Å; Q263-E309 HydrophobicContact CB-CG 4.08Å; Q263-E309 HydrophobicContact CG-CG 3.85Å; Q263-E309 PolarHBondContact NE2-OE1 3.19Å; Y298-E309 HydrophobicContact CD2-CB 4.39Å; Y298-E309 PolarHBondContact N-O 2.99Å; K307-E309 HydrophobicContact CB-CB 4.45Å; K307-E309 HydrophobicContact CD-CG 4.45Å; K307-E309 WeakPolarHBondContact CD-OE2 3.31Å; K307-E309 VanDerWaalsContact CE-OE1 3.29Å; K307-E309 WeakPolarHBondContact CE-OE1 3.49Å; K307-E309 WeakPolarHBondContact CE-OE2 3.28Å; K307-E309 IonicContact NZ-OE1 2.77Å; K307-E309 PolarHBondContact NZ-OE1 3.29Å; K307-E309 IonicContact NZ-OE2 2.69Å; K307-E309 PolarHBondContact NZ-OE2 2.85Å; K307-E309 PolarHBondContact O-N 2.84Å |
| 310 | A | 89.9 | Confident | 83.3 | Confident | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 32% | 0.322 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.2 | 153 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V262 L265 I295 N296 I297 | V262-A310 PolarHBondContact N-O 3.33Å; V262-A310 PolarHBondContact O-N 3.02Å; L265-A310 HydrophobicContact CD1-CB 3.61Å; I295-A310 HydrophobicContact CG2-CB 4.44Å; N296-A310 CarbonylContact O-C 3.55Å; N296-A310 VanDerWaalsContact O-CA 3.28Å; N296-A310 WeakPolarHBondContact O-CA 3.4Å; I297-A310 HydrophobicContact CB-CB 4.41Å; I297-A310 HydrophobicContact CG1-CB 3.97Å |
| 311 | T | 91.1 | Very high | 83.7 | Confident | 24 Ų | 24 | 59 Ų | 59 | 15% | 0.147 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 132.6 | 161.4 | 42.6 | 0 | 0 | 0 | 0 | 110.1 | I260 F261 I295 N296 Y298 A342 | I260-T311 WeakPolarHBondContact O-CA 3.21Å; F261-T311 HydrophobicContact CD2-CG2 3.74Å; I295-T311 VanDerWaalsContact CA-O 3.29Å; I295-T311 WeakPolarHBondContact CA-O 3.12Å; N296-T311 PolarHBondContact N-O 2.89Å; N296-T311 PolarHBondContact O-N 2.66Å; Y298-T311 HydrophobicContact CE2-CG2 4.18Å; T311-A342 HydrophobicContact CG2-CB 4.31Å |
| 312 | V | 90.6 | Very high | 84.6 | Confident | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.1 | 123.4 | 176.3 | -178.5 | 0 | 0 | 0 | 0 | 107.9 | T259 I260 V262 V274 F278 I284 I295 F314 | T259-V312 WeakPolarHBondContact CA-O 3.24Å; I260-V312 HydrophobicContact CD1-CB 4.16Å; I260-V312 HydrophobicContact CG1-CB 3.75Å; I260-V312 HydrophobicContact CG1-CG2 4.43Å; I260-V312 PolarHBondContact N-O 3.48Å; I260-V312 PolarHBondContact O-N 2.65Å; V262-V312 HydrophobicContact CG2-CG2 4.25Å; V274-V312 HydrophobicContact CG1-CG2 3.7Å; F278-V312 HydrophobicContact CB-CG1 4.33Å; F278-V312 HydrophobicContact CD2-CG2 4.2Å; I284-V312 HydrophobicContact CD1-CG1 4.02Å; I284-V312 HydrophobicContact CG1-CG1 4.24Å; I284-V312 HydrophobicContact CG2-CG1 4.02Å; I295-V312 HydrophobicContact CD1-CG1 4.5Å; I295-V312 HydrophobicContact CG1-CB 4.39Å; I295-V312 HydrophobicContact CG1-CG1 4.07Å; I295-V312 HydrophobicContact CG1-CG2 4.12Å; I295-V312 HydrophobicContact CG2-CG2 4.33Å; V312-F314 HydrophobicContact CG1-CE2 4.42Å; V312-F314 HydrophobicContact CG1-CZ 4.47Å |
| 313 | S | 90.1 | Very high | 85.4 | Confident | 20 Ų | 20 | 47 Ų | 47 | 14% | 0.14 | 27% | 0.268 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.6 | 113.6 | 175.7 | -47.3 | 0 | 0 | 0 | 0 | 110.2 | I284 K285 M294 | I284-S313 WeakPolarHBondContact CG2-O 3.23Å; K285-S313 VanDerWaalsContact CB-O 3.26Å; K285-S313 WeakPolarHBondContact CB-O 3.36Å; K285-S313 PolarHBondContact N-O 3.33Å; M294-S313 PolarHBondContact O-N 2.97Å; M294-S313 PolarHBondContact O-OG 2.88Å |
| 314 | F | 90.8 | Very high | 86.2 | Confident | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 25% | 0.247 | C | C | . | . | B | Isolated β-bridge | trans | -75.8 | 162 | 165.4 | -65.3 | -81.8 | 0 | 0 | 0 | 111.1 | N258 I260 F278 I283 I284 V312 A320 A323 | N258-F314 PolarHBondContact ND2-O 3.41Å; N258-F314 VanDerWaalsContact ND2-O 3.13Å; N258-F314 WeakPolarHBondContact O-CA 3.36Å; N258-F314 WeakPolarHBondContact O-CB 3.48Å; N258-F314 PolarHBondContact O-N 2.75Å; I260-F314 HydrophobicContact CD1-CE2 3.69Å; I260-F314 HydrophobicContact CD1-CZ 4.24Å; I260-F314 HydrophobicContact CG1-CD2 4.48Å; I260-F314 HydrophobicContact CG1-CE2 3.82Å; I260-F314 HydrophobicContact CG2-CD2 4.38Å; I260-F314 HydrophobicContact CG2-CE2 4.02Å; F278-F314 HydrophobicContact CB-CE1 4.4Å; F278-F314 HydrophobicContact CB-CZ 4.03Å; F278-F314 HydrophobicContact CD1-CZ 4.17Å; I283-F314 WeakPolarHBondContact O-CA 3.45Å; I284-F314 HydrophobicContact CG1-CD1 4.06Å; I284-F314 HydrophobicContact CG1-CE1 3.9Å; V312-F314 HydrophobicContact CG1-CE2 4.42Å; V312-F314 HydrophobicContact CG1-CZ 4.47Å; F314-A320 HydrophobicContact CB-CB 4.33Å; F314-A320 HydrophobicContact CD2-CB 3.57Å; F314-A320 HydrophobicContact CE2-CB 4.26Å; F314-A320 HydrophobicContact CG-CB 4.25Å; F314-A323 HydrophobicContact CE2-CB 3.71Å; F314-A323 HydrophobicContact CZ-CB 3.54Å |
| 315 | D | 89.3 | Confident | 87.3 | Confident | 101 Ų | 101 | 46.6 Ų | 46.6 | 54% | 0.54 | 25% | 0.248 | S | C | . | . | S | Bend | trans | -74.9 | -40.5 | 168.8 | -146.7 | 51.9 | 0 | 0 | 0 | 109.9 | N258 I283 | N258-D315 PolarHBondContact ND2-O 3.19Å; N258-D315 VanDerWaalsContact ND2-O 3.11Å; I283-D315 HydrophobicContact CB-CB 4.48Å; I283-D315 HydrophobicContact CG2-CB 4.32Å; I283-D315 PolarHBondContact O-N 2.85Å |
| 316 | D | 88.5 | Confident | 88.1 | Confident | 64 Ų | 64 | 46.5 Ų | 46.5 | 34% | 0.342 | 25% | 0.248 | S | C | . | . | S | Bend | trans | -107.4 | 131.2 | -170.5 | 174.7 | 67.4 | 0 | 0 | 0 | 113.8 | P318 S319 A320 | D316-P318 WeakPolarHBondContact OD1-CD 3.34Å; D316-P318 WeakPolarHBondContact OD2-CD 3.46Å; D316-P318 VanDerWaalsContact OD2-CG 3.31Å; D316-P318 WeakPolarHBondContact OD2-CG 3.46Å; D316-S319 WeakPolarHBondContact OD2-CB 3.32Å; D316-S319 PolarHBondContact OD2-N 2.61Å; D316-S319 PolarHBondContact OD2-OG 2.88Å; D316-A320 PolarHBondContact O-N 2.82Å |
| 317 | P | 87.1 | Confident | 88.8 | Confident | 43 Ų | 43 | 44.3 Ų | 44.3 | 28% | 0.279 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.9 | -50.5 | 179 | -20.2 | 30.7 | 0 | 0 | 0 | 116.6 | N258 S319 A320 K321 | N258-P317 HydrophobicContact CB-CB 4.41Å; N258-P317 HydrophobicContact CB-CG 4.14Å; P317-S319 VanDerWaalsContact C-N 3.26Å; P317-S319 PolarHBondContact O-N 2.94Å; P317-A320 WeakPolarHBondContact O-CA 3.46Å; P317-A320 VanDerWaalsContact O-CB 3.31Å; P317-A320 WeakPolarHBondContact O-CB 3.45Å; P317-A320 PolarHBondContact O-N 3.21Å; P317-K321 PolarHBondContact O-N 3.17Å; P317-K321 VanDerWaalsContact O-N 3.14Å |
| 318 | P | 89.1 | Confident | 89.4 | Confident | 87 Ų | 87 | 42.3 Ų | 42.3 | 57% | 0.565 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -63 | -30.8 | 178.3 | 19.3 | -28.5 | 0 | 0 | 0 | 113.1 | D316 A320 K321 A322 | D316-P318 WeakPolarHBondContact OD1-CD 3.34Å; D316-P318 WeakPolarHBondContact OD2-CD 3.46Å; D316-P318 VanDerWaalsContact OD2-CG 3.31Å; D316-P318 WeakPolarHBondContact OD2-CG 3.46Å; P318-A320 VanDerWaalsContact C-N 3.32Å; P318-A320 PolarHBondContact O-N 3.24Å; P318-K321 PolarHBondContact O-N 2.96Å; P318-A322 PolarHBondContact O-N 3.16Å |
| 319 | S | 89.7 | Confident | 89.5 | Confident | 24 Ų | 24 | 44.8 Ų | 44.8 | 17% | 0.168 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58.9 | -40.8 | 168.5 | -63.1 | 0 | 0 | 0 | 0 | 112.6 | D316 P317 K321 A322 A323 | D316-S319 WeakPolarHBondContact OD2-CB 3.32Å; D316-S319 PolarHBondContact OD2-N 2.61Å; D316-S319 PolarHBondContact OD2-OG 2.88Å; P317-S319 VanDerWaalsContact C-N 3.26Å; P317-S319 PolarHBondContact O-N 2.94Å; S319-K321 VanDerWaalsContact C-N 3.33Å; S319-K321 PolarHBondContact O-N 2.79Å; S319-A322 PolarHBondContact O-N 3.34Å; S319-A323 WeakPolarHBondContact O-CB 3.25Å; S319-A323 PolarHBondContact O-N 2.96Å |
| 320 | A | 88.8 | Confident | 89.5 | Confident | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65.4 | -36.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | I260 F314 D316 P317 P318 A323 I324 | I260-A320 HydrophobicContact CG2-CB 4.04Å; I260-A320 WeakPolarHBondContact CG2-O 3.32Å; F314-A320 HydrophobicContact CB-CB 4.33Å; F314-A320 HydrophobicContact CD2-CB 3.57Å; F314-A320 HydrophobicContact CE2-CB 4.26Å; F314-A320 HydrophobicContact CG-CB 4.25Å; D316-A320 PolarHBondContact O-N 2.82Å; P317-A320 WeakPolarHBondContact O-CA 3.46Å; P317-A320 VanDerWaalsContact O-CB 3.31Å; P317-A320 WeakPolarHBondContact O-CB 3.45Å; P317-A320 PolarHBondContact O-N 3.21Å; P318-A320 VanDerWaalsContact C-N 3.32Å; P318-A320 PolarHBondContact O-N 3.24Å; A320-A323 PolarHBondContact O-N 2.96Å; A320-I324 WeakPolarHBondContact O-CG1 3.32Å; A320-I324 PolarHBondContact O-N 2.79Å |
| 321 | K | 89 | Confident | 89.3 | Confident | 105 Ų | 105 | 54.9 Ų | 54.9 | 46% | 0.457 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -64.8 | -50.8 | 171.8 | -171.7 | -176 | 172.5 | -174.4 | 0 | 111.7 | P317 P318 S319 A323 I324 D325 F341 | P317-K321 PolarHBondContact O-N 3.17Å; P317-K321 VanDerWaalsContact O-N 3.14Å; P318-K321 PolarHBondContact O-N 2.96Å; S319-K321 VanDerWaalsContact C-N 3.33Å; S319-K321 PolarHBondContact O-N 2.79Å; K321-A323 PolarHBondContact O-N 3.39Å; K321-I324 WeakPolarHBondContact O-CB 3.29Å; K321-I324 PolarHBondContact O-N 3.21Å; K321-D325 WeakPolarHBondContact CE-OD2 3.31Å; K321-D325 PolarHBondContact O-N 3.37Å; K321-D325 VanDerWaalsContact O-N 3.09Å; K321-F341 HydrophobicContact CB-CE1 4.34Å; K321-F341 HydrophobicContact CB-CZ 3.8Å; K321-F341 HydrophobicContact CG-CE2 4.44Å; K321-F341 HydrophobicContact CG-CZ 3.87Å |
| 322 | A | 90.6 | Very high | 88.8 | Confident | 43 Ų | 43 | 54.4 Ų | 54.4 | 36% | 0.355 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -59.1 | -33 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | I281 P318 S319 W326 | I281-A322 HydrophobicContact CG2-CB 3.71Å; P318-A322 PolarHBondContact O-N 3.16Å; S319-A322 PolarHBondContact O-N 3.34Å; A322-W326 VanDerWaalsContact O-CB 3.22Å; A322-W326 WeakPolarHBondContact O-CB 3.38Å; A322-W326 PolarHBondContact O-N 2.92Å |
| 323 | A | 90.1 | Very high | 88.2 | Confident | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -66.8 | -35 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | I260 F278 I281 F314 S319 A320 K321 F327 | I260-A323 HydrophobicContact CD1-CB 4.47Å; F278-A323 HydrophobicContact CD1-CB 4.44Å; I281-A323 HydrophobicContact CB-CB 4.44Å; I281-A323 HydrophobicContact CG2-CB 4.21Å; F314-A323 HydrophobicContact CE2-CB 3.71Å; F314-A323 HydrophobicContact CZ-CB 3.54Å; S319-A323 WeakPolarHBondContact O-CB 3.25Å; S319-A323 PolarHBondContact O-N 2.96Å; A320-A323 PolarHBondContact O-N 2.96Å; K321-A323 PolarHBondContact O-N 3.39Å; A323-F327 HydrophobicContact CB-CD2 4.08Å; A323-F327 HydrophobicContact CB-CE2 4.38Å; A323-F327 VanDerWaalsContact O-CB 3.25Å; A323-F327 WeakPolarHBondContact O-CB 2.9Å; A323-F327 WeakPolarHBondContact O-CD2 3.3Å; A323-F327 PolarHBondContact O-N 2.94Å |
| 324 | I | 90.6 | Very high | 87.7 | Confident | 19 Ų | 19 | 60.7 Ų | 60.7 | 10% | 0.097 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -64.4 | -56 | 172.1 | -65.8 | 156.5 | 0 | 0 | 0 | 109.5 | I260 A320 K321 W326 F327 D328 V339 F341 | I260-I324 HydrophobicContact CG2-CD1 4.06Å; I260-I324 HydrophobicContact CG2-CG1 3.84Å; A320-I324 WeakPolarHBondContact O-CG1 3.32Å; A320-I324 PolarHBondContact O-N 2.79Å; K321-I324 WeakPolarHBondContact O-CB 3.29Å; K321-I324 PolarHBondContact O-N 3.21Å; I324-W326 PolarHBondContact O-N 2.95Å; I324-W326 VanDerWaalsContact O-N 3.12Å; I324-F327 PolarHBondContact O-N 2.73Å; I324-D328 WeakPolarHBondContact O-CB 3.47Å; I324-D328 PolarHBondContact O-N 2.87Å; I324-V339 HydrophobicContact CB-CG1 4.42Å; I324-V339 HydrophobicContact CG1-CG1 3.93Å; I324-F341 HydrophobicContact CD1-CB 4.13Å; I324-F341 HydrophobicContact CD1-CD1 3.58Å; I324-F341 HydrophobicContact CD1-CD2 3.43Å; I324-F341 VanDerWaalsContact CD1-CD2 3.43Å; I324-F341 HydrophobicContact CD1-CE1 3.76Å; I324-F341 HydrophobicContact CD1-CE2 3.6Å; I324-F341 HydrophobicContact CD1-CG 3.41Å; I324-F341 VanDerWaalsContact CD1-CG 3.41Å; I324-F341 HydrophobicContact CD1-CZ 3.77Å; I324-F341 VanDerWaalsContact CD1-N 3.26Å |
| 325 | D | 90.8 | Very high | 87.4 | Confident | 119 Ų | 119 | 64.7 Ų | 64.7 | 64% | 0.636 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -62.1 | -23.8 | -174.8 | -62.5 | -22 | 0 | 0 | 0 | 112.9 | K321 | K321-D325 WeakPolarHBondContact CE-OD2 3.31Å; K321-D325 PolarHBondContact O-N 3.37Å; K321-D325 VanDerWaalsContact O-N 3.09Å |
| 326 | W | 89.3 | Confident | 87.3 | Confident | 135 Ų | 135 | 64.1 Ų | 64.1 | 51% | 0.511 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -93.4 | -34.2 | 178.1 | -175.9 | -102 | 0 | 0 | 0 | 114.7 | I281 A322 I324 K330 | I281-W326 HydrophobicContact CD1-CB 4.29Å; I281-W326 HydrophobicContact CD1-CD2 4.23Å; I281-W326 HydrophobicContact CD1-CG 3.8Å; I281-W326 HydrophobicContact CG1-CB 4.43Å; I281-W326 HydrophobicContact CG1-CG 4.23Å; A322-W326 VanDerWaalsContact O-CB 3.22Å; A322-W326 WeakPolarHBondContact O-CB 3.38Å; A322-W326 PolarHBondContact O-N 2.92Å; I324-W326 PolarHBondContact O-N 2.95Å; I324-W326 VanDerWaalsContact O-N 3.12Å; W326-K330 WeakPolarHBondContact O-CE 3.1Å; W326-K330 WeakPolarHBondContact O-CG 3.25Å |
| 327 | F | 89.3 | Confident | 87.5 | Confident | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -105.6 | -15.1 | -172.1 | -65.5 | -62.1 | 0 | 0 | 0 | 115.1 | Y277 F278 Q280 I281 A323 I324 G329 K330 I337 V339 | Y277-F327 HydrophobicContact CD1-CD1 4.02Å; Y277-F327 AromaticContact CD1-CE1 3.66Å; Y277-F327 HydrophobicContact CD1-CE1 3.66Å; Y277-F327 HydrophobicContact CD1-CZ 4.01Å; Y277-F327 HydrophobicContact CD2-CE1 4.48Å; Y277-F327 AromaticContact CE1-CD1 3.21Å; Y277-F327 HydrophobicContact CE1-CD1 3.21Å; Y277-F327 AromaticContact CE1-CE1 3.18Å; Y277-F327 HydrophobicContact CE1-CE1 3.18Å; Y277-F327 HydrophobicContact CE1-CG 4.04Å; Y277-F327 AromaticContact CE1-CZ 3.99Å; Y277-F327 HydrophobicContact CE1-CZ 3.99Å; Y277-F327 HydrophobicContact CE2-CE1 4.09Å; Y277-F327 HydrophobicContact CG-CE1 4.3Å; Y277-F327 AromaticContact CZ-CD1 3.59Å; Y277-F327 AromaticContact CZ-CE1 3.43Å; Y277-F327 VanDerWaalsContact CZ-CE1 3.43Å; F278-F327 AromaticContact CD1-CD2 3.4Å; F278-F327 HydrophobicContact CD1-CD2 3.4Å; F278-F327 AromaticContact CD1-CE2 3.44Å; F278-F327 HydrophobicContact CD1-CE2 3.44Å; F278-F327 VanDerWaalsContact CD1-CE2 3.44Å; F278-F327 HydrophobicContact CD1-CG 4.26Å; F278-F327 HydrophobicContact CD1-CZ 4.32Å; F278-F327 HydrophobicContact CE1-CB 3.92Å; F278-F327 AromaticContact CE1-CD2 3.27Å; F278-F327 HydrophobicContact CE1-CD2 3.27Å; F278-F327 AromaticContact CE1-CE2 3.82Å; F278-F327 HydrophobicContact CE1-CE2 3.82Å; F278-F327 AromaticContact CE1-CG 3.75Å; F278-F327 HydrophobicContact CE1-CG 3.75Å; F278-F327 HydrophobicContact CG-CD2 4.5Å; F278-F327 HydrophobicContact CG-CE2 4.22Å; F278-F327 HydrophobicContact CZ-CB 4.39Å; F278-F327 HydrophobicContact CZ-CD2 4.3Å; F278-F327 HydrophobicContact CZ-CG 4.41Å; Q280-F327 HydrophobicContact CG-CE1 4.49Å; Q280-F327 HydrophobicContact CG-CZ 3.72Å; I281-F327 HydrophobicContact CB-CE2 4.29Å; I281-F327 HydrophobicContact CG1-CD2 4.35Å; I281-F327 HydrophobicContact CG1-CE2 3.52Å; I281-F327 HydrophobicContact CG1-CZ 3.85Å; A323-F327 HydrophobicContact CB-CD2 4.08Å; A323-F327 HydrophobicContact CB-CE2 4.38Å; A323-F327 VanDerWaalsContact O-CB 3.25Å; A323-F327 WeakPolarHBondContact O-CB 2.9Å; A323-F327 WeakPolarHBondContact O-CD2 3.3Å; A323-F327 PolarHBondContact O-N 2.94Å; I324-F327 PolarHBondContact O-N 2.73Å; F327-G329 PolarHBondContact O-N 2.86Å; F327-K330 HydrophobicContact CD1-CG 4.41Å; F327-K330 WeakPolarHBondContact O-CB 3.22Å; F327-K330 PolarHBondContact O-N 3.24Å; F327-K330 VanDerWaalsContact O-N 3.16Å; F327-I337 HydrophobicContact CB-CD1 4.34Å; F327-V339 HydrophobicContact CB-CG2 3.75Å |
| 328 | D | 90.9 | Very high | 87.7 | Confident | 78 Ų | 78 | 65.2 Ų | 65.2 | 42% | 0.417 | 36% | 0.361 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | 128.3 | 175 | -163.8 | 38.5 | 0 | 0 | 0 | 110.7 | I324 K330 K338 V339 | I324-D328 WeakPolarHBondContact O-CB 3.47Å; I324-D328 PolarHBondContact O-N 2.87Å; D328-K330 VanDerWaalsContact C-N 3.3Å; D328-K330 PolarHBondContact O-N 2.81Å; D328-K338 VanDerWaalsContact OD1-CA 3.23Å; D328-K338 WeakPolarHBondContact OD1-CA 3.39Å; D328-K338 WeakPolarHBondContact OD1-CG 3.45Å; D328-V339 HydrophobicContact CB-CB 4.3Å; D328-V339 PolarHBondContact OD1-N 2.9Å |
| 329 | G | 86.7 | Confident | 87.8 | Confident | 58 Ų | 58 | 61.2 Ų | 61.2 | 60% | 0.598 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.9 | 6.8 | -176.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | F327 I337 | F327-G329 PolarHBondContact O-N 2.86Å; G329-I337 WeakPolarHBondContact CA-O 3.39Å; G329-I337 PolarHBondContact N-O 3.13Å |
| 330 | K | 87.5 | Confident | 87.8 | Confident | 90 Ų | 90 | 62.4 Ų | 62.4 | 39% | 0.391 | 34% | 0.343 | S | S | . | . | trans | -72.1 | 163.8 | 168.1 | -64.7 | -62.3 | -178.3 | -177.2 | 0 | 111.1 | W326 F327 D328 P336 I337 | W326-K330 WeakPolarHBondContact O-CE 3.1Å; W326-K330 WeakPolarHBondContact O-CG 3.25Å; F327-K330 HydrophobicContact CD1-CG 4.41Å; F327-K330 WeakPolarHBondContact O-CB 3.22Å; F327-K330 PolarHBondContact O-N 3.24Å; F327-K330 VanDerWaalsContact O-N 3.16Å; D328-K330 VanDerWaalsContact C-N 3.3Å; D328-K330 PolarHBondContact O-N 2.81Å; K330-P336 CarbonylContact O-C 3.47Å; K330-P336 WeakPolarHBondContact O-CA 3.24Å; K330-I337 HydrophobicContact CB-CD1 4.33Å; K330-I337 HydrophobicContact CB-CG1 4.14Å; K330-I337 WeakPolarHBondContact O-CG1 3.19Å; K330-I337 PolarHBondContact O-N 3Å | ||
| 331 | E | 86.5 | Confident | 87.8 | Confident | 142 Ų | 142 | 64.4 Ų | 64.4 | 66% | 0.664 | 35% | 0.352 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -99.2 | 133.4 | 171 | -63.5 | -174.9 | 129.7 | 0 | 0 | 111 | K335 | E331-K335 CarbonylContact C-O 3.36Å; E331-K335 WeakPolarHBondContact CA-O 3.4Å |
| 332 | F | 79.7 | Confident | 87.6 | Confident | 14 Ų | 14 | 59.7 Ų | 59.7 | 6% | 0.061 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.6 | 124 | 171.5 | -170.8 | -86.6 | 0 | 0 | 0 | 107.7 | L265 A269 E273 V274 Y277 G334 K335 I337 | L265-F332 HydrophobicContact CB-CD1 4.43Å; L265-F332 HydrophobicContact CD2-CB 4.41Å; L265-F332 HydrophobicContact CD2-CD1 3.77Å; L265-F332 HydrophobicContact CD2-CD2 4.14Å; L265-F332 HydrophobicContact CD2-CE1 4Å; L265-F332 HydrophobicContact CD2-CE2 4.35Å; L265-F332 HydrophobicContact CD2-CG 3.85Å; L265-F332 HydrophobicContact CD2-CZ 4.29Å; L265-F332 WeakPolarHBondContact O-CD1 3.46Å; A269-F332 HydrophobicContact CB-CE1 3.84Å; A269-F332 HydrophobicContact CB-CZ 4.47Å; E273-F332 HydrophobicContact CB-CZ 4.28Å; V274-F332 HydrophobicContact CG2-CZ 4.43Å; Y277-F332 HydrophobicContact CD1-CD2 4.33Å; Y277-F332 HydrophobicContact CE1-CD2 4.41Å; Y277-F332 HydrophobicContact CG-CD2 4.4Å; Y277-F332 HydrophobicContact CG-CE2 4.3Å; F332-G334 PolarHBondContact O-N 2.81Å; F332-G334 VanDerWaalsContact O-N 3.16Å; F332-K335 PolarHBondContact N-O 2.95Å; F332-K335 PolarHBondContact O-N 3.21Å; F332-K335 VanDerWaalsContact O-O 3.14Å; F332-I337 HydrophobicContact CB-CD1 4.5Å; F332-I337 HydrophobicContact CB-CG1 4.42Å; F332-I337 HydrophobicContact CB-CG2 3.55Å; F332-I337 HydrophobicContact CG-CG2 4.47Å |
| 333 | N | 78.3 | Confident | 86.9 | Confident | 87 Ų | 87 | 63.3 Ų | 63.3 | 47% | 0.465 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 47.8 | 41.9 | -175.9 | -62.8 | -9.3 | 0 | 0 | 0 | 113.9 | K335 | N333-K335 VanDerWaalsContact C-N 3.3Å; N333-K335 PolarHBondContact O-N 3.45Å |
| 334 | G | 80 | Confident | 85.6 | Confident | 65 Ų | 65 | 71.8 Ų | 71.8 | 67% | 0.67 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.6 | 16.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | F332 | F332-G334 PolarHBondContact O-N 2.81Å; F332-G334 VanDerWaalsContact O-N 3.16Å |
| 335 | K | 83.4 | Confident | 83.8 | Confident | 84 Ų | 84 | 82.4 Ų | 82.4 | 37% | 0.365 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.4 | 134.4 | 176 | -68.6 | 162.2 | -174.8 | 158.8 | 0 | 109.3 | G264 D268 E331 F332 N333 I337 | G264-K335 WeakPolarHBondContact O-CB 3.35Å; D268-K335 IonicContact OD2-NZ 3.85Å; E331-K335 CarbonylContact C-O 3.36Å; E331-K335 WeakPolarHBondContact CA-O 3.4Å; F332-K335 PolarHBondContact N-O 2.95Å; F332-K335 PolarHBondContact O-N 3.21Å; F332-K335 VanDerWaalsContact O-O 3.14Å; N333-K335 VanDerWaalsContact C-N 3.3Å; N333-K335 PolarHBondContact O-N 3.45Å; K335-I337 PolarHBondContact O-N 3.07Å |
| 336 | P | 87.9 | Confident | 81.8 | Confident | 90 Ų | 90 | 80 Ų | 80 | 58% | 0.584 | 42% | 0.418 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -66.3 | 123.4 | 175.8 | 26.8 | -33.4 | 0 | 0 | 0 | 110 | K330 | K330-P336 CarbonylContact O-C 3.47Å; K330-P336 WeakPolarHBondContact O-CA 3.24Å |
| 337 | I | 92 | Very high | 79.7 | Confident | 3 Ų | 3 | 80.3 Ų | 80.3 | 2% | 0.015 | 42% | 0.424 | C | S | . | . | trans | -87.1 | 141.8 | 171.1 | 52.5 | 161.8 | 0 | 0 | 0 | 110.9 | V262 Q263 L265 Y277 F278 F327 G329 K330 F332 K335 V339 | V262-I337 HydrophobicContact CG1-CB 4.37Å; V262-I337 HydrophobicContact CG1-CG2 4.42Å; Q263-I337 CarbonylContact O-C 3.51Å; Q263-I337 WeakPolarHBondContact O-CA 3.5Å; Q263-I337 WeakPolarHBondContact O-CB 3.45Å; L265-I337 HydrophobicContact CD2-CG2 4Å; L265-I337 HydrophobicContact CG-CG2 4.25Å; Y277-I337 HydrophobicContact CE1-CD1 4.05Å; F278-I337 HydrophobicContact CZ-CD1 4.4Å; F327-I337 HydrophobicContact CB-CD1 4.34Å; G329-I337 WeakPolarHBondContact CA-O 3.39Å; G329-I337 PolarHBondContact N-O 3.13Å; K330-I337 HydrophobicContact CB-CD1 4.33Å; K330-I337 HydrophobicContact CB-CG1 4.14Å; K330-I337 WeakPolarHBondContact O-CG1 3.19Å; K330-I337 PolarHBondContact O-N 3Å; F332-I337 HydrophobicContact CB-CD1 4.5Å; F332-I337 HydrophobicContact CB-CG1 4.42Å; F332-I337 HydrophobicContact CB-CG2 3.55Å; F332-I337 HydrophobicContact CG-CG2 4.47Å; K335-I337 PolarHBondContact O-N 3.07Å; I337-V339 HydrophobicContact CD1-CG2 4.12Å | ||
| 338 | K | 91.1 | Very high | 77.4 | Confident | 127 Ų | 127 | 90.4 Ų | 90.4 | 55% | 0.552 | 47% | 0.469 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -106.5 | 131.2 | 167.1 | -164.2 | 176.6 | -176.7 | 159.6 | 0 | 109.2 | V262 Q263 D328 | V262-K338 CarbonylContact C-O 3.47Å; V262-K338 WeakPolarHBondContact CA-O 3.26Å; Q263-K338 HydrophobicContact CB-CB 4.45Å; Q263-K338 PolarHBondContact N-O 3.37Å; Q263-K338 PolarHBondContact O-N 3.23Å; D328-K338 VanDerWaalsContact OD1-CA 3.23Å; D328-K338 WeakPolarHBondContact OD1-CA 3.39Å; D328-K338 WeakPolarHBondContact OD1-CG 3.45Å |
| 339 | V | 91.4 | Very high | 75.4 | Confident | 3 Ų | 3 | 91.4 Ų | 91.4 | 2% | 0.018 | 48% | 0.478 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121 | 132.1 | 178.8 | -170.5 | 0 | 0 | 0 | 0 | 109.2 | I260 F261 V262 F278 I324 F327 D328 I337 | I260-V339 HydrophobicContact CB-CG1 4.21Å; I260-V339 HydrophobicContact CD1-CG1 3.75Å; F261-V339 WeakPolarHBondContact O-CA 3.32Å; V262-V339 HydrophobicContact CG1-CG2 4.23Å; V262-V339 HydrophobicContact CG2-CG1 4.39Å; V262-V339 HydrophobicContact CG2-CG2 4.43Å; F278-V339 HydrophobicContact CE1-CG1 4.45Å; F278-V339 HydrophobicContact CE1-CG2 4.32Å; F278-V339 HydrophobicContact CZ-CG2 4.18Å; I324-V339 HydrophobicContact CB-CG1 4.42Å; I324-V339 HydrophobicContact CG1-CG1 3.93Å; F327-V339 HydrophobicContact CB-CG2 3.75Å; D328-V339 HydrophobicContact CB-CB 4.3Å; D328-V339 PolarHBondContact OD1-N 2.9Å; I337-V339 HydrophobicContact CD1-CG2 4.12Å |
| 340 | S | 89.9 | Confident | 73.7 | Confident | 48 Ų | 48 | 96.4 Ų | 96.4 | 34% | 0.336 | 49% | 0.486 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142 | 164.7 | 175.9 | 62.9 | 0 | 0 | 0 | 0 | 110.4 | I260 F261 A342 | I260-S340 CarbonylContact C-O 3.58Å; I260-S340 WeakPolarHBondContact CA-O 3.45Å; I260-S340 WeakPolarHBondContact CB-O 3.46Å; F261-S340 PolarHBondContact N-O 3.13Å; F261-S340 PolarHBondContact O-N 2.59Å; S340-A342 PolarHBondContact O-N 2.87Å |
| 341 | F | 89.3 | Confident | 71.8 | Confident | 43 Ų | 43 | 102 Ų | 102 | 19% | 0.189 | 50% | 0.504 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -57.6 | 130.1 | 164.9 | -74.2 | -76.3 | 0 | 0 | 0 | 107.9 | N254 N257 K321 I324 T343 | N254-F341 HydrophobicContact CB-CB 4.16Å; N254-F341 HydrophobicContact CB-CG 4.41Å; N254-F341 VanDerWaalsContact ND2-CB 3.34Å; N254-F341 WeakPolarHBondContact ND2-CB 3.33Å; N254-F341 WeakPolarHBondContact O-CD1 3.12Å; N257-F341 HydrophobicContact CB-CD1 4.33Å; K321-F341 HydrophobicContact CB-CE1 4.34Å; K321-F341 HydrophobicContact CB-CZ 3.8Å; K321-F341 HydrophobicContact CG-CE2 4.44Å; K321-F341 HydrophobicContact CG-CZ 3.87Å; I324-F341 HydrophobicContact CD1-CB 4.13Å; I324-F341 HydrophobicContact CD1-CD1 3.58Å; I324-F341 HydrophobicContact CD1-CD2 3.43Å; I324-F341 VanDerWaalsContact CD1-CD2 3.43Å; I324-F341 HydrophobicContact CD1-CE1 3.76Å; I324-F341 HydrophobicContact CD1-CE2 3.6Å; I324-F341 HydrophobicContact CD1-CG 3.41Å; I324-F341 VanDerWaalsContact CD1-CG 3.41Å; I324-F341 HydrophobicContact CD1-CZ 3.77Å; I324-F341 VanDerWaalsContact CD1-N 3.26Å; F341-T343 PolarHBondContact O-N 2.9Å |
| 342 | A | 83.6 | Confident | 69.5 | Low | 6 Ų | 6 | 99.5 Ų | 99.5 | 5% | 0.05 | 52% | 0.517 | C | S | . | . | trans | -59.9 | 115.9 | 169.3 | 0 | 0 | 0 | 0 | 0 | 106.6 | N254 N257 T259 F261 T311 S340 R344 | N254-A342 PolarHBondContact ND2-O 3.23Å; N257-A342 PolarHBondContact ND2-O 3.45Å; T259-A342 HydrophobicContact CG2-CB 3.79Å; T259-A342 VanDerWaalsContact O-CB 3.24Å; T259-A342 WeakPolarHBondContact O-CB 3.28Å; T259-A342 PolarHBondContact O-N 3.43Å; F261-A342 HydrophobicContact CB-CB 4.16Å; T311-A342 HydrophobicContact CG2-CB 4.31Å; S340-A342 PolarHBondContact O-N 2.87Å; A342-R344 VanDerWaalsContact C-N 3.31Å; A342-R344 PolarHBondContact O-N 3.1Å | ||
| 343 | T | 77.1 | Confident | 68.3 | Low | 118 Ų | 118 | 101.2 Ų | 101.2 | 72% | 0.724 | 54% | 0.538 | S | S | * | . | trans | -56.8 | 109.5 | 156.7 | 47.6 | 0 | 0 | 0 | 0 | 104.3 | F341 R345 | F341-T343 PolarHBondContact O-N 2.9Å; T343-R345 PolarHBondContact O-N 3.28Å | ||
| 344 | R | 61.8 | Low | 66.8 | Low | 178 Ų | 178 | 105.8 Ų | 105.8 | 67% | 0.672 | 55% | 0.554 | S | S | * | * | trans | -52 | 116.1 | 162.4 | -87.8 | -177.5 | -78.9 | 162.5 | -6.5 | 103.5 | N257 A342 A346 | N257-R344 PolarHBondContact ND2-NE 2.82Å; N257-R344 PolarHBondContact OD1-NE 3.12Å; N257-R344 PolarHBondContact OD1-NH2 3.09Å; A342-R344 VanDerWaalsContact C-N 3.31Å; A342-R344 PolarHBondContact O-N 3.1Å; R344-A346 PolarHBondContact O-N 3.12Å | ||
| 345 | R | 54 | Low | 64.9 | Low | 243 Ų | 243 | 115 Ų | 115 | 92% | 0.917 | 57% | 0.568 | S | S | * | * | trans | -64.3 | 83.5 | 164.3 | -178.9 | 175.8 | 180 | 159.1 | 0.3 | 104.5 | T343 E347 | T343-R345 PolarHBondContact O-N 3.28Å; R345-E347 PolarHBondContact O-N 3.02Å | ||
| 346 | A | 49 | Very low | 62.9 | Low | 69 Ų | 69 | 114.8 Ų | 114.8 | 57% | 0.57 | 59% | 0.59 | S | S | * | * | trans | -50.2 | 129.9 | -180 | 0 | 0 | 0 | 0 | 0 | 105.4 | R344 F348 | R344-A346 PolarHBondContact O-N 3.12Å; A346-F348 VanDerWaalsContact C-N 3.31Å; A346-F348 PolarHBondContact O-N 2.97Å | ||
| 347 | E | 43.4 | Very low | 60.9 | Low | 140 Ų | 140 | 114 Ų | 114 | 65% | 0.654 | 60% | 0.599 | S | S | * | * | trans | -58.3 | 104.4 | 176.7 | -92 | -151.9 | 87.7 | 0 | 0 | 107.6 | R345 T349 Q350 | R345-E347 PolarHBondContact O-N 3.02Å; E347-T349 PolarHBondContact O-N 3.02Å; E347-T349 VanDerWaalsContact OE1-CB 3.31Å; E347-T349 WeakPolarHBondContact OE1-CB 3.2Å; E347-T349 PolarHBondContact OE1-OG1 3.25Å; E347-Q350 PolarHBondContact O-N 2.62Å | ||
| 348 | F | 42.5 | Very low | 58.2 | Low | 212 Ų | 212 | 126.1 Ų | 126.1 | 93% | 0.93 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.4 | 27.4 | 166.3 | -165 | -103.9 | 0 | 0 | 0 | 111.1 | A346 | A346-F348 VanDerWaalsContact C-N 3.31Å; A346-F348 PolarHBondContact O-N 2.97Å |
| 349 | T | 47.4 | Very low | 55.7 | Low | 99 Ų | 99 | 123.9 Ų | 123.9 | 61% | 0.607 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | -30.8 | 162.3 | -37.9 | 0 | 0 | 0 | 0 | 109.8 | E347 | E347-T349 PolarHBondContact O-N 3.02Å; E347-T349 VanDerWaalsContact OE1-CB 3.31Å; E347-T349 WeakPolarHBondContact OE1-CB 3.2Å; E347-T349 PolarHBondContact OE1-OG1 3.25Å |
| 350 | Q | 52 | Low | 53.4 | Low | 163 Ų | 163 | 126.6 Ų | 126.6 | 76% | 0.762 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -149.2 | 71.5 | -171.2 | -62 | -167.7 | 10 | 0 | 0 | 116.5 | E347 | E347-Q350 PolarHBondContact O-N 2.62Š|
| 351 | R | 47.4 | Very low | 50.9 | Low | 209 Ų | 209 | 134.3 Ų | 134.3 | 79% | 0.789 | 71% | 0.714 | S | S | * | * | trans | -153.5 | 83.2 | 146.8 | -141.5 | 175.7 | -170.6 | -173.1 | 2.3 | 116 | ||||
| 352 | G | 37.3 | Very low | 49 | Very low | 89 Ų | 89 | 144.7 Ų | 144.7 | 92% | 0.918 | 75% | 0.752 | S | S | * | * | trans | -106.3 | 78.9 | 156.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 353 | G | 55.7 | Low | 46.8 | Very low | 49 Ų | 49 | 147.9 Ų | 147.9 | 51% | 0.505 | 79% | 0.785 | S | S | . | * | trans | -87.6 | 162.8 | -169 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 354 | F | 46.8 | Very low | 44.9 | Very low | 184 Ų | 184 | 154.1 Ų | 154.1 | 81% | 0.807 | 80% | 0.796 | S | S | * | * | trans | 68.9 | 87.3 | 158.1 | -54.3 | -76.2 | 0 | 0 | 0 | 119.6 | ||||
| 355 | R | 40.3 | Very low | 43.6 | Very low | 257 Ų | 257 | 149.5 Ų | 149.5 | 97% | 0.97 | 80% | 0.803 | S | S | * | * | -161.8 | 136.9 | 127.4 | -98.2 | 162.9 | -172.3 | 175.7 | 2.1 | 106.4 | |||||
| 356 | G | 41.8 | Very low | 42.8 | Very low | 80 Ų | 80 | 141.8 Ų | 141.8 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | cis | 142.7 | 71.5 | 7.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 357 | G | 44.5 | Very low | 42.6 | Very low | 75 Ų | 75 | 142.8 Ų | 142.8 | 77% | 0.773 | 82% | 0.816 | S | S | * | * | trans | 103.8 | 165.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 358 | R | 36.9 | Very low | 42.4 | Very low | 256 Ų | 256 | 138.7 Ų | 138.7 | 97% | 0.966 | 81% | 0.812 | S | S | * | * | trans | 64.6 | 76.2 | 167.6 | -149.2 | 171.7 | -159.4 | 149 | 4.1 | 116.7 | ||||
| 359 | G | 38.1 | Very low | 42.3 | Very low | 81 Ų | 81 | 131.8 Ų | 131.8 | 84% | 0.835 | 80% | 0.801 | S | S | * | * | trans | -82.3 | -168.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 360 | G | 43.4 | Very low | 42.1 | Very low | 59 Ų | 59 | 132.2 Ų | 132.2 | 61% | 0.608 | 81% | 0.805 | S | S | * | * | trans | 163.4 | 140.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 361 | F | 37.3 | Very low | 41.8 | Very low | 210 Ų | 210 | 130.8 Ų | 130.8 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | trans | 65.8 | 114.1 | 153.6 | -47.9 | -70 | 0 | 0 | 0 | 120.4 | ||||
| 362 | R | 48.1 | Very low | 41.8 | Very low | 261 Ų | 261 | 128.8 Ų | 128.8 | 99% | 0.985 | 80% | 0.8 | S | S | * | * | trans | -64.5 | 135.2 | 156.1 | -65.9 | 170 | 170.7 | 154.1 | -5.2 | 109 | ||||
| 363 | G | 37.4 | Very low | 42.4 | Very low | 73 Ų | 73 | 132.1 Ų | 132.1 | 75% | 0.753 | 80% | 0.797 | S | S | * | * | trans | -147.3 | 44.9 | -164.2 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 364 | R | 37.4 | Very low | 42.4 | Very low | 249 Ų | 249 | 133.4 Ų | 133.4 | 94% | 0.94 | 79% | 0.791 | S | S | * | * | trans | 49.3 | 87.5 | 151 | -166.3 | -170.7 | -178.6 | -172.9 | 0.6 | 119.5 | ||||
| 365 | G | 34.3 | Very low | 42.8 | Very low | 81 Ų | 81 | 133.5 Ų | 133.5 | 84% | 0.835 | 79% | 0.791 | S | S | * | * | trans | 85.2 | 171.4 | 135.4 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 366 | G | 37.8 | Very low | 43.7 | Very low | 82 Ų | 82 | 124.9 Ų | 124.9 | 85% | 0.845 | 78% | 0.783 | S | S | * | * | trans | 95.3 | 110.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 367 | G | 45.6 | Very low | 45.1 | Very low | 89 Ų | 89 | 122.4 Ų | 122.4 | 92% | 0.918 | 76% | 0.757 | S | S | * | * | trans | -86.4 | 138.6 | 164.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 368 | G | 38.2 | Very low | 47.1 | Very low | 54 Ų | 54 | 120.7 Ų | 120.7 | 56% | 0.557 | 73% | 0.73 | S | S | * | * | trans | -165.6 | 29.8 | -171.1 | 0 | 0 | 0 | 0 | 0 | 116 | N371 | G368-N371 PolarHBondContact O-ND2 3.5Š| ||
| 369 | G | 39.9 | Very low | 49.3 | Very low | 68 Ų | 68 | 108.8 Ų | 108.8 | 70% | 0.701 | 69% | 0.685 | S | S | * | * | trans | 64.3 | 179.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | N371 | G369-N371 PolarHBondContact O-N 3.22Š| ||
| 370 | P | 43.5 | Very low | 51.7 | Low | 108 Ų | 108 | 108.6 Ų | 108.6 | 70% | 0.701 | 67% | 0.67 | S | S | * | * | trans | -76.9 | 75.7 | 167.7 | 33.9 | -33.5 | 0 | 0 | 0 | 109.1 | F372 | P370-F372 HydrophobicContact CB-CD2 4.34Å; P370-F372 HydrophobicContact CB-CE2 3.9Å; P370-F372 HydrophobicContact CB-CZ 4.27Å; P370-F372 HydrophobicContact CG-CE2 4.27Å; P370-F372 VanDerWaalsContact O-CD2 3.25Å; P370-F372 WeakPolarHBondContact O-CD2 3.24Å; P370-F372 PolarHBondContact O-N 2.82Å | ||
| 371 | N | 47 | Very low | 53.7 | Low | 133 Ų | 133 | 106.2 Ų | 106.2 | 71% | 0.711 | 64% | 0.643 | S | S | * | * | trans | -65.1 | 88.9 | 156.9 | -89.6 | -76.6 | 0 | 0 | 0 | 107.2 | G368 G369 D373 | G368-N371 PolarHBondContact O-ND2 3.5Å; G369-N371 PolarHBondContact O-N 3.22Å; N371-D373 PolarHBondContact O-N 3.37Å | ||
| 372 | F | 46.3 | Very low | 55.8 | Low | 167 Ų | 167 | 99.7 Ų | 99.7 | 73% | 0.732 | 62% | 0.622 | S | S | * | * | trans | -60.2 | 117.2 | 164.1 | -63 | -87.8 | 0 | 0 | 0 | 106.8 | P370 I374 | P370-F372 HydrophobicContact CB-CD2 4.34Å; P370-F372 HydrophobicContact CB-CE2 3.9Å; P370-F372 HydrophobicContact CB-CZ 4.27Å; P370-F372 HydrophobicContact CG-CE2 4.27Å; P370-F372 VanDerWaalsContact O-CD2 3.25Å; P370-F372 WeakPolarHBondContact O-CD2 3.24Å; P370-F372 PolarHBondContact O-N 2.82Å; F372-I374 VanDerWaalsContact C-N 3.29Å; F372-I374 PolarHBondContact O-N 2.95Å | ||
| 373 | D | 51 | Low | 57.3 | Low | 158 Ų | 158 | 91 Ų | 91 | 85% | 0.845 | 60% | 0.595 | S | S | * | * | trans | -58.7 | 95 | 173.1 | -67 | -77 | 0 | 0 | 0 | 109.3 | N371 K375 | N371-D373 PolarHBondContact O-N 3.37Å; D373-K375 PolarHBondContact O-N 3.49Å | ||
| 374 | I | 55.2 | Low | 59.2 | Low | 76 Ų | 76 | 93.3 Ų | 93.3 | 39% | 0.39 | 60% | 0.6 | S | S | . | * | trans | -58.6 | 105.8 | 176 | -71.6 | -65.8 | 0 | 0 | 0 | 106.7 | F372 G376 D378 M389 | F372-I374 VanDerWaalsContact C-N 3.29Å; F372-I374 PolarHBondContact O-N 2.95Å; I374-G376 VanDerWaalsContact C-N 3.33Å; I374-G376 PolarHBondContact O-N 2.93Å; I374-D378 WeakPolarHBondContact CG2-O 3.48Å; I374-M389 HydrophobicContact CD1-CE 4.02Å | ||
| 375 | K | 55.9 | Low | 61.2 | Low | 186 Ų | 186 | 86.3 Ų | 86.3 | 81% | 0.809 | 59% | 0.589 | S | S | * | * | G | 310 helix | trans | -69.6 | 91.3 | -166.3 | -145.4 | 169 | -171 | 169.6 | 0 | 109.4 | D373 G377 | D373-K375 PolarHBondContact O-N 3.49Å; K375-G377 PolarHBondContact O-N 3.18Å |
| 376 | G | 58.8 | Low | 63.7 | Low | 76 Ų | 76 | 83 Ų | 83 | 78% | 0.784 | 55% | 0.553 | S | S | * | * | G | 310 helix | trans | 46.1 | 57.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | I374 | I374-G376 VanDerWaalsContact C-N 3.33Å; I374-G376 PolarHBondContact O-N 2.93Å |
| 377 | G | 71.4 | Confident | 65.6 | Low | 28 Ų | 28 | 82.1 Ų | 82.1 | 29% | 0.289 | 54% | 0.544 | S | S | . | . | G | 310 helix | trans | 101 | -1 | 163.3 | 0 | 0 | 0 | 0 | 0 | 117.8 | K375 A392 | K375-G377 PolarHBondContact O-N 3.18Å; G377-A392 VanDerWaalsContact O-CA 3.22Å; G377-A392 WeakPolarHBondContact O-CA 3.46Å; G377-A392 VanDerWaalsContact O-CB 3.27Å; G377-A392 WeakPolarHBondContact O-CB 3.36Å |
| 378 | D | 84.6 | Confident | 67.6 | Low | 40 Ų | 40 | 80.2 Ų | 80.2 | 21% | 0.214 | 51% | 0.512 | C | S | . | . | trans | -62.4 | 138.3 | 171 | -73.9 | -3.2 | 0 | 0 | 0 | 110.7 | I374 M389 N390 F391 A392 | I374-D378 WeakPolarHBondContact CG2-O 3.48Å; D378-M389 HydrophobicContact CB-CG 4.43Å; D378-N390 CarbonylContact C-O 3.52Å; D378-N390 VanDerWaalsContact CA-O 3.3Å; D378-N390 WeakPolarHBondContact CA-O 3.4Å; D378-F391 VanDerWaalsContact OD1-CA 3.22Å; D378-F391 WeakPolarHBondContact OD1-CA 3.42Å; D378-A392 PolarHBondContact OD1-N 2.96Å | ||
| 379 | W | 84.9 | Confident | 69.8 | Low | 5 Ų | 5 | 83 Ų | 83 | 2% | 0.019 | 51% | 0.513 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.3 | 136.7 | -166.5 | 62.5 | -86.5 | 0 | 0 | 0 | 113.6 | N390 R394 C397 K404 | W379-N390 HydrophobicContact CD2-CB 3.9Å; W379-N390 HydrophobicContact CE3-CB 4.43Å; W379-N390 HydrophobicContact CG-CB 4.31Å; W379-N390 HydrophobicContact CH2-CB 4.36Å; W379-N390 HydrophobicContact CZ2-CB 3.81Å; W379-N390 WeakPolarHBondContact CZ3-ND2 3.34Å; W379-N390 PolarHBondContact N-O 2.84Å; W379-N390 WeakPolarHBondContact O-CB 3.49Å; W379-N390 PolarHBondContact O-N 3.17Å; W379-N390 PolarHBondContact O-ND2 2.72Å; W379-R394 PolarHBondContact NE1-O 2.61Å; W379-C397 HydrophobicContact CH2-CB 3.96Å; W379-C397 HydrophobicContact CZ3-CB 4.45Å; W379-K404 HydrophobicContact CD2-CB 4.15Å; W379-K404 HydrophobicContact CD2-CD 4.39Å; W379-K404 HydrophobicContact CD2-CG 3.77Å; W379-K404 HydrophobicContact CE3-CB 4.39Å; W379-K404 HydrophobicContact CE3-CG 4.25Å; W379-K404 HydrophobicContact CG-CD 4.27Å; W379-K404 HydrophobicContact CG-CG 4.01Å; W379-K404 HydrophobicContact CH2-CB 3.97Å; W379-K404 HydrophobicContact CZ2-CB 3.69Å; W379-K404 HydrophobicContact CZ2-CG 4.19Å; W379-K404 HydrophobicContact CZ3-CB 4.31Å |
| 380 | P | 87.4 | Confident | 71.9 | Confident | 78 Ų | 78 | 79.9 Ų | 79.9 | 51% | 0.506 | 48% | 0.479 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.2 | 141 | 177.2 | 30.8 | -34.3 | 0 | 0 | 0 | 112.3 | ||
| 381 | C | 85.5 | Confident | 73.9 | Confident | 8 Ų | 8 | 80.5 Ų | 80.5 | 5% | 0.054 | 47% | 0.471 | C | S | . | . | trans | -56.5 | 126.4 | 170.4 | 170.7 | 0 | 0 | 0 | 0 | 109.5 | N383 C386 N388 N390 C397 C400 | C381-N383 PolarHBondContact O-N 2.91Å; C381-N383 VanDerWaalsContact SG-CB 3.59Å; C381-N383 PolarHBondContact SG-N 3.03Å; C381-N383 VanDerWaalsContact SG-N 3.41Å; C381-C386 HydrophobicContact CB-CB 4.06Å; C381-C386 VanDerWaalsContact SG-CB 3.5Å; C381-N388 PolarHBondContact N-O 2.79Å; C381-N390 PolarHBondContact N-ND2 3.49Å; C381-C397 HydrophobicContact CB-CB 4.06Å; C381-C400 WeakPolarHBondContact CB-SG 3.35Å; C381-C400 WeakPolarHBondContact SG-CB 3.48Å; C381-C400 CovalentContact SG-SG 2.06Å; C381-C400 PolarHBondContact SG-SG 3.18Å | ||
| 382 | P | 82 | Confident | 75.6 | Confident | 74 Ų | 74 | 75.7 Ų | 75.7 | 48% | 0.481 | 45% | 0.45 | S | S | . | . | S | Bend | trans | -69.1 | -13.4 | -178.5 | 27.7 | -35.3 | 0 | 0 | 0 | 113.3 | S384 | P382-S384 PolarHBondContact O-N 2.85Š|
| 383 | N | 80.1 | Confident | 77.2 | Confident | 77 Ų | 77 | 78 Ų | 78 | 41% | 0.412 | 45% | 0.454 | S | S | . | . | trans | -78.6 | 109.5 | 171.6 | -177.3 | -14.6 | 0 | 0 | 0 | 110.5 | C381 S385 C386 G387 | C381-N383 PolarHBondContact O-N 2.91Å; C381-N383 VanDerWaalsContact SG-CB 3.59Å; C381-N383 PolarHBondContact SG-N 3.03Å; C381-N383 VanDerWaalsContact SG-N 3.41Å; N383-S385 VanDerWaalsContact CG-OG 3.27Å; N383-S385 PolarHBondContact ND2-OG 3.49Å; N383-S385 PolarHBondContact O-N 3.4Å; N383-S385 VanDerWaalsContact O-N 3.11Å; N383-S385 WeakPolarHBondContact OD1-CB 3.32Å; N383-S385 PolarHBondContact OD1-N 2.73Å; N383-S385 PolarHBondContact OD1-OG 3.21Å; N383-C386 HydrophobicContact CB-CB 4.41Å; N383-C386 VanDerWaalsContact O-CB 3.28Å; N383-C386 WeakPolarHBondContact O-CB 3.25Å; N383-C386 PolarHBondContact O-N 3.35Å; N383-G387 PolarHBondContact O-N 2.86Å | ||
| 384 | S | 77.1 | Confident | 78.7 | Confident | 122 Ų | 122 | 74.2 Ų | 74.2 | 85% | 0.853 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | -24.8 | -179.6 | -48.2 | 0 | 0 | 0 | 0 | 114.8 | P382 C386 | P382-S384 PolarHBondContact O-N 2.85Å; S384-C386 VanDerWaalsContact C-N 3.28Å; S384-C386 PolarHBondContact O-N 2.75Å |
| 385 | S | 79.6 | Confident | 80.1 | Confident | 102 Ų | 102 | 76.9 Ų | 76.9 | 71% | 0.713 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.5 | -18.4 | 174 | 68.9 | 0 | 0 | 0 | 0 | 113.6 | N383 | N383-S385 VanDerWaalsContact CG-OG 3.27Å; N383-S385 PolarHBondContact ND2-OG 3.49Å; N383-S385 PolarHBondContact O-N 3.4Å; N383-S385 VanDerWaalsContact O-N 3.11Å; N383-S385 WeakPolarHBondContact OD1-CB 3.32Å; N383-S385 PolarHBondContact OD1-N 2.73Å; N383-S385 PolarHBondContact OD1-OG 3.21Å |
| 386 | C | 85.2 | Confident | 81.7 | Confident | 13 Ų | 13 | 74.3 Ų | 74.3 | 9% | 0.088 | 43% | 0.43 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91 | -49.8 | -177.4 | -178.9 | 0 | 0 | 0 | 0 | 112.6 | C381 N383 S384 N388 K399 C400 | C381-C386 HydrophobicContact CB-CB 4.06Å; C381-C386 VanDerWaalsContact SG-CB 3.5Å; N383-C386 HydrophobicContact CB-CB 4.41Å; N383-C386 VanDerWaalsContact O-CB 3.28Å; N383-C386 WeakPolarHBondContact O-CB 3.25Å; N383-C386 PolarHBondContact O-N 3.35Å; S384-C386 VanDerWaalsContact C-N 3.28Å; S384-C386 PolarHBondContact O-N 2.75Å; C386-N388 PolarHBondContact O-N 2.95Å; C386-N388 VanDerWaalsContact O-N 3.08Å; C386-N388 VanDerWaalsContact SG-CB 3.5Å; C386-K399 PolarHBondContact O-NZ 3.32Å; C386-C400 HydrophobicContact CB-CB 3.62Å; C386-C400 WeakPolarHBondContact SG-CB 3.36Å |
| 387 | G | 79.1 | Confident | 83.2 | Confident | 62 Ų | 62 | 71 Ų | 71 | 64% | 0.639 | 40% | 0.395 | S | S | * | . | trans | 62.6 | 5.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 116.2 | N383 | N383-G387 PolarHBondContact O-N 2.86Š| ||
| 388 | N | 86.4 | Confident | 83.9 | Confident | 49 Ų | 49 | 74.6 Ų | 74.6 | 26% | 0.262 | 41% | 0.407 | S | S | . | . | trans | -79.2 | 127.7 | -169 | -169.9 | 81.9 | 0 | 0 | 0 | 113.1 | C381 C386 N390 K399 | C381-N388 PolarHBondContact N-O 2.79Å; C386-N388 PolarHBondContact O-N 2.95Å; C386-N388 VanDerWaalsContact O-N 3.08Å; C386-N388 VanDerWaalsContact SG-CB 3.5Å; N388-N390 PolarHBondContact ND2-OD1 2.83Å; N388-N390 PolarHBondContact O-ND2 2.75Å; N388-K399 HydrophobicContact CB-CB 4Å; N388-K399 HydrophobicContact CB-CD 4.08Å | ||
| 389 | M | 85.4 | Confident | 83.9 | Confident | 114 Ų | 114 | 79.4 Ų | 79.4 | 56% | 0.562 | 43% | 0.426 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -76.8 | 129.5 | 169.1 | -171.1 | 172.2 | -76.5 | 0 | 0 | 110.7 | I374 D378 | I374-M389 HydrophobicContact CD1-CE 4.02Å; D378-M389 HydrophobicContact CB-CG 4.43Å |
| 390 | N | 84.3 | Confident | 84 | Confident | 1 Ų | 1 | 81.1 Ų | 81.1 | 1% | 0.005 | 44% | 0.438 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.9 | 140.7 | -174.4 | -54.9 | -63.8 | 0 | 0 | 0 | 110.9 | D378 W379 C381 N388 C397 N398 | D378-N390 CarbonylContact C-O 3.52Å; D378-N390 VanDerWaalsContact CA-O 3.3Å; D378-N390 WeakPolarHBondContact CA-O 3.4Å; W379-N390 HydrophobicContact CD2-CB 3.9Å; W379-N390 HydrophobicContact CE3-CB 4.43Å; W379-N390 HydrophobicContact CG-CB 4.31Å; W379-N390 HydrophobicContact CH2-CB 4.36Å; W379-N390 HydrophobicContact CZ2-CB 3.81Å; W379-N390 WeakPolarHBondContact CZ3-ND2 3.34Å; W379-N390 PolarHBondContact N-O 2.84Å; W379-N390 WeakPolarHBondContact O-CB 3.49Å; W379-N390 PolarHBondContact O-N 3.17Å; W379-N390 PolarHBondContact O-ND2 2.72Å; C381-N390 PolarHBondContact N-ND2 3.49Å; N388-N390 PolarHBondContact ND2-OD1 2.83Å; N388-N390 PolarHBondContact O-ND2 2.75Å; N390-C397 WeakPolarHBondContact OD1-CA 3.44Å; N390-C397 PolarHBondContact OD1-SG 3.22Å; N390-N398 PolarHBondContact OD1-N 3.47Å |
| 391 | F | 85.3 | Confident | 83.9 | Confident | 121 Ų | 121 | 79.6 Ų | 79.6 | 53% | 0.531 | 44% | 0.437 | S | S | . | . | trans | -62.1 | 140.9 | 177.3 | -62.8 | -68 | 0 | 0 | 0 | 112.6 | D378 R393 R394 | D378-F391 VanDerWaalsContact OD1-CA 3.22Å; D378-F391 WeakPolarHBondContact OD1-CA 3.42Å; F391-R393 HydrophobicContact CB-CG 4.26Å; F391-R393 PolarHBondContact O-N 2.85Å; F391-R394 WeakPolarHBondContact O-CB 3.3Å; F391-R394 PolarHBondContact O-N 2.91Å | ||
| 392 | A | 81.4 | Confident | 83.9 | Confident | 33 Ų | 33 | 80.4 Ų | 80.4 | 27% | 0.273 | 44% | 0.444 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -46.4 | -38 | -174.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | G377 D378 R394 K404 | G377-A392 VanDerWaalsContact O-CA 3.22Å; G377-A392 WeakPolarHBondContact O-CA 3.46Å; G377-A392 VanDerWaalsContact O-CB 3.27Å; G377-A392 WeakPolarHBondContact O-CB 3.36Å; D378-A392 PolarHBondContact OD1-N 2.96Å; A392-R394 VanDerWaalsContact C-N 3.26Å; A392-R394 PolarHBondContact O-N 3.16Å; A392-K404 PolarHBondContact O-NZ 2.98Å; A392-K404 VanDerWaalsContact O-NZ 3.11Å |
| 393 | R | 81.4 | Confident | 84 | Confident | 214 Ų | 214 | 81.3 Ų | 81.3 | 81% | 0.808 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.5 | -6.4 | -179.6 | 68.6 | 179.5 | 177.7 | 116 | -6.7 | 115.6 | F391 | F391-R393 HydrophobicContact CB-CG 4.26Å; F391-R393 PolarHBondContact O-N 2.85Å |
| 394 | R | 80.9 | Confident | 84.1 | Confident | 79 Ų | 79 | 80.6 Ų | 80.6 | 30% | 0.298 | 44% | 0.443 | S | S | . | . | trans | -97 | 135.1 | 179.4 | -65.9 | 178.8 | 169.4 | -105 | 9 | 109.9 | W379 F391 A392 E396 N398 | W379-R394 PolarHBondContact NE1-O 2.61Å; F391-R394 WeakPolarHBondContact O-CB 3.3Å; F391-R394 PolarHBondContact O-N 2.91Å; A392-R394 VanDerWaalsContact C-N 3.26Å; A392-R394 PolarHBondContact O-N 3.16Å; R394-E396 WeakPolarHBondContact CB-O 3.21Å; R394-N398 PolarHBondContact NH1-OD1 2.95Å; R394-N398 PolarHBondContact NH2-OD1 2.98Å | ||
| 395 | Q | 85.6 | Confident | 84.3 | Confident | 133 Ų | 133 | 77.1 Ų | 77.1 | 62% | 0.621 | 42% | 0.418 | S | S | * | . | S | Bend | trans | -93.8 | -5.3 | 170.5 | -51.2 | -62.1 | 29.9 | 0 | 0 | 112.9 | P403 K404 | Q395-P403 CarbonylContact O-C 3.58Å; Q395-P403 WeakPolarHBondContact O-CA 3.31Å; Q395-K404 WeakPolarHBondContact O-CB 3.47Å; Q395-K404 PolarHBondContact O-N 3.13Å |
| 396 | E | 88.6 | Confident | 83.6 | Confident | 131 Ų | 131 | 81.8 Ų | 81.8 | 61% | 0.612 | 43% | 0.428 | S | S | * | . | B | Isolated β-bridge | trans | -136.9 | 148.3 | 179.6 | -69.8 | 164.9 | -150.6 | 0 | 0 | 109.8 | R394 | R394-E396 WeakPolarHBondContact CB-O 3.21Å |
| 397 | C | 90.4 | Very high | 82.4 | Confident | 7 Ų | 7 | 88.5 Ų | 88.5 | 5% | 0.047 | 46% | 0.463 | C | S | . | . | trans | -76 | 135 | -178.9 | 172.8 | 0 | 0 | 0 | 0 | 112.7 | W379 C381 N390 K399 C400 G401 A402 | W379-C397 HydrophobicContact CH2-CB 3.96Å; W379-C397 HydrophobicContact CZ3-CB 4.45Å; C381-C397 HydrophobicContact CB-CB 4.06Å; N390-C397 WeakPolarHBondContact OD1-CA 3.44Å; N390-C397 PolarHBondContact OD1-SG 3.22Å; C397-K399 PolarHBondContact O-N 3.39Å; C397-K399 PolarHBondContact SG-N 3.32Å; C397-C400 HydrophobicContact CB-CB 4.41Å; C397-C400 WeakPolarHBondContact CB-SG 3.41Å; C397-C400 PolarHBondContact SG-N 3.5Å; C397-C400 PolarHBondContact SG-SG 3.14Å; C397-G401 WeakPolarHBondContact O-CA 3.38Å; C397-G401 PolarHBondContact O-N 3.39Å; C397-G401 VanDerWaalsContact O-N 3.09Å; C397-A402 PolarHBondContact N-O 2.93Å | ||
| 398 | N | 87.3 | Confident | 81.3 | Confident | 104 Ų | 104 | 87.3 Ų | 87.3 | 56% | 0.556 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.8 | -3.2 | 178.8 | -165.2 | 73 | 0 | 0 | 0 | 115.4 | N390 R394 | N390-N398 PolarHBondContact OD1-N 3.47Å; R394-N398 PolarHBondContact NH1-OD1 2.95Å; R394-N398 PolarHBondContact NH2-OD1 2.98Å |
| 399 | K | 84.8 | Confident | 79.8 | Confident | 141 Ų | 141 | 88.4 Ų | 88.4 | 61% | 0.613 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -132.7 | -39 | -177.2 | -179.4 | -175.7 | 169 | -161.9 | 0 | 113.4 | C386 N388 C397 | C386-K399 PolarHBondContact O-NZ 3.32Å; N388-K399 HydrophobicContact CB-CB 4Å; N388-K399 HydrophobicContact CB-CD 4.08Å; C397-K399 PolarHBondContact O-N 3.39Å; C397-K399 PolarHBondContact SG-N 3.32Å |
| 400 | C | 86.7 | Confident | 78.2 | Confident | 40 Ų | 40 | 91 Ų | 91 | 27% | 0.27 | 48% | 0.479 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.4 | -9.4 | -180 | 65.6 | 0 | 0 | 0 | 0 | 114.4 | C381 C386 C397 A402 | C381-C400 WeakPolarHBondContact CB-SG 3.35Å; C381-C400 WeakPolarHBondContact SG-CB 3.48Å; C381-C400 CovalentContact SG-SG 2.06Å; C381-C400 PolarHBondContact SG-SG 3.18Å; C386-C400 HydrophobicContact CB-CB 3.62Å; C386-C400 WeakPolarHBondContact SG-CB 3.36Å; C397-C400 HydrophobicContact CB-CB 4.41Å; C397-C400 WeakPolarHBondContact CB-SG 3.41Å; C397-C400 PolarHBondContact SG-N 3.5Å; C397-C400 PolarHBondContact SG-SG 3.14Å; C400-A402 HydrophobicContact CB-CB 4.43Å; C400-A402 PolarHBondContact O-N 2.83Å; C400-A402 WeakPolarHBondContact SG-CB 3.36Å |
| 401 | G | 84.8 | Confident | 76.5 | Confident | 46 Ų | 46 | 94.6 Ų | 94.6 | 47% | 0.474 | 52% | 0.516 | S | S | . | . | trans | 66 | -17.6 | -171.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | C397 | C397-G401 WeakPolarHBondContact O-CA 3.38Å; C397-G401 PolarHBondContact O-N 3.39Å; C397-G401 VanDerWaalsContact O-N 3.09Å | ||
| 402 | A | 85.4 | Confident | 74.5 | Confident | 25 Ų | 25 | 92.5 Ų | 92.5 | 21% | 0.207 | 53% | 0.528 | C | S | . | . | P | Polyproline II helix | trans | -55.6 | 143.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | C397 C400 | C397-A402 PolarHBondContact N-O 2.93Å; C400-A402 HydrophobicContact CB-CB 4.43Å; C400-A402 PolarHBondContact O-N 2.83Å; C400-A402 WeakPolarHBondContact SG-CB 3.36Å |
| 403 | P | 84.6 | Confident | 72.9 | Confident | 93 Ų | 93 | 93.7 Ų | 93.7 | 60% | 0.604 | 54% | 0.544 | S | S | * | . | B | Isolated β-bridge | trans | -64.7 | 157.7 | -179 | 28 | -35.9 | 0 | 0 | 0 | 111.7 | Q395 | Q395-P403 CarbonylContact O-C 3.58Å; Q395-P403 WeakPolarHBondContact O-CA 3.31Å |
| 404 | K | 82.8 | Confident | 71.5 | Confident | 62 Ų | 62 | 90.6 Ų | 90.6 | 27% | 0.27 | 54% | 0.543 | S | S | . | . | P | Polyproline II helix | trans | -63.3 | 126.3 | 168.6 | -176.3 | 175.4 | -170.6 | 175.3 | 0 | 108.7 | W379 A392 Q395 E406 | W379-K404 HydrophobicContact CD2-CB 4.15Å; W379-K404 HydrophobicContact CD2-CD 4.39Å; W379-K404 HydrophobicContact CD2-CG 3.77Å; W379-K404 HydrophobicContact CE3-CB 4.39Å; W379-K404 HydrophobicContact CE3-CG 4.25Å; W379-K404 HydrophobicContact CG-CD 4.27Å; W379-K404 HydrophobicContact CG-CG 4.01Å; W379-K404 HydrophobicContact CH2-CB 3.97Å; W379-K404 HydrophobicContact CZ2-CB 3.69Å; W379-K404 HydrophobicContact CZ2-CG 4.19Å; W379-K404 HydrophobicContact CZ3-CB 4.31Å; A392-K404 PolarHBondContact O-NZ 2.98Å; A392-K404 VanDerWaalsContact O-NZ 3.11Å; Q395-K404 WeakPolarHBondContact O-CB 3.47Å; Q395-K404 PolarHBondContact O-N 3.13Å; K404-E406 PolarHBondContact O-N 3.39Å |
| 405 | P | 79.6 | Confident | 69.8 | Low | 49 Ų | 49 | 99 Ų | 99 | 32% | 0.318 | 58% | 0.575 | S | S | . | * | P | Polyproline II helix | trans | -62.9 | 121.5 | 174.3 | 23.5 | -30 | 0 | 0 | 0 | 109.5 | D407 A408 | P405-D407 VanDerWaalsContact C-N 3.26Å; P405-D407 PolarHBondContact O-N 3.11Å; P405-A408 HydrophobicContact CG-CB 4.2Å; P405-A408 VanDerWaalsContact O-CB 3.27Å; P405-A408 WeakPolarHBondContact O-CB 3.31Å; P405-A408 PolarHBondContact O-N 3.13Å |
| 406 | E | 66.4 | Low | 67.6 | Low | 201 Ų | 201 | 96.5 Ų | 96.5 | 94% | 0.939 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | -27.4 | -177.4 | 58.1 | -154 | 114.8 | 0 | 0 | 113.1 | K404 A408 | K404-E406 PolarHBondContact O-N 3.39Å; E406-A408 PolarHBondContact O-N 2.87Å |
| 407 | D | 60.2 | Low | 65.3 | Low | 154 Ų | 154 | 93.9 Ų | 93.9 | 82% | 0.824 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | 7.6 | 175.2 | -157.3 | -124.2 | 0 | 0 | 0 | 114.1 | P405 G409 | P405-D407 VanDerWaalsContact C-N 3.26Å; P405-D407 PolarHBondContact O-N 3.11Å; D407-G409 PolarHBondContact O-N 3.06Å |
| 408 | A | 55.4 | Low | 63.1 | Low | 36 Ų | 36 | 105.9 Ų | 105.9 | 30% | 0.298 | 64% | 0.637 | S | S | . | * | trans | -74.8 | 54.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | P405 E406 F410 | P405-A408 HydrophobicContact CG-CB 4.2Å; P405-A408 VanDerWaalsContact O-CB 3.27Å; P405-A408 WeakPolarHBondContact O-CB 3.31Å; P405-A408 PolarHBondContact O-N 3.13Å; E406-A408 PolarHBondContact O-N 2.87Å; A408-F410 HydrophobicContact CB-CD2 4.38Å; A408-F410 PolarHBondContact O-N 3.46Å | ||
| 409 | G | 53.8 | Low | 60.7 | Low | 73 Ų | 73 | 104.3 Ų | 104.3 | 75% | 0.753 | 65% | 0.646 | S | S | * | * | trans | -69.2 | 36.4 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | D407 G411 | D407-G409 PolarHBondContact O-N 3.06Å; G409-G411 VanDerWaalsContact C-N 3.3Å; G409-G411 PolarHBondContact O-N 3.4Å | ||
| 410 | F | 51.8 | Low | 58.6 | Low | 169 Ų | 169 | 101.1 Ų | 101.1 | 74% | 0.741 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -78.3 | 73.3 | -178.8 | -66.3 | -74.8 | 0 | 0 | 0 | 112.4 | A408 G412 | A408-F410 HydrophobicContact CB-CD2 4.38Å; A408-F410 PolarHBondContact O-N 3.46Å; F410-G412 VanDerWaalsContact C-N 3.33Å; F410-G412 PolarHBondContact O-N 2.62Å; F410-G412 VanDerWaalsContact O-N 3.12Å |
| 411 | G | 49.3 | Very low | 56.5 | Low | 75 Ų | 75 | 108.6 Ų | 108.6 | 77% | 0.773 | 68% | 0.681 | S | S | * | * | trans | 64.3 | 25.1 | 154.6 | 0 | 0 | 0 | 0 | 0 | 117.1 | G409 G413 | G409-G411 VanDerWaalsContact C-N 3.3Å; G409-G411 PolarHBondContact O-N 3.4Å; G411-G413 VanDerWaalsContact C-N 3.25Å; G411-G413 PolarHBondContact O-N 3.48Å | ||
| 412 | G | 42.8 | Very low | 54.1 | Low | 77 Ų | 77 | 110.1 Ų | 110.1 | 79% | 0.794 | 70% | 0.697 | S | S | * | * | trans | -73.5 | 65.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | F410 | F410-G412 VanDerWaalsContact C-N 3.33Å; F410-G412 PolarHBondContact O-N 2.62Å; F410-G412 VanDerWaalsContact O-N 3.12Å | ||
| 413 | G | 48.8 | Very low | 52 | Low | 58 Ų | 58 | 112 Ų | 112 | 60% | 0.598 | 72% | 0.719 | S | S | * | * | trans | -60 | 150.9 | 168.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | G411 | G411-G413 VanDerWaalsContact C-N 3.25Å; G411-G413 PolarHBondContact O-N 3.48Å | ||
| 414 | D | 52 | Low | 50 | Low | 149 Ų | 149 | 115.3 Ų | 115.3 | 80% | 0.797 | 73% | 0.731 | S | S | * | * | S | Bend | trans | 64.6 | 66.3 | 161.8 | -56.3 | -67.7 | 0 | 0 | 0 | 118.6 | ||
| 415 | R | 45.8 | Very low | 48.1 | Very low | 256 Ų | 256 | 125.1 Ų | 125.1 | 97% | 0.966 | 77% | 0.767 | S | S | * | * | -177.2 | 125.7 | 121.4 | -104.5 | 165.3 | -75.2 | -173.5 | -4.2 | 116.3 | |||||
| 416 | G | 39.4 | Very low | 46.1 | Very low | 80 Ų | 80 | 126.2 Ų | 126.2 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | trans | 147.5 | 119 | 148.2 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 417 | G | 39.3 | Very low | 44.7 | Very low | 77 Ų | 77 | 120 Ų | 120 | 79% | 0.794 | 78% | 0.777 | S | S | * | * | trans | 79.9 | 124.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 418 | R | 43.8 | Very low | 43.6 | Very low | 258 Ų | 258 | 117.2 Ų | 117.2 | 97% | 0.974 | 77% | 0.77 | S | S | * | * | cis | 70.9 | 82.7 | 10.7 | -155.5 | -169.5 | -163.4 | -148.8 | 5.7 | 116.3 | ||||
| 419 | G | 38.1 | Very low | 42.9 | Very low | 71 Ų | 71 | 124.1 Ų | 124.1 | 73% | 0.732 | 79% | 0.793 | S | S | * | * | trans | 145.1 | 116.5 | 165.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 420 | G | 39.2 | Very low | 42.4 | Very low | 74 Ų | 74 | 132.4 Ų | 132.4 | 76% | 0.763 | 80% | 0.802 | S | S | * | * | trans | 157.7 | 87.7 | -173.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 421 | F | 43.4 | Very low | 41.6 | Very low | 198 Ų | 198 | 127.8 Ų | 127.8 | 87% | 0.868 | 80% | 0.801 | S | S | * | * | trans | -124 | 123.4 | -172.1 | 10.7 | -110.7 | 0 | 0 | 0 | 110.3 | ||||
| 422 | G | 35.1 | Very low | 41.2 | Very low | 77 Ų | 77 | 136.5 Ų | 136.5 | 79% | 0.794 | 81% | 0.811 | S | S | * | * | trans | 155.3 | 124.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 423 | G | 41 | Very low | 40.9 | Very low | 65 Ų | 65 | 135.9 Ų | 135.9 | 67% | 0.67 | 80% | 0.804 | S | S | * | * | trans | 72.3 | 138.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 424 | D | 41 | Very low | 40.4 | Very low | 163 Ų | 163 | 136.4 Ų | 136.4 | 87% | 0.872 | 81% | 0.81 | S | S | * | * | cis | -143.3 | 122.9 | -13.6 | -84.8 | -65.8 | 0 | 0 | 0 | 110.1 | ||||
| 425 | R | 44.2 | Very low | 39.8 | Very low | 267 Ų | 267 | 138.6 Ų | 138.6 | 100% | 1.008 | 81% | 0.813 | S | S | * | * | trans | -96.9 | 81.1 | 165.5 | -76.4 | -172.9 | 179.9 | 173.1 | 1.2 | 108.9 | ||||
| 426 | G | 36.6 | Very low | 39.6 | Very low | 73 Ų | 73 | 138.2 Ų | 138.2 | 75% | 0.753 | 81% | 0.811 | S | S | * | * | trans | -123.1 | 135 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 427 | G | 37.8 | Very low | 39.6 | Very low | 70 Ų | 70 | 138.6 Ų | 138.6 | 72% | 0.722 | 82% | 0.815 | S | S | * | * | trans | 92.2 | 48.9 | 144.6 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 428 | S | 37.1 | Very low | 39.5 | Very low | 96 Ų | 96 | 138 Ų | 138 | 67% | 0.671 | 81% | 0.809 | S | S | * | * | 61.4 | 154.6 | 127.8 | -54.3 | 0 | 0 | 0 | 0 | 123.9 | |||||
| 429 | F | 41.3 | Very low | 39.4 | Very low | 181 Ų | 181 | 131.9 Ų | 131.9 | 79% | 0.794 | 80% | 0.796 | S | S | * | * | trans | 98.1 | 109.4 | 149.7 | -53.3 | -57.1 | 0 | 0 | 0 | 121.8 | ||||
| 430 | R | 42.2 | Very low | 39.6 | Very low | 247 Ų | 247 | 139 Ų | 139 | 93% | 0.932 | 80% | 0.8 | S | S | * | * | trans | 68.7 | 129.4 | 151 | -53.1 | 173.4 | -165.6 | -146.3 | 3.9 | 117.6 | ||||
| 431 | G | 36.1 | Very low | 39.6 | Very low | 71 Ų | 71 | 138.8 Ų | 138.8 | 73% | 0.732 | 80% | 0.798 | S | S | * | * | cis | 159.8 | 168.7 | -8.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 432 | R | 39.5 | Very low | 39.4 | Very low | 259 Ų | 259 | 132.4 Ų | 132.4 | 98% | 0.977 | 79% | 0.788 | S | S | * | * | trans | 67.3 | 131.3 | 171.3 | -176.7 | -172.2 | -75.5 | -156.1 | -3 | 116.7 | ||||
| 433 | G | 36.1 | Very low | 39.6 | Very low | 63 Ų | 63 | 138.8 Ų | 138.8 | 65% | 0.649 | 79% | 0.794 | S | S | * | * | cis | 151.3 | 130.1 | -13.5 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 434 | G | 39.3 | Very low | 39.4 | Very low | 69 Ų | 69 | 139.5 Ų | 139.5 | 71% | 0.711 | 80% | 0.801 | S | S | * | * | trans | 76.2 | 167.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 435 | F | 40.3 | Very low | 39.3 | Very low | 196 Ų | 196 | 136 Ų | 136 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | cis | -150 | 137.1 | -3.1 | -68.6 | -88.7 | 0 | 0 | 0 | 107.8 | ||||
| 436 | R | 41.5 | Very low | 39.1 | Very low | 247 Ų | 247 | 126.3 Ų | 126.3 | 93% | 0.932 | 79% | 0.787 | S | S | * | * | 61.6 | 123.2 | 86.8 | -96.6 | -168.8 | -176.8 | -170 | 2.7 | 118 | |||||
| 437 | G | 38 | Very low | 39.3 | Very low | 88 Ų | 88 | 128.9 Ų | 128.9 | 91% | 0.907 | 78% | 0.783 | S | S | * | * | trans | 96.2 | 148.2 | 165.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 438 | G | 37.9 | Very low | 39.4 | Very low | 64 Ų | 64 | 135.8 Ų | 135.8 | 66% | 0.66 | 79% | 0.787 | S | S | * | * | cis | 164 | 153.7 | -9 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 439 | D | 42.1 | Very low | 39.3 | Very low | 131 Ų | 131 | 134.5 Ų | 134.5 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | trans | 66.1 | 156.9 | 156.7 | -69.3 | -94 | 0 | 0 | 0 | 119.8 | ||||
| 440 | R | 42 | Very low | 39.2 | Very low | 221 Ų | 221 | 136.3 Ų | 136.3 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | cis | -171.8 | 153.1 | -16.9 | 177.9 | -174.3 | -56.7 | 177.4 | 2.6 | 111.1 | ||||
| 441 | G | 39.7 | Very low | 38.8 | Very low | 69 Ų | 69 | 128.3 Ų | 128.3 | 71% | 0.711 | 79% | 0.792 | S | S | * | * | trans | 89.4 | 157.7 | 170.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 442 | G | 37.8 | Very low | 38.9 | Very low | 63 Ų | 63 | 129 Ų | 129 | 65% | 0.649 | 80% | 0.799 | S | S | * | * | cis | 125.7 | 142.7 | 5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 443 | F | 40.2 | Very low | 38.7 | Very low | 212 Ų | 212 | 120.4 Ų | 120.4 | 93% | 0.93 | 79% | 0.791 | S | S | * | * | cis | -159.5 | 177.3 | -2.3 | -49.6 | -85.5 | 0 | 0 | 0 | 107.4 | ||||
| 444 | G | 37.4 | Very low | 39 | Very low | 79 Ų | 79 | 127.6 Ų | 127.6 | 81% | 0.814 | 80% | 0.8 | S | S | * | * | cis | 155.9 | 118.8 | -7.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 445 | G | 39.1 | Very low | 39.2 | Very low | 89 Ų | 89 | 134.3 Ų | 134.3 | 92% | 0.918 | 81% | 0.81 | S | S | * | * | trans | 94.9 | 158.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 446 | G | 38.9 | Very low | 39.3 | Very low | 64 Ų | 64 | 134 Ų | 134 | 66% | 0.66 | 81% | 0.813 | S | S | * | * | cis | 170.1 | 155.8 | -8 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 447 | D | 40.2 | Very low | 39.1 | Very low | 128 Ų | 128 | 126.2 Ų | 126.2 | 68% | 0.684 | 81% | 0.81 | S | S | * | * | trans | 67 | 156.3 | 159.1 | -56.2 | -57.5 | 0 | 0 | 0 | 119.8 | ||||
| 448 | R | 40.5 | Very low | 39 | Very low | 214 Ų | 214 | 126.1 Ų | 126.1 | 81% | 0.808 | 81% | 0.809 | S | S | * | * | cis | -164 | 142.7 | -17.9 | -115.4 | 172.7 | -116.3 | 161.6 | 10.5 | 111.7 | ||||
| 449 | G | 35.9 | Very low | 39.1 | Very low | 69 Ų | 69 | 135.3 Ų | 135.3 | 71% | 0.711 | 82% | 0.824 | S | S | * | * | trans | 77.2 | 172 | 155.7 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 450 | F | 38.7 | Very low | 38.8 | Very low | 219 Ų | 219 | 131.9 Ų | 131.9 | 96% | 0.961 | 82% | 0.819 | S | S | * | * | cis | -166.1 | 139.7 | -19.4 | -134 | -78.9 | 0 | 0 | 0 | 111.5 | ||||
| 451 | G | 34.1 | Very low | 38.6 | Very low | 79 Ų | 79 | 129 Ų | 129 | 81% | 0.814 | 82% | 0.82 | S | S | * | * | trans | 74.3 | 160 | 169.3 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 452 | G | 37.5 | Very low | 38.7 | Very low | 87 Ų | 87 | 137.6 Ų | 137.6 | 90% | 0.897 | 83% | 0.831 | S | S | * | * | cis | 143 | 93.3 | -6.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 453 | G | 36.4 | Very low | 39 | Very low | 78 Ų | 78 | 145.5 Ų | 145.5 | 80% | 0.804 | 84% | 0.841 | S | S | * | * | trans | -167.5 | 141.8 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 454 | Y | 42.5 | Very low | 39.3 | Very low | 214 Ų | 214 | 142.7 Ų | 142.7 | 84% | 0.839 | 84% | 0.836 | S | S | * | * | trans | -123.8 | 147.8 | -168.3 | 45.6 | -92.3 | 0 | 0 | 0 | 112.3 | ||||
| 455 | K | 42.6 | Very low | 39.6 | Very low | 209 Ų | 209 | 147 Ų | 147 | 91% | 0.909 | 84% | 0.84 | S | S | * | * | trans | -167.7 | 146.6 | 150.8 | -107.8 | 154.8 | -173.9 | 177.3 | 0 | 110.8 | ||||
| 456 | M | 41.8 | Very low | 40.1 | Very low | 190 Ų | 190 | 154.3 Ų | 154.3 | 94% | 0.936 | 84% | 0.84 | S | S | * | * | trans | -125.4 | 154.2 | -169.9 | -85.1 | -81.5 | -138.4 | 0 | 0 | 111.4 | ||||
| 457 | G | 38.2 | Very low | 40.4 | Very low | 84 Ų | 84 | 163.1 Ų | 163.1 | 87% | 0.866 | 85% | 0.853 | S | S | * | * | trans | 89 | 143.9 | 144 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 458 | G | 35.3 | Very low | 40.6 | Very low | 85 Ų | 85 | 164.6 Ų | 164.6 | 88% | 0.876 | 86% | 0.861 | S | S | * | * | trans | 143.6 | 79.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 459 | R | 40.5 | Very low | 40.6 | Very low | 258 Ų | 258 | 165.7 Ų | 165.7 | 97% | 0.974 | 87% | 0.866 | S | S | * | * | trans | -147.7 | 121.9 | -179.3 | -161.4 | -174.5 | -159.8 | -166.7 | 7.1 | 110.5 | ||||
| 460 | G | 35.2 | Very low | 41.7 | Very low | 58 Ų | 58 | 167.4 Ų | 167.4 | 60% | 0.598 | 86% | 0.864 | S | S | * | * | trans | 128.9 | 151.2 | -170.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 461 | D | 38.7 | Very low | 41.6 | Very low | 160 Ų | 160 | 171.1 Ų | 171.1 | 86% | 0.856 | 87% | 0.874 | S | S | * | * | cis | -149.2 | 129.5 | -9.3 | -72.5 | -64.9 | 0 | 0 | 0 | 108.6 | ||||
| 462 | R | 40.8 | Very low | 42 | Very low | 251 Ų | 251 | 175.8 Ų | 175.8 | 95% | 0.947 | 88% | 0.877 | S | S | * | * | trans | -151.4 | 90 | 170.2 | -68.9 | -164.5 | -171.5 | 179.8 | 3.7 | 111.5 | ||||
| 463 | R | 45.4 | Very low | 42.2 | Very low | 228 Ų | 228 | 180.4 Ų | 180.4 | 86% | 0.86 | 88% | 0.876 | S | S | * | * | trans | -135.9 | 169.1 | 155.8 | -80.2 | -170 | 171 | -174.8 | -3.1 | 107.8 | ||||
| 464 | D | 45.2 | Very low | 42.5 | Very low | 154 Ų | 154 | 186.1 Ų | 186.1 | 82% | 0.824 | 88% | 0.88 | S | S | * | * | trans | 75.1 | 48.1 | 167.4 | -52.2 | -59.1 | 0 | 0 | 0 | 117.7 | ||||
| 465 | D | 43.6 | Very low | 42.5 | Very low | 169 Ų | 169 | 184.5 Ų | 184.5 | 90% | 0.904 | 88% | 0.882 | S | S | * | * | trans | -114.6 | 69.3 | 154.8 | -82.5 | -56.3 | 0 | 0 | 0 | 110.7 | ||||
| 466 | R | 49.3 | Very low | 42.5 | Very low | 243 Ų | 243 | 182.9 Ų | 182.9 | 92% | 0.917 | 88% | 0.88 | S | S | * | * | trans | -144.8 | 87.1 | 164.5 | -84.8 | -162.3 | -178.7 | -168.7 | 2.3 | 110.3 | ||||
| 467 | R | 45.7 | Very low | 42.6 | Very low | 248 Ų | 248 | 182.5 Ų | 182.5 | 94% | 0.936 | 88% | 0.877 | S | S | * | * | trans | -143.8 | 158.4 | 159.6 | -77 | -159.9 | 173.8 | -155.3 | -2.6 | 110.7 | ||||
| 468 | D | 45.1 | Very low | 42.9 | Very low | 159 Ų | 159 | 189.5 Ų | 189.5 | 85% | 0.85 | 88% | 0.878 | S | S | * | * | trans | -78.2 | 169.5 | -163.6 | -58.9 | -102.6 | 0 | 0 | 0 | 115.7 | ||||
| 469 | R | 41 | Very low | 43.5 | Very low | 238 Ų | 238 | 197.5 Ų | 197.5 | 90% | 0.898 | 88% | 0.878 | S | S | * | * | trans | -49.2 | 170 | 155.7 | -94.7 | 175.7 | 165.2 | 177.7 | -5.4 | 113 | ||||
| 470 | P | 57.1 | Low | 43.7 | Very low | 105 Ų | 105 | 192.5 Ų | 192.5 | 68% | 0.682 | 87% | 0.87 | S | S | * | * | cis | -132.4 | 168.6 | -1.9 | 39.7 | -24.6 | 0 | 0 | 0 | 115.2 | ||||
| 471 | Y | 37.8 | Very low | 44.5 | Very low | 297 Ų | 297 | 204.7 Ų | 204.7 | 100% | 1.165 | 89% | 0.894 | S | S | * | * | -152.9 | 0 | 112 | -134.1 | -89.4 | 0 | 0 | 0 | 110 |
Retrieved 471 of 471 residues in 309.8 ms
(Link to these results)