| 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 | 38.6 | Very low | 41.7 | Very low | 252 Ų | 252 | 154.5 Ų | 154.5 | 100% | 1.241 | 84% | 0.843 | S | S | * | * | 0 | 162.5 | 0 | -69.6 | 173.5 | -178 | 0 | 0 | 108.3 | |||||
| 2 | Y | 40.4 | Very low | 42.3 | Very low | 204 Ų | 204 | 152.5 Ų | 152.5 | 80% | 0.8 | 84% | 0.843 | S | S | * | * | trans | -94.3 | 179.1 | -160.1 | -150.7 | -102 | 0 | 0 | 0 | 113.4 | ||||
| 3 | F | 39.3 | Very low | 41.7 | Very low | 186 Ų | 186 | 148.5 Ų | 148.5 | 82% | 0.816 | 83% | 0.833 | S | S | * | * | trans | 74.8 | 133 | 177.2 | -53.8 | -82.1 | 0 | 0 | 0 | 115.5 | ||||
| 4 | G | 40 | Very low | 41.2 | Very low | 64 Ų | 64 | 149.7 Ų | 149.7 | 66% | 0.66 | 84% | 0.835 | S | S | * | * | cis | 112.1 | 122.6 | 5.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 5 | N | 39 | Very low | 40.6 | Very low | 175 Ų | 175 | 146.2 Ų | 146.2 | 94% | 0.936 | 83% | 0.833 | S | S | * | * | trans | -139.6 | 131.3 | 174 | -101.3 | -40.3 | 0 | 0 | 0 | 111 | ||||
| 6 | V | 42.2 | Very low | 40.2 | Very low | 121 Ų | 121 | 151.6 Ų | 151.6 | 73% | 0.733 | 84% | 0.836 | S | S | * | * | trans | -110.9 | 143.2 | -173.7 | 169.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 7 | C | 43.8 | Very low | 40.3 | Very low | 122 Ų | 122 | 148.5 Ų | 148.5 | 82% | 0.824 | 82% | 0.824 | S | S | * | * | trans | -71 | 135.2 | 177.2 | -52.2 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 8 | H | 41.5 | Very low | 39.9 | Very low | 173 Ų | 173 | 147.3 Ų | 147.3 | 80% | 0.801 | 82% | 0.822 | S | S | * | * | trans | -139.9 | 123.1 | 158.4 | -81.6 | -73.8 | 0 | 0 | 0 | 111.5 | ||||
| 9 | S | 41.7 | Very low | 39.6 | Very low | 113 Ų | 113 | 148.2 Ų | 148.2 | 79% | 0.79 | 82% | 0.824 | S | S | * | * | trans | -75.4 | 159.8 | 161.6 | -46.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 10 | P | 49.8 | Very low | 39.2 | Very low | 123 Ų | 123 | 144.5 Ų | 144.5 | 80% | 0.799 | 82% | 0.821 | S | S | * | * | -142.3 | 147 | 125.2 | 33.9 | -19.5 | 0 | 0 | 0 | 115 | |||||
| 11 | L | 42.5 | Very low | 38.9 | Very low | 166 Ų | 166 | 148.9 Ų | 148.9 | 87% | 0.869 | 82% | 0.824 | S | S | * | * | trans | -88.6 | 161.5 | 149.8 | -71.8 | 169.6 | 0 | 0 | 0 | 108.5 | ||||
| 12 | P | 48.7 | Very low | 38.7 | Very low | 131 Ų | 131 | 143.4 Ų | 143.4 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | -143.7 | 179.5 | 108.6 | 34.9 | -18.6 | 0 | 0 | 0 | 115.3 | |||||
| 13 | S | 34.3 | Very low | 38.6 | Very low | 101 Ų | 101 | 141.4 Ų | 141.4 | 71% | 0.706 | 80% | 0.803 | S | S | * | * | trans | -117.1 | 154 | -175.9 | 170.4 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 14 | L | 34.6 | Very low | 39 | Very low | 165 Ų | 165 | 138.4 Ų | 138.4 | 86% | 0.864 | 80% | 0.802 | S | S | * | * | 163.3 | 147.6 | 126.8 | -94.4 | 151.6 | 0 | 0 | 0 | 116.5 | |||||
| 15 | A | 33.1 | Very low | 38.9 | Very low | 97 Ų | 97 | 140.1 Ų | 140.1 | 80% | 0.802 | 80% | 0.804 | S | S | * | * | trans | 82.7 | 138.1 | 141 | 0 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 16 | R | 33.3 | Very low | 39.6 | Very low | 233 Ų | 233 | 137.4 Ų | 137.4 | 88% | 0.879 | 80% | 0.796 | S | S | * | * | trans | -96.1 | 171.8 | 166.2 | -161.4 | 170.7 | 172.4 | -149.4 | -2.1 | 106.8 | ||||
| 17 | P | 43 | Very low | 39.5 | Very low | 99 Ų | 99 | 138.2 Ų | 138.2 | 64% | 0.643 | 80% | 0.797 | S | S | * | * | cis | -157.5 | 177.5 | 30.9 | 43.2 | -19.5 | 0 | 0 | 0 | 122 | ||||
| 18 | T | 33.4 | Very low | 40.1 | Very low | 127 Ų | 127 | 136.3 Ų | 136.3 | 78% | 0.779 | 78% | 0.782 | S | S | * | * | trans | 62.4 | 156.6 | 151.5 | 40 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 19 | L | 33.8 | Very low | 39.9 | Very low | 163 Ų | 163 | 137.3 Ų | 137.3 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | cis | -153.1 | 156.8 | -1 | -166.9 | 113.9 | 0 | 0 | 0 | 108.3 | ||||
| 20 | G | 30.2 | Very low | 39.7 | Very low | 75 Ų | 75 | 135.8 Ų | 135.8 | 77% | 0.773 | 78% | 0.778 | S | S | * | * | trans | -177 | 134.5 | 170.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 21 | R | 34.4 | Very low | 39.1 | Very low | 236 Ų | 236 | 137.2 Ų | 137.2 | 89% | 0.891 | 78% | 0.779 | S | S | * | * | trans | -141.1 | 120 | -164.1 | 169.4 | -165.8 | -178.1 | 171.8 | 2.2 | 112 | ||||
| 22 | T | 33.5 | Very low | 38.9 | Very low | 137 Ų | 137 | 137 Ų | 137 | 84% | 0.84 | 78% | 0.777 | S | S | * | * | trans | -151.8 | 138 | 155.9 | -26.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 23 | Q | 39.8 | Very low | 39.1 | Very low | 163 Ų | 163 | 135.1 Ų | 135.1 | 76% | 0.762 | 77% | 0.766 | S | S | * | * | trans | -142 | 151 | 165.5 | -89.2 | -73.1 | -22 | 0 | 0 | 105.7 | ||||
| 24 | P | 46.3 | Very low | 39.4 | Very low | 122 Ų | 122 | 139.2 Ų | 139.2 | 79% | 0.792 | 77% | 0.771 | S | S | * | * | -147.4 | 160.5 | 104 | 35.1 | -17.7 | 0 | 0 | 0 | 116.5 | |||||
| 25 | S | 37.8 | Very low | 39.6 | Very low | 100 Ų | 100 | 141 Ų | 141 | 70% | 0.699 | 77% | 0.774 | S | S | * | * | trans | -106.1 | 161 | 167.3 | -172.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 26 | P | 53.5 | Low | 39.9 | Very low | 118 Ų | 118 | 144.2 Ų | 144.2 | 77% | 0.766 | 78% | 0.777 | S | S | * | * | -146.6 | 139.5 | 91.6 | 26.9 | -4.1 | 0 | 0 | 0 | 115.5 | |||||
| 27 | D | 40.7 | Very low | 40.2 | Very low | 139 Ų | 139 | 140.8 Ų | 140.8 | 74% | 0.743 | 78% | 0.775 | S | S | * | * | 86.2 | 169 | 91.4 | -152.5 | 32.8 | 0 | 0 | 0 | 113.3 | |||||
| 28 | P | 56.1 | Low | 40.4 | Very low | 81 Ų | 81 | 142.1 Ų | 142.1 | 53% | 0.526 | 78% | 0.784 | S | S | . | * | cis | -132.6 | 168.1 | -23.7 | 10.9 | 15.5 | 0 | 0 | 0 | 118.4 | ||||
| 29 | K | 37.9 | Very low | 40.3 | Very low | 195 Ų | 195 | 139.2 Ų | 139.2 | 85% | 0.848 | 78% | 0.779 | S | S | * | * | trans | 69.9 | 158 | 144.8 | -68 | 157 | -167 | 167.2 | 0 | 122.5 | ||||
| 30 | A | 36.4 | Very low | 40.4 | Very low | 80 Ų | 80 | 141.7 Ų | 141.7 | 66% | 0.661 | 78% | 0.783 | S | S | * | * | cis | -179.7 | 166 | -37.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 31 | L | 37.1 | Very low | 40.8 | Very low | 153 Ų | 153 | 144 Ų | 144 | 80% | 0.801 | 78% | 0.783 | S | S | * | * | trans | 91 | 96.1 | 154.2 | -52.1 | -176.5 | 0 | 0 | 0 | 123.3 | ||||
| 32 | L | 38.1 | Very low | 41 | Very low | 161 Ų | 161 | 138.6 Ų | 138.6 | 84% | 0.843 | 77% | 0.772 | S | S | * | * | 67.2 | 162.4 | 111.6 | -68.7 | -164.1 | 0 | 0 | 0 | 123.8 | |||||
| 33 | P | 54.3 | Low | 41.4 | Very low | 93 Ų | 93 | 139.1 Ų | 139.1 | 60% | 0.604 | 77% | 0.766 | S | S | * | * | trans | -133.3 | -164.2 | -145.7 | 42.9 | -23.5 | 0 | 0 | 0 | 117.1 | ||||
| 34 | F | 39.4 | Very low | 41.5 | Very low | 186 Ų | 186 | 137.1 Ų | 137.1 | 82% | 0.816 | 76% | 0.761 | S | S | * | * | trans | 82.9 | 135.3 | 174.8 | -55.9 | -74.7 | 0 | 0 | 0 | 117.6 | ||||
| 35 | H | 38.8 | Very low | 41.5 | Very low | 202 Ų | 202 | 138.8 Ų | 138.8 | 94% | 0.935 | 76% | 0.758 | S | S | * | * | trans | -167.9 | 160.9 | 135.1 | -93.6 | -59.7 | 0 | 0 | 0 | 110.9 | ||||
| 36 | L | 39.2 | Very low | 41.4 | Very low | 166 Ų | 166 | 140.5 Ų | 140.5 | 87% | 0.869 | 76% | 0.759 | S | S | * | * | trans | -106.4 | 162.6 | -166.1 | -70.4 | 150.4 | 0 | 0 | 0 | 113 | ||||
| 37 | L | 39.9 | Very low | 41.1 | Very low | 160 Ų | 160 | 144.2 Ų | 144.2 | 84% | 0.838 | 77% | 0.765 | S | S | * | * | trans | -51.4 | 162.5 | 165 | -79 | 111.5 | 0 | 0 | 0 | 112.8 | ||||
| 38 | P | 47.9 | Very low | 41.2 | Very low | 128 Ų | 128 | 146.7 Ų | 146.7 | 83% | 0.831 | 77% | 0.769 | S | S | * | * | cis | -156.8 | -179.1 | 47.2 | 43.6 | -21.9 | 0 | 0 | 0 | 119.9 | ||||
| 39 | G | 30.4 | Very low | 40.4 | Very low | 65 Ų | 65 | 147.1 Ų | 147.1 | 67% | 0.67 | 78% | 0.78 | S | S | * | * | trans | 125.5 | 105 | 136.7 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 40 | F | 36.4 | Very low | 40.9 | Very low | 215 Ų | 215 | 145.4 Ų | 145.4 | 94% | 0.943 | 78% | 0.779 | S | S | * | * | trans | -150.5 | 103.8 | 141.2 | -133.1 | -88.1 | 0 | 0 | 0 | 110.6 | ||||
| 41 | T | 39.2 | Very low | 41.3 | Very low | 125 Ų | 125 | 149.3 Ų | 149.3 | 77% | 0.767 | 79% | 0.787 | S | S | * | * | trans | -78.9 | 162.7 | 161.4 | 45.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 42 | D | 39.1 | Very low | 41.2 | Very low | 121 Ų | 121 | 147.8 Ų | 147.8 | 65% | 0.647 | 79% | 0.789 | S | S | * | * | cis | -169 | 157.4 | -1.4 | 152 | 51.3 | 0 | 0 | 0 | 105.4 | D44 | D42-D44 PolarHBondContact OD1-N 3.4Š| ||
| 43 | M | 41.7 | Very low | 41.6 | Very low | 148 Ų | 148 | 146.2 Ų | 146.2 | 73% | 0.729 | 79% | 0.788 | S | S | * | * | trans | 178.5 | 94.2 | 136.6 | -94.5 | -83.6 | 75.2 | 0 | 0 | 110.7 | ||||
| 44 | D | 41.3 | Very low | 40.7 | Very low | 122 Ų | 122 | 147.7 Ų | 147.7 | 65% | 0.652 | 80% | 0.8 | S | S | * | * | trans | -74 | 155.1 | 161.3 | -128.3 | -65.1 | 0 | 0 | 0 | 111.1 | D42 | D42-D44 PolarHBondContact OD1-N 3.4Š| ||
| 45 | H | 47.2 | Very low | 41.2 | Very low | 157 Ų | 157 | 148.7 Ų | 148.7 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | 170.8 | 112.3 | 126.9 | -85.6 | -46.4 | 0 | 0 | 0 | 113.2 | |||||
| 46 | L | 34.9 | Very low | 41 | Very low | 136 Ų | 136 | 142 Ų | 142 | 71% | 0.712 | 79% | 0.79 | S | S | * | * | trans | 51.2 | 110.8 | 154.3 | -72.8 | 103.7 | 0 | 0 | 0 | 119.6 | ||||
| 47 | H | 46.2 | Very low | 41.3 | Very low | 195 Ų | 195 | 142.5 Ų | 142.5 | 90% | 0.903 | 79% | 0.793 | S | S | * | * | -147.1 | 143.2 | 103.3 | -101.1 | -177.7 | 0 | 0 | 0 | 112.1 | |||||
| 48 | K | 43.3 | Very low | 41.1 | Very low | 192 Ų | 192 | 141.2 Ų | 141.2 | 84% | 0.835 | 79% | 0.791 | S | S | * | * | trans | -105.1 | 98.1 | -164.3 | -177.1 | -179.9 | 178.2 | -176.7 | 0 | 111.3 | ||||
| 49 | A | 40.4 | Very low | 41 | Very low | 90 Ų | 90 | 139.7 Ų | 139.7 | 74% | 0.744 | 78% | 0.784 | S | S | * | * | trans | -149.3 | 92.3 | 164 | 0 | 0 | 0 | 0 | 0 | 107.6 | I51 | A49-I51 PolarHBondContact O-N 3.47Š| ||
| 50 | L | 47.4 | Very low | 41.4 | Very low | 159 Ų | 159 | 142 Ų | 142 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | 60.7 | 42.3 | 70.4 | -140.2 | 156.4 | 0 | 0 | 0 | 113.3 | |||||
| 51 | I | 44.6 | Very low | 42 | Very low | 162 Ų | 162 | 139 Ų | 139 | 83% | 0.831 | 78% | 0.78 | S | S | * | * | trans | -133 | 126.5 | 147.9 | -54.7 | -178 | 0 | 0 | 0 | 107.5 | A49 | A49-I51 PolarHBondContact O-N 3.47Š| ||
| 52 | S | 35.3 | Very low | 42.3 | Very low | 120 Ų | 120 | 140.2 Ų | 140.2 | 84% | 0.839 | 78% | 0.775 | S | S | * | * | trans | -71 | 140.3 | -164.6 | -48.8 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 53 | P | 47.3 | Very low | 43.1 | Very low | 128 Ų | 128 | 145.5 Ų | 145.5 | 83% | 0.831 | 79% | 0.786 | S | S | * | * | trans | -103.7 | 113.7 | 166.1 | 34.6 | -25.9 | 0 | 0 | 0 | 111.8 | ||||
| 54 | C | 34.7 | Very low | 44.2 | Very low | 125 Ų | 125 | 143.5 Ų | 143.5 | 85% | 0.845 | 77% | 0.773 | S | S | * | * | trans | -151.7 | 127.4 | 155.9 | -157.1 | 0 | 0 | 0 | 0 | 111.6 | G56 | C54-G56 PolarHBondContact O-N 3.32Š| ||
| 55 | F | 49.8 | Very low | 45.1 | Very low | 206 Ų | 206 | 142.1 Ų | 142.1 | 90% | 0.904 | 77% | 0.771 | S | S | * | * | trans | -71.4 | 91.2 | 177.5 | -82.1 | -109.5 | 0 | 0 | 0 | 110.7 | ||||
| 56 | G | 34.9 | Very low | 46.7 | Very low | 62 Ų | 62 | 136.6 Ų | 136.6 | 64% | 0.639 | 76% | 0.756 | S | S | * | * | trans | -79.2 | 123.2 | 161.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | C54 T58 | C54-G56 PolarHBondContact O-N 3.32Å; G56-T58 VanDerWaalsContact C-N 3.28Å; G56-T58 PolarHBondContact O-N 3.01Å | ||
| 57 | L | 45.9 | Very low | 49.4 | Very low | 177 Ų | 177 | 132.9 Ų | 132.9 | 93% | 0.927 | 74% | 0.741 | S | S | * | * | trans | -66.2 | 85.8 | 171.1 | -78.2 | 93.1 | 0 | 0 | 0 | 110.5 | S59 | L57-S59 VanDerWaalsContact C-N 3.27Å; L57-S59 PolarHBondContact O-N 3.19Å | ||
| 58 | T | 35.9 | Very low | 51.7 | Low | 132 Ų | 132 | 123.7 Ų | 123.7 | 81% | 0.81 | 70% | 0.699 | S | S | * | * | trans | -73.5 | 88.1 | 164.8 | 57.5 | 0 | 0 | 0 | 0 | 108.6 | G56 | G56-T58 VanDerWaalsContact C-N 3.28Å; G56-T58 PolarHBondContact O-N 3.01Å | ||
| 59 | S | 44.9 | Very low | 54 | Low | 97 Ų | 97 | 119.5 Ų | 119.5 | 68% | 0.678 | 69% | 0.694 | S | S | * | * | trans | -47 | 122.2 | 166.2 | -177.8 | 0 | 0 | 0 | 0 | 109 | L57 L61 | L57-S59 VanDerWaalsContact C-N 3.27Å; L57-S59 PolarHBondContact O-N 3.19Å; S59-L61 PolarHBondContact O-N 3.32Å | ||
| 60 | P | 39.6 | Very low | 56.5 | Low | 112 Ų | 112 | 117 Ų | 117 | 73% | 0.727 | 67% | 0.669 | S | S | * | * | trans | -64.6 | 116.8 | 178.7 | 25.9 | -32.1 | 0 | 0 | 0 | 107.6 | K62 | P60-K62 PolarHBondContact O-N 3.33Š| ||
| 61 | L | 48.9 | Very low | 58.7 | Low | 153 Ų | 153 | 110.2 Ų | 110.2 | 80% | 0.801 | 64% | 0.635 | S | S | * | * | trans | -47.8 | 116 | 174.9 | -85.5 | 80 | 0 | 0 | 0 | 107.7 | S59 R63 | S59-L61 PolarHBondContact O-N 3.32Å; L61-R63 PolarHBondContact O-N 3.45Å | ||
| 62 | K | 45.8 | Very low | 61 | Low | 151 Ų | 151 | 113.5 Ų | 113.5 | 66% | 0.657 | 64% | 0.637 | S | S | * | * | trans | -68.7 | 72.3 | -169.6 | -160.1 | -166.9 | -170.1 | -166.1 | 0 | 110.7 | P60 K64 E78 | P60-K62 PolarHBondContact O-N 3.33Å; K62-K64 HydrophobicContact CD-CG 4.09Å; K62-K64 HydrophobicContact CG-CG 4.11Å; K62-K64 PolarHBondContact O-N 3.45Å; K62-E78 IonicContact NZ-OE1 2.78Å; K62-E78 PolarHBondContact NZ-OE1 2.8Å | ||
| 63 | R | 55.8 | Low | 63.7 | Low | 232 Ų | 232 | 110.6 Ų | 110.6 | 88% | 0.875 | 61% | 0.614 | S | S | * | * | trans | -67.2 | 80 | 162.6 | -69.1 | -165.4 | -175 | 123.3 | -1 | 106.7 | L61 | L61-R63 PolarHBondContact O-N 3.45Š| ||
| 64 | K | 64.3 | Low | 65.9 | Low | 106 Ų | 106 | 114.8 Ų | 114.8 | 46% | 0.461 | 61% | 0.613 | S | S | . | * | trans | -48.3 | 135.4 | 173.9 | -59.1 | -178.9 | -172.7 | -176.2 | 0 | 107.5 | K62 G66 E78 | K62-K64 HydrophobicContact CD-CG 4.09Å; K62-K64 HydrophobicContact CG-CG 4.11Å; K62-K64 PolarHBondContact O-N 3.45Å; K64-G66 VanDerWaalsContact C-N 3.29Å; K64-G66 PolarHBondContact O-N 3.18Å; K64-E78 HydrophobicContact CD-CB 4.3Å; K64-E78 HydrophobicContact CD-CG 4.36Å; K64-E78 VanDerWaalsContact CE-OE2 3.28Å; K64-E78 WeakPolarHBondContact CE-OE2 3.47Å; K64-E78 IonicContact NZ-OE2 2.78Å; K64-E78 PolarHBondContact NZ-OE2 3.36Å | ||
| 65 | P | 59.3 | Low | 68.8 | Low | 93 Ų | 93 | 110 Ų | 110 | 60% | 0.604 | 58% | 0.578 | S | S | * | * | trans | -58 | 92.1 | 173.8 | -27 | 36.1 | 0 | 0 | 0 | 111 | S67 | P65-S67 PolarHBondContact O-N 2.98Å; P65-S67 VanDerWaalsContact O-N 3.07Å | ||
| 66 | G | 81.7 | Confident | 70.7 | Confident | 41 Ų | 41 | 107.8 Ų | 107.8 | 42% | 0.423 | 58% | 0.576 | S | S | . | * | trans | -72.7 | 8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113 | K64 R74 F75 | K64-G66 VanDerWaalsContact C-N 3.29Å; K64-G66 PolarHBondContact O-N 3.18Å; G66-R74 CarbonylContact O-C 3.58Å; G66-R74 VanDerWaalsContact O-CA 3.24Å; G66-R74 WeakPolarHBondContact O-CA 3.42Å; G66-F75 PolarHBondContact O-N 3.46Å | ||
| 67 | S | 92 | Very high | 73.4 | Confident | 57 Ų | 57 | 107.7 Ų | 107.7 | 40% | 0.399 | 57% | 0.565 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -157.5 | 145.7 | 172.2 | 60.7 | 0 | 0 | 0 | 0 | 113.4 | P65 V73 Y85 | P65-S67 PolarHBondContact O-N 2.98Å; P65-S67 VanDerWaalsContact O-N 3.07Å; S67-V73 CarbonylContact C-O 3.59Å; S67-V73 WeakPolarHBondContact CA-O 3.41Å; S67-V73 VanDerWaalsContact CB-O 3.3Å; S67-V73 WeakPolarHBondContact CB-O 3.44Å; S67-Y85 PolarHBondContact O-OH 3.24Å |
| 68 | C | 94.5 | Very high | 75.7 | Confident | 2 Ų | 2 | 103.7 Ų | 103.7 | 1% | 0.014 | 54% | 0.542 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.6 | 119.2 | 167.8 | 171 | 0 | 0 | 0 | 0 | 110 | C71 R72 V73 F75 H84 Y85 H90 | C68-C71 HydrophobicContact CB-CB 4.35Å; C68-C71 PolarHBondContact SG-N 3.19Å; C68-C71 VanDerWaalsContact SG-N 3.37Å; C68-R72 WeakPolarHBondContact O-CA 3.35Å; C68-R72 PolarHBondContact O-N 3.01Å; C68-V73 PolarHBondContact N-O 2.78Å; C68-V73 PolarHBondContact O-N 3.31Å; C68-F75 HydrophobicContact CB-CE2 3.74Å; C68-F75 HydrophobicContact CB-CZ 3.68Å; C68-H84 PolarHBondContact SG-NE2 3.42Å; C68-H84 VanDerWaalsContact SG-NE2 3.38Å; C68-Y85 HydrophobicContact CB-CE1 3.94Å; C68-H90 PolarHBondContact SG-CE1 2.98Å; C68-H90 PolarHBondContact SG-ND1 3.3Å; C68-H90 VanDerWaalsContact SG-ND1 3.42Å |
| 69 | S | 91.3 | Very high | 78.4 | Confident | 104 Ų | 104 | 100.7 Ų | 100.7 | 73% | 0.727 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.5 | -47.3 | 178.7 | 48.7 | 0 | 0 | 0 | 0 | 112.4 | C71 R72 | S69-C71 VanDerWaalsContact C-N 3.27Å; S69-C71 PolarHBondContact O-N 3.38Å; S69-R72 PolarHBondContact O-N 3.32Å |
| 70 | V | 93.2 | Very high | 80.7 | Confident | 39 Ų | 39 | 100.4 Ų | 100.4 | 24% | 0.236 | 52% | 0.518 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.9 | -34.8 | 179.5 | 169.4 | 0 | 0 | 0 | 0 | 113 | R93 L94 L97 | V70-R93 HydrophobicContact CG1-CB 3.83Å; V70-L94 HydrophobicContact CG1-CD2 4.36Å; V70-L94 HydrophobicContact CG1-CG 4.45Å; V70-L94 HydrophobicContact CG2-CD2 3.81Å; V70-L97 HydrophobicContact CB-CD1 4.31Å; V70-L97 HydrophobicContact CG1-CD1 3.83Å; V70-L97 HydrophobicContact CG2-CD1 4.16Å |
| 71 | C | 92.9 | Very high | 83.3 | Confident | 15 Ų | 15 | 95.7 Ų | 95.7 | 10% | 0.101 | 49% | 0.488 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.6 | -8.8 | -178.9 | -64 | 0 | 0 | 0 | 0 | 114.1 | C68 S69 V73 H84 H90 | C68-C71 HydrophobicContact CB-CB 4.35Å; C68-C71 PolarHBondContact SG-N 3.19Å; C68-C71 VanDerWaalsContact SG-N 3.37Å; S69-C71 VanDerWaalsContact C-N 3.27Å; S69-C71 PolarHBondContact O-N 3.38Å; C71-V73 HydrophobicContact CB-CB 4.44Å; C71-V73 HydrophobicContact CB-CG2 3.86Å; C71-V73 PolarHBondContact O-N 2.78Å; C71-H84 WeakPolarHBondContact CB-NE2 3.27Å; C71-H84 PolarHBondContact SG-NE2 2.67Å; C71-H90 PolarHBondContact SG-ND1 2.95Å; C71-H90 VanDerWaalsContact SG-ND1 3.44Å |
| 72 | R | 92.4 | Very high | 85.4 | Confident | 231 Ų | 231 | 91.8 Ų | 91.8 | 87% | 0.872 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.7 | 26.3 | -169 | -58.1 | -174.3 | -179.1 | -175.2 | 0.6 | 114.5 | C68 S69 | C68-R72 WeakPolarHBondContact O-CA 3.35Å; C68-R72 PolarHBondContact O-N 3.01Å; S69-R72 PolarHBondContact O-N 3.32Å |
| 73 | V | 93.1 | Very high | 87.8 | Confident | 60 Ų | 60 | 87.9 Ų | 87.9 | 36% | 0.364 | 47% | 0.466 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 130.2 | 178.2 | 178 | 0 | 0 | 0 | 0 | 109.3 | S67 C68 C71 F75 | S67-V73 CarbonylContact C-O 3.59Å; S67-V73 WeakPolarHBondContact CA-O 3.41Å; S67-V73 VanDerWaalsContact CB-O 3.3Å; S67-V73 WeakPolarHBondContact CB-O 3.44Å; C68-V73 PolarHBondContact N-O 2.78Å; C68-V73 PolarHBondContact O-N 3.31Å; C71-V73 HydrophobicContact CB-CB 4.44Å; C71-V73 HydrophobicContact CB-CG2 3.86Å; C71-V73 PolarHBondContact O-N 2.78Å; V73-F75 HydrophobicContact CB-CE1 4.15Å; V73-F75 HydrophobicContact CB-CZ 4.27Å; V73-F75 HydrophobicContact CG1-CD1 4.07Å; V73-F75 HydrophobicContact CG1-CE1 3.51Å; V73-F75 HydrophobicContact CG1-CZ 4.14Å |
| 74 | R | 93.8 | Very high | 89.7 | Confident | 215 Ų | 215 | 78.6 Ų | 78.6 | 81% | 0.811 | 43% | 0.432 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90.2 | 145.9 | 169.6 | -62.8 | -169.1 | 174 | 157.4 | 0.7 | 110.9 | G66 | G66-R74 CarbonylContact O-C 3.58Å; G66-R74 VanDerWaalsContact O-CA 3.24Å; G66-R74 WeakPolarHBondContact O-CA 3.42Å |
| 75 | F | 95.5 | Very high | 91.2 | Very high | 24 Ų | 24 | 78 Ų | 78 | 11% | 0.105 | 43% | 0.428 | C | S | . | . | trans | -115.8 | 137.8 | -179.9 | -52.2 | -58 | 0 | 0 | 0 | 111.1 | G66 C68 V73 Q80 A81 H84 Y85 | G66-F75 PolarHBondContact O-N 3.46Å; C68-F75 HydrophobicContact CB-CE2 3.74Å; C68-F75 HydrophobicContact CB-CZ 3.68Å; V73-F75 HydrophobicContact CB-CE1 4.15Å; V73-F75 HydrophobicContact CB-CZ 4.27Å; V73-F75 HydrophobicContact CG1-CD1 4.07Å; V73-F75 HydrophobicContact CG1-CE1 3.51Å; V73-F75 HydrophobicContact CG1-CZ 4.14Å; F75-Q80 VanDerWaalsContact CA-OE1 3.31Å; F75-Q80 HydrophobicContact CB-CB 4.45Å; F75-Q80 HydrophobicContact CD1-CB 4.43Å; F75-Q80 HydrophobicContact CD1-CG 3.98Å; F75-A81 HydrophobicContact CB-CB 4.11Å; F75-A81 HydrophobicContact CD2-CB 3.48Å; F75-A81 VanDerWaalsContact CD2-CB 3.48Å; F75-A81 HydrophobicContact CE2-CB 4.05Å; F75-A81 HydrophobicContact CG-CB 3.81Å; F75-H84 HydrophobicContact CE1-CB 3.48Å; F75-H84 VanDerWaalsContact CE1-CB 3.48Å; F75-H84 AromaticContact CE1-CG 3.6Å; F75-H84 AromaticContact CE1-ND1 3.85Å; F75-H84 HydrophobicContact CZ-CB 3.5Å; F75-H84 VanDerWaalsContact CZ-CB 3.5Å; F75-H84 AromaticContact CZ-CD2 3.56Å; F75-H84 AromaticContact CZ-CG 3.36Å; F75-H84 AromaticContact CZ-ND1 3.87Å; F75-Y85 HydrophobicContact CE2-CE2 4.12Å | ||
| 76 | N | 89.8 | Confident | 93 | Very high | 160 Ų | 160 | 78.5 Ų | 78.5 | 86% | 0.856 | 43% | 0.433 | S | S | * | . | S | Bend | trans | -87.2 | -22.6 | 175 | -170.4 | -95.6 | 0 | 0 | 0 | 112.2 | ||
| 77 | S | 91.7 | Very high | 93.6 | Very high | 60 Ų | 60 | 77.6 Ų | 77.6 | 42% | 0.42 | 42% | 0.424 | S | S | . | . | S | Bend | trans | -142.4 | 158.9 | -178.9 | 74.3 | 0 | 0 | 0 | 0 | 113.3 | A79 Q80 A81 | S77-A79 VanDerWaalsContact C-N 3.3Å; S77-A79 PolarHBondContact O-N 3.09Å; S77-Q80 WeakPolarHBondContact O-CB 3.12Å; S77-Q80 PolarHBondContact O-N 3.33Å; S77-Q80 PolarHBondContact OG-N 3.18Å; S77-A81 PolarHBondContact O-N 2.82Å; S77-A81 VanDerWaalsContact O-N 3.08Å |
| 78 | E | 92.4 | Very high | 93.8 | Very high | 94 Ų | 94 | 80.1 Ų | 80.1 | 44% | 0.439 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -64.7 | -32.9 | 178.9 | -168.1 | 161.8 | -148.2 | 0 | 0 | 112.2 | K62 K64 A81 S82 | K62-E78 IonicContact NZ-OE1 2.78Å; K62-E78 PolarHBondContact NZ-OE1 2.8Å; K64-E78 HydrophobicContact CD-CB 4.3Å; K64-E78 HydrophobicContact CD-CG 4.36Å; K64-E78 VanDerWaalsContact CE-OE2 3.28Å; K64-E78 WeakPolarHBondContact CE-OE2 3.47Å; K64-E78 IonicContact NZ-OE2 2.78Å; K64-E78 PolarHBondContact NZ-OE2 3.36Å; E78-A81 PolarHBondContact O-N 2.74Å; E78-S82 PolarHBondContact O-N 3.27Å; E78-S82 PolarHBondContact O-OG 3.42Å |
| 79 | A | 93.4 | Very high | 93.7 | Very high | 68 Ų | 68 | 86.6 Ų | 86.6 | 56% | 0.562 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -68.9 | -32.1 | 174 | 0 | 0 | 0 | 0 | 0 | 113.1 | S77 S82 S83 | S77-A79 VanDerWaalsContact C-N 3.3Å; S77-A79 PolarHBondContact O-N 3.09Å; A79-S82 WeakPolarHBondContact CA-OG 2.91Å; A79-S82 PolarHBondContact O-OG 3.1Å; A79-S83 WeakPolarHBondContact O-CB 3.42Å; A79-S83 PolarHBondContact O-N 2.9Å; A79-S83 PolarHBondContact O-OG 3.03Å |
| 80 | Q | 92.9 | Very high | 93.9 | Very high | 92 Ų | 92 | 82.1 Ų | 82.1 | 43% | 0.43 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -73.3 | -34.9 | 173.9 | -166.1 | -177.9 | 49.5 | 0 | 0 | 111.4 | F75 S77 S83 H84 | F75-Q80 VanDerWaalsContact CA-OE1 3.31Å; F75-Q80 HydrophobicContact CB-CB 4.45Å; F75-Q80 HydrophobicContact CD1-CB 4.43Å; F75-Q80 HydrophobicContact CD1-CG 3.98Å; S77-Q80 WeakPolarHBondContact O-CB 3.12Å; S77-Q80 PolarHBondContact O-N 3.33Å; S77-Q80 PolarHBondContact OG-N 3.18Å; Q80-S83 PolarHBondContact O-OG 3.28Å; Q80-H84 WeakPolarHBondContact O-CB 3.15Å; Q80-H84 PolarHBondContact O-N 2.78Å |
| 81 | A | 95.1 | Very high | 94 | Very high | 12 Ų | 12 | 82.3 Ų | 82.3 | 10% | 0.099 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -66.3 | -51.2 | 173 | 0 | 0 | 0 | 0 | 0 | 111.4 | F75 S77 E78 S83 H84 Y85 | F75-A81 HydrophobicContact CB-CB 4.11Å; F75-A81 HydrophobicContact CD2-CB 3.48Å; F75-A81 VanDerWaalsContact CD2-CB 3.48Å; F75-A81 HydrophobicContact CE2-CB 4.05Å; F75-A81 HydrophobicContact CG-CB 3.81Å; S77-A81 PolarHBondContact O-N 2.82Å; S77-A81 VanDerWaalsContact O-N 3.08Å; E78-A81 PolarHBondContact O-N 2.74Å; A81-S83 PolarHBondContact O-N 2.84Å; A81-H84 WeakPolarHBondContact O-CB 3.49Å; A81-H84 PolarHBondContact O-N 3.33Å; A81-H84 VanDerWaalsContact O-N 3.14Å; A81-Y85 HydrophobicContact CB-CD2 4.36Å; A81-Y85 HydrophobicContact CB-CE2 4.06Å; A81-Y85 WeakPolarHBondContact O-CD2 3.42Å; A81-Y85 PolarHBondContact O-N 3.27Å |
| 82 | S | 93.2 | Very high | 94.1 | Very high | 71 Ų | 71 | 89.3 Ų | 89.3 | 50% | 0.497 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -60.6 | -46.7 | -178.3 | 61.6 | 0 | 0 | 0 | 0 | 112.6 | E78 A79 H84 Y85 S86 | E78-S82 PolarHBondContact O-N 3.27Å; E78-S82 PolarHBondContact O-OG 3.42Å; A79-S82 WeakPolarHBondContact CA-OG 2.91Å; A79-S82 PolarHBondContact O-OG 3.1Å; S82-H84 VanDerWaalsContact C-N 3.26Å; S82-H84 PolarHBondContact O-N 3.47Å; S82-Y85 PolarHBondContact O-N 3.28Å; S82-S86 PolarHBondContact O-N 3.27Å; S82-S86 PolarHBondContact O-OG 3.09Å |
| 83 | S | 95.6 | Very high | 94.1 | Very high | 69 Ų | 69 | 84.7 Ų | 84.7 | 48% | 0.483 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.1 | -27.2 | 176.3 | 54.9 | 0 | 0 | 0 | 0 | 113.8 | A79 Q80 A81 G87 | A79-S83 WeakPolarHBondContact O-CB 3.42Å; A79-S83 PolarHBondContact O-N 2.9Å; A79-S83 PolarHBondContact O-OG 3.03Å; Q80-S83 PolarHBondContact O-OG 3.28Å; A81-S83 PolarHBondContact O-N 2.84Å; S83-G87 PolarHBondContact O-N 2.88Å |
| 84 | H | 96.3 | Very high | 94.1 | Very high | 38 Ų | 38 | 85.6 Ų | 85.6 | 18% | 0.176 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -71.4 | -48.9 | 169.8 | -179.2 | 97.5 | 0 | 0 | 0 | 111.8 | C68 C71 F75 Q80 A81 S82 S86 G87 H90 | C68-H84 PolarHBondContact SG-NE2 3.42Å; C68-H84 VanDerWaalsContact SG-NE2 3.38Å; C71-H84 WeakPolarHBondContact CB-NE2 3.27Å; C71-H84 PolarHBondContact SG-NE2 2.67Å; F75-H84 HydrophobicContact CE1-CB 3.48Å; F75-H84 VanDerWaalsContact CE1-CB 3.48Å; F75-H84 AromaticContact CE1-CG 3.6Å; F75-H84 AromaticContact CE1-ND1 3.85Å; F75-H84 HydrophobicContact CZ-CB 3.5Å; F75-H84 VanDerWaalsContact CZ-CB 3.5Å; F75-H84 AromaticContact CZ-CD2 3.56Å; F75-H84 AromaticContact CZ-CG 3.36Å; F75-H84 AromaticContact CZ-ND1 3.87Å; Q80-H84 WeakPolarHBondContact O-CB 3.15Å; Q80-H84 PolarHBondContact O-N 2.78Å; A81-H84 WeakPolarHBondContact O-CB 3.49Å; A81-H84 PolarHBondContact O-N 3.33Å; A81-H84 VanDerWaalsContact O-N 3.14Å; S82-H84 VanDerWaalsContact C-N 3.26Å; S82-H84 PolarHBondContact O-N 3.47Å; H84-S86 VanDerWaalsContact C-N 3.33Å; H84-S86 PolarHBondContact O-N 3.26Å; H84-G87 PolarHBondContact O-N 3.21Å; H84-H90 AromaticContact CD2-CG 3.86Å; H84-H90 AromaticContact CD2-ND1 3.81Å; H84-H90 AromaticContact NE2-CG 3.82Å; H84-H90 AromaticContact NE2-ND1 3.44Å; H84-H90 PolarHBondContact NE2-ND1 3.45Å; H84-H90 WeakPolarHBondContact O-CB 3.38Å |
| 85 | Y | 96 | Very high | 94 | Very high | 94 Ų | 94 | 83.3 Ų | 83.3 | 37% | 0.369 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.6 | -35.7 | -177.6 | -69.2 | -60.3 | 0 | 0 | 0 | 112.5 | S67 C68 F75 A81 S82 G87 H90 | S67-Y85 PolarHBondContact O-OH 3.24Å; C68-Y85 HydrophobicContact CB-CE1 3.94Å; F75-Y85 HydrophobicContact CE2-CE2 4.12Å; A81-Y85 HydrophobicContact CB-CD2 4.36Å; A81-Y85 HydrophobicContact CB-CE2 4.06Å; A81-Y85 WeakPolarHBondContact O-CD2 3.42Å; A81-Y85 PolarHBondContact O-N 3.27Å; S82-Y85 PolarHBondContact O-N 3.28Å; Y85-G87 PolarHBondContact O-N 3.48Å; Y85-H90 AromaticContact CD1-CD2 3.93Å; Y85-H90 AromaticContact CD1-CE1 3.99Å; Y85-H90 AromaticContact CD1-NE2 3.5Å; Y85-H90 WeakPolarHBondContact CD1-NE2 3.41Å; Y85-H90 PolarHBondContact O-CD2 3.28Å |
| 86 | S | 95.3 | Very high | 93.7 | Very high | 102 Ų | 102 | 85.7 Ų | 85.7 | 71% | 0.713 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.3 | -1.1 | 171.8 | 69.3 | 0 | 0 | 0 | 0 | 114 | S82 H84 | S82-S86 PolarHBondContact O-N 3.27Å; S82-S86 PolarHBondContact O-OG 3.09Å; H84-S86 VanDerWaalsContact C-N 3.33Å; H84-S86 PolarHBondContact O-N 3.26Å |
| 87 | G | 95.7 | Very high | 93.5 | Very high | 23 Ų | 23 | 83.7 Ų | 83.7 | 24% | 0.237 | 46% | 0.457 | C | S | . | . | S | Bend | trans | -81.1 | 137.6 | -173.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | S83 H84 Y85 R89 H90 A91 | S83-G87 PolarHBondContact O-N 2.88Å; H84-G87 PolarHBondContact O-N 3.21Å; Y85-G87 PolarHBondContact O-N 3.48Å; G87-R89 PolarHBondContact O-N 3.22Å; G87-R89 VanDerWaalsContact O-N 3.1Å; G87-H90 WeakPolarHBondContact O-CB 3.33Å; G87-H90 PolarHBondContact O-N 3.38Å; G87-A91 PolarHBondContact O-N 3.13Å |
| 88 | T | 95.2 | Very high | 92.8 | Very high | 110 Ų | 110 | 87.7 Ų | 87.7 | 68% | 0.675 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -55.5 | -31.4 | 178.6 | 57.7 | 0 | 0 | 0 | 0 | 113.6 | K92 | T88-K92 WeakPolarHBondContact O-CB 3.35Å; T88-K92 WeakPolarHBondContact O-CG 3.39Å; T88-K92 PolarHBondContact O-N 3.29Å |
| 89 | R | 93.1 | Very high | 91.9 | Very high | 138 Ų | 138 | 86.2 Ų | 86.2 | 52% | 0.521 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -66 | -37.8 | 174.5 | -68.3 | -176.8 | 174.6 | -166.1 | -4.1 | 112.9 | G87 R93 Q125 | G87-R89 PolarHBondContact O-N 3.22Å; G87-R89 VanDerWaalsContact O-N 3.1Å; R89-R93 PolarHBondContact O-N 3.03Å; R89-Q125 VanDerWaalsContact NH1-CD 3.33Å |
| 90 | H | 95.8 | Very high | 90.4 | Very high | 10 Ų | 10 | 88.4 Ų | 88.4 | 5% | 0.046 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -73.2 | -45.5 | 176.1 | -178.7 | 64.8 | 0 | 0 | 0 | 110.6 | C68 C71 H84 Y85 G87 K92 R93 L94 | C68-H90 PolarHBondContact SG-CE1 2.98Å; C68-H90 PolarHBondContact SG-ND1 3.3Å; C68-H90 VanDerWaalsContact SG-ND1 3.42Å; C71-H90 PolarHBondContact SG-ND1 2.95Å; C71-H90 VanDerWaalsContact SG-ND1 3.44Å; H84-H90 AromaticContact CD2-CG 3.86Å; H84-H90 AromaticContact CD2-ND1 3.81Å; H84-H90 AromaticContact NE2-CG 3.82Å; H84-H90 AromaticContact NE2-ND1 3.44Å; H84-H90 PolarHBondContact NE2-ND1 3.45Å; H84-H90 WeakPolarHBondContact O-CB 3.38Å; Y85-H90 AromaticContact CD1-CD2 3.93Å; Y85-H90 AromaticContact CD1-CE1 3.99Å; Y85-H90 AromaticContact CD1-NE2 3.5Å; Y85-H90 WeakPolarHBondContact CD1-NE2 3.41Å; Y85-H90 PolarHBondContact O-CD2 3.28Å; G87-H90 WeakPolarHBondContact O-CB 3.33Å; G87-H90 PolarHBondContact O-N 3.38Å; H90-K92 VanDerWaalsContact C-N 3.32Å; H90-K92 PolarHBondContact O-N 3.25Å; H90-R93 PolarHBondContact O-N 3.45Å; H90-L94 VanDerWaalsContact NE2-CD1 3.33Å; H90-L94 WeakPolarHBondContact NE2-CD1 3.4Å; H90-L94 PolarHBondContact O-N 3.47Å |
| 91 | A | 94.5 | Very high | 88.4 | Confident | 42 Ų | 42 | 91.5 Ų | 91.5 | 35% | 0.347 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -57.6 | -40.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | G87 L94 K95 | G87-A91 PolarHBondContact O-N 3.13Å; A91-L94 PolarHBondContact O-N 3.22Å; A91-K95 WeakPolarHBondContact O-CG 3.38Å; A91-K95 PolarHBondContact O-N 3.3Å; A91-K95 VanDerWaalsContact O-N 3.16Å |
| 92 | K | 94.8 | Very high | 86.2 | Confident | 162 Ų | 162 | 95.2 Ų | 95.2 | 70% | 0.704 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.5 | -39.5 | 174.1 | -76.6 | -179.9 | 179.6 | -172.6 | 0 | 112.6 | T88 H90 A96 | T88-K92 WeakPolarHBondContact O-CB 3.35Å; T88-K92 WeakPolarHBondContact O-CG 3.39Å; T88-K92 PolarHBondContact O-N 3.29Å; H90-K92 VanDerWaalsContact C-N 3.32Å; H90-K92 PolarHBondContact O-N 3.25Å; K92-A96 PolarHBondContact O-N 3.38Å |
| 93 | R | 92.6 | Very high | 84 | Confident | 135 Ų | 135 | 100.7 Ų | 100.7 | 51% | 0.509 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -72.3 | -37.9 | 176.5 | -80.4 | -173.7 | 170.3 | -176.2 | -3.5 | 113.2 | V70 R89 H90 A96 L97 | V70-R93 HydrophobicContact CG1-CB 3.83Å; R89-R93 PolarHBondContact O-N 3.03Å; H90-R93 PolarHBondContact O-N 3.45Å; R93-A96 PolarHBondContact O-N 3.39Å; R93-L97 WeakPolarHBondContact O-CG 3.48Å; R93-L97 PolarHBondContact O-N 3.25Å |
| 94 | L | 93.1 | Very high | 81.9 | Confident | 78 Ų | 78 | 105.4 Ų | 105.4 | 41% | 0.408 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -56.4 | -52.5 | 173 | -81.5 | 172.5 | 0 | 0 | 0 | 110.9 | V70 H90 A91 A96 L97 D98 | V70-L94 HydrophobicContact CG1-CD2 4.36Å; V70-L94 HydrophobicContact CG1-CG 4.45Å; V70-L94 HydrophobicContact CG2-CD2 3.81Å; H90-L94 VanDerWaalsContact NE2-CD1 3.33Å; H90-L94 WeakPolarHBondContact NE2-CD1 3.4Å; H90-L94 PolarHBondContact O-N 3.47Å; A91-L94 PolarHBondContact O-N 3.22Å; L94-A96 PolarHBondContact O-N 3.36Å; L94-L97 PolarHBondContact O-N 3.47Å; L94-D98 PolarHBondContact O-N 3.05Å |
| 95 | K | 91.1 | Very high | 79.1 | Confident | 168 Ų | 168 | 111.9 Ų | 111.9 | 73% | 0.73 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -60.8 | -28.7 | 179.3 | -68.9 | -179.9 | 178 | -165.8 | 0 | 113.9 | A91 | A91-K95 WeakPolarHBondContact O-CG 3.38Å; A91-K95 PolarHBondContact O-N 3.3Å; A91-K95 VanDerWaalsContact O-N 3.16Å |
| 96 | A | 89.4 | Confident | 76.3 | Confident | 74 Ų | 74 | 112.5 Ų | 112.5 | 61% | 0.612 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -78.2 | -19.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | K92 R93 L94 | K92-A96 PolarHBondContact O-N 3.38Å; R93-A96 PolarHBondContact O-N 3.39Å; L94-A96 PolarHBondContact O-N 3.36Å |
| 97 | L | 85.5 | Confident | 73.4 | Confident | 118 Ų | 118 | 116.3 Ų | 116.3 | 62% | 0.618 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -97.7 | -17.5 | 175.8 | -65.2 | -179.9 | 0 | 0 | 0 | 113.4 | V70 R93 L94 A99 | V70-L97 HydrophobicContact CB-CD1 4.31Å; V70-L97 HydrophobicContact CG1-CD1 3.83Å; V70-L97 HydrophobicContact CG2-CD1 4.16Å; R93-L97 WeakPolarHBondContact O-CG 3.48Å; R93-L97 PolarHBondContact O-N 3.25Å; L94-L97 PolarHBondContact O-N 3.47Å; L97-A99 VanDerWaalsContact C-N 3.3Å |
| 98 | D | 78.8 | Confident | 70.6 | Confident | 143 Ų | 143 | 123.1 Ų | 123.1 | 77% | 0.765 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -79.1 | -14.5 | 177.4 | -156.2 | -123 | 0 | 0 | 0 | 112.5 | L94 | L94-D98 PolarHBondContact O-N 3.05Š|
| 99 | A | 73.6 | Confident | 67.9 | Low | 64 Ų | 64 | 123.2 Ų | 123.2 | 53% | 0.529 | 64% | 0.637 | S | S | . | * | S | Bend | trans | -66.6 | 123 | 165.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | L97 D101 | L97-A99 VanDerWaalsContact C-N 3.3Å; A99-D101 PolarHBondContact O-N 3.33Å |
| 100 | P | 60.3 | Low | 64.9 | Low | 114 Ų | 114 | 122.7 Ų | 122.7 | 74% | 0.74 | 65% | 0.649 | S | S | * | * | trans | -74.1 | 101.8 | -161.3 | 27.2 | -35.9 | 0 | 0 | 0 | 113.4 | S102 | P100-S102 VanDerWaalsContact C-N 3.34Å; P100-S102 PolarHBondContact O-N 2.98Å | ||
| 101 | D | 51.6 | Low | 62 | Low | 157 Ų | 157 | 128.2 Ų | 128.2 | 84% | 0.84 | 68% | 0.683 | S | S | * | * | trans | -69.2 | 94.2 | 160 | -161.3 | -51 | 0 | 0 | 0 | 109.1 | A99 K103 | A99-D101 PolarHBondContact O-N 3.33Å; D101-K103 PolarHBondContact O-N 3.08Å | ||
| 102 | S | 49.8 | Very low | 59.3 | Low | 89 Ų | 89 | 135.3 Ų | 135.3 | 62% | 0.622 | 71% | 0.707 | S | S | * | * | trans | -100.9 | 71.5 | -173.5 | 49.2 | 0 | 0 | 0 | 0 | 111.6 | P100 | P100-S102 VanDerWaalsContact C-N 3.34Å; P100-S102 PolarHBondContact O-N 2.98Å | ||
| 103 | K | 46.8 | Very low | 56.5 | Low | 186 Ų | 186 | 136.5 Ų | 136.5 | 81% | 0.809 | 72% | 0.715 | S | S | * | * | trans | -172.1 | 106.9 | 142.4 | -92.9 | 135.4 | -144 | -65.3 | 0 | 111.9 | D101 K105 | D101-K103 PolarHBondContact O-N 3.08Å; K103-K105 PolarHBondContact O-N 2.9Å | ||
| 104 | I | 50.2 | Low | 53.6 | Low | 169 Ų | 169 | 136.3 Ų | 136.3 | 87% | 0.867 | 73% | 0.728 | S | S | * | * | trans | -65.3 | 125.4 | 162 | -62.2 | 167.4 | 0 | 0 | 0 | 108.6 | ||||
| 105 | K | 38 | Very low | 50.8 | Low | 173 Ų | 173 | 138.4 Ų | 138.4 | 75% | 0.752 | 75% | 0.745 | S | S | * | * | trans | -141.9 | 108.9 | 151.7 | -166.8 | 157.4 | -175 | 173.9 | 0 | 112.2 | K103 F107 | K103-K105 PolarHBondContact O-N 2.9Å; K105-F107 HydrophobicContact CD-CE2 4.47Å; K105-F107 HydrophobicContact CG-CE2 4.4Å | ||
| 106 | T | 37.2 | Very low | 48.2 | Very low | 107 Ų | 107 | 135 Ų | 135 | 66% | 0.656 | 74% | 0.742 | S | S | * | * | trans | -44.4 | 136.6 | 165.2 | -51 | 0 | 0 | 0 | 0 | 113 | ||||
| 107 | F | 33.5 | Very low | 45.8 | Very low | 183 Ų | 183 | 139.3 Ų | 139.3 | 80% | 0.803 | 75% | 0.75 | S | S | * | * | trans | -147.2 | 132.7 | 146.7 | -90.8 | -71.7 | 0 | 0 | 0 | 111 | K105 | K105-F107 HydrophobicContact CD-CE2 4.47Å; K105-F107 HydrophobicContact CG-CE2 4.4Å | ||
| 108 | E | 38.8 | Very low | 43.3 | Very low | 165 Ų | 165 | 140 Ų | 140 | 77% | 0.771 | 75% | 0.752 | S | S | * | * | trans | -77.5 | 162.2 | 175.7 | -82 | -71.8 | 115.6 | 0 | 0 | 111.9 | ||||
| 109 | P | 36.7 | Very low | 41 | Very low | 113 Ų | 113 | 140.3 Ų | 140.3 | 73% | 0.734 | 75% | 0.754 | S | S | * | * | trans | -84.6 | 137.3 | -172.7 | 33.4 | -33.3 | 0 | 0 | 0 | 113.2 | ||||
| 110 | V | 30.4 | Very low | 38.8 | Very low | 127 Ų | 127 | 143 Ų | 143 | 77% | 0.77 | 77% | 0.768 | S | S | * | * | trans | -125.3 | 129.8 | 166.9 | 173.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 111 | T | 36.2 | Very low | 37.6 | Very low | 125 Ų | 125 | 143.3 Ų | 143.3 | 77% | 0.767 | 77% | 0.773 | S | S | * | * | trans | -72.1 | 137.1 | 178.8 | 46.5 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 112 | K | 38 | Very low | 36.6 | Very low | 192 Ų | 192 | 141.2 Ų | 141.2 | 84% | 0.835 | 77% | 0.771 | S | S | * | * | trans | -179.9 | 149.4 | 133.3 | 52.9 | -156.8 | 83.1 | 177.5 | 0 | 111.4 | ||||
| 113 | E | 34.8 | Very low | 35.5 | Very low | 187 Ų | 187 | 143 Ų | 143 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | trans | -76.1 | 156.3 | -172.4 | -56.1 | -179 | 94.5 | 0 | 0 | 113.6 | ||||
| 114 | T | 31 | Very low | 35 | Very low | 130 Ų | 130 | 139.9 Ų | 139.9 | 80% | 0.798 | 78% | 0.784 | S | S | * | * | 177.3 | 119 | 123.3 | -74.4 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 115 | T | 35.3 | Very low | 34.7 | Very low | 122 Ų | 122 | 138.8 Ų | 138.8 | 75% | 0.748 | 78% | 0.775 | S | S | * | * | trans | 28.6 | 118.3 | 143.8 | -54.2 | 0 | 0 | 0 | 0 | 121 | ||||
| 116 | S | 37.3 | Very low | 34.7 | Very low | 97 Ų | 97 | 136 Ų | 136 | 68% | 0.678 | 78% | 0.775 | S | S | * | * | trans | 88.6 | 120.3 | 144.8 | -76.4 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 117 | Q | 37.3 | Very low | 34.9 | Very low | 164 Ų | 164 | 136.9 Ų | 136.9 | 77% | 0.766 | 79% | 0.785 | S | S | * | * | trans | 109.3 | 96.5 | 131.2 | -79.7 | -172.4 | 74.7 | 0 | 0 | 122.6 | ||||
| 118 | I | 34.3 | Very low | 34.8 | Very low | 132 Ų | 132 | 131.3 Ų | 131.3 | 68% | 0.677 | 78% | 0.779 | S | S | * | * | trans | 79.3 | 140.9 | 134.5 | -33.3 | 169.9 | 0 | 0 | 0 | 120.9 | ||||
| 119 | L | 31 | Very low | 34.8 | Very low | 151 Ų | 151 | 128.1 Ų | 128.1 | 79% | 0.791 | 78% | 0.775 | S | S | * | * | trans | 87.9 | 105.4 | 159 | -72.1 | 118.2 | 0 | 0 | 0 | 119.9 | ||||
| 120 | S | 27 | Very low | 34.6 | Very low | 119 Ų | 119 | 129.2 Ų | 129.2 | 83% | 0.832 | 78% | 0.775 | S | S | * | * | -169.6 | 106.1 | 103 | -83.3 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 121 | S | 34 | Very low | 34.7 | Very low | 121 Ų | 121 | 129 Ų | 129 | 85% | 0.846 | 77% | 0.774 | S | S | * | * | trans | 32.7 | 130.6 | 146.4 | -140 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 122 | S | 30.2 | Very low | 34.2 | Very low | 114 Ų | 114 | 129.1 Ų | 129.1 | 80% | 0.797 | 77% | 0.774 | S | S | * | * | trans | -66.1 | 155 | 173.7 | -67.3 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 123 | C | 27.1 | Very low | 33.9 | Very low | 126 Ų | 126 | 124.8 Ų | 124.8 | 85% | 0.851 | 77% | 0.768 | S | S | * | * | trans | -57 | 140.5 | 162.9 | -71.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 124 | S | 36.9 | Very low | 33.6 | Very low | 121 Ų | 121 | 125.5 Ų | 125.5 | 85% | 0.846 | 77% | 0.772 | S | S | * | * | trans | -141.3 | 140.7 | 144.8 | -82.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 125 | Q | 44.8 | Very low | 33.5 | Very low | 145 Ų | 145 | 126.7 Ų | 126.7 | 68% | 0.678 | 77% | 0.773 | S | S | * | * | trans | -79.3 | 158 | 176.1 | -56.6 | -173.7 | 3.7 | 0 | 0 | 110.2 | R89 | R89-Q125 VanDerWaalsContact NH1-CD 3.33Š| ||
| 126 | P | 36.2 | Very low | 34 | Very low | 115 Ų | 115 | 125.5 Ų | 125.5 | 75% | 0.747 | 77% | 0.768 | S | S | * | * | trans | -111.3 | 153.4 | 147.1 | 32.2 | -23.9 | 0 | 0 | 0 | 112.3 | ||||
| 127 | S | 41.3 | Very low | 33.5 | Very low | 126 Ų | 126 | 126 Ų | 126 | 88% | 0.881 | 77% | 0.771 | S | S | * | * | trans | -136.2 | 145.4 | 168.8 | -173.7 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 128 | G | 33.3 | Very low | 33.2 | Very low | 66 Ų | 66 | 122.8 Ų | 122.8 | 68% | 0.68 | 77% | 0.773 | S | S | * | * | trans | 152 | 153.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 129 | S | 37.1 | Very low | 33.6 | Very low | 97 Ų | 97 | 123 Ų | 123 | 68% | 0.678 | 78% | 0.782 | S | S | * | * | cis | -170.2 | -163.3 | -12.6 | 42.6 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 130 | D | 32.9 | Very low | 33.5 | Very low | 137 Ų | 137 | 122.2 Ų | 122.2 | 73% | 0.733 | 78% | 0.779 | S | S | * | * | trans | 93.2 | 142.7 | 156.5 | -49.1 | -12.1 | 0 | 0 | 0 | 117.1 | ||||
| 131 | T | 33.7 | Very low | 33.5 | Very low | 121 Ų | 121 | 121 Ų | 121 | 74% | 0.742 | 77% | 0.77 | S | S | * | * | cis | -167.5 | 179.5 | -8.2 | 20.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 132 | T | 24.6 | Very low | 33.3 | Very low | 128 Ų | 128 | 120.4 Ų | 120.4 | 79% | 0.785 | 76% | 0.762 | S | S | * | * | trans | 103.1 | 138.5 | 154.5 | -42.4 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 133 | S | 31.1 | Very low | 33.4 | Very low | 101 Ų | 101 | 119.4 Ų | 119.4 | 71% | 0.706 | 76% | 0.755 | S | S | * | * | cis | -168.8 | 168.4 | -30 | -83.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 134 | E | 29.2 | Very low | 33.6 | Very low | 203 Ų | 203 | 120.2 Ų | 120.2 | 95% | 0.949 | 75% | 0.751 | S | S | * | * | trans | 89.7 | 157.4 | 158.1 | -46.7 | -157.6 | 109.7 | 0 | 0 | 121.8 | ||||
| 135 | D | 28 | Very low | 33.3 | Very low | 154 Ų | 154 | 119.4 Ų | 119.4 | 82% | 0.824 | 74% | 0.741 | S | S | * | * | trans | -103.1 | -164.4 | -149 | -150.2 | 29.5 | 0 | 0 | 0 | 113.2 | ||||
| 136 | P | 46.3 | Very low | 32.5 | Very low | 97 Ų | 97 | 118.3 Ų | 118.3 | 63% | 0.63 | 74% | 0.744 | S | S | * | * | cis | -131 | 166.6 | -12.8 | 21.2 | 3.6 | 0 | 0 | 0 | 117.9 | ||||
| 137 | S | 26.4 | Very low | 32.3 | Very low | 107 Ų | 107 | 117.5 Ų | 117.5 | 75% | 0.748 | 74% | 0.741 | S | S | * | * | 146.4 | 126.1 | 123.3 | -65.1 | 0 | 0 | 0 | 0 | 117.8 | |||||
| 138 | A | 31.1 | Very low | 31.8 | Very low | 98 Ų | 98 | 120 Ų | 120 | 81% | 0.81 | 74% | 0.744 | S | S | * | * | trans | 56.2 | 142.7 | 137.8 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 139 | P | 43.4 | Very low | 31.8 | Very low | 135 Ų | 135 | 122.9 Ų | 122.9 | 88% | 0.877 | 75% | 0.754 | S | S | * | * | -142.4 | -178.8 | 57.1 | 39.1 | -18.6 | 0 | 0 | 0 | 118.1 | |||||
| 140 | N | 28.3 | Very low | 31.4 | Very low | 136 Ų | 136 | 122 Ų | 122 | 73% | 0.727 | 76% | 0.76 | S | S | * | * | trans | -95.4 | 149.7 | -168.9 | 160.4 | 78.4 | 0 | 0 | 0 | 114.9 | ||||
| 141 | S | 27.5 | Very low | 31.2 | Very low | 92 Ų | 92 | 119.5 Ų | 119.5 | 64% | 0.643 | 77% | 0.767 | S | S | * | * | trans | 164 | 115.6 | 136.6 | -104.7 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 142 | T | 29.2 | Very low | 31 | Very low | 109 Ų | 109 | 122 Ų | 122 | 67% | 0.669 | 77% | 0.774 | S | S | * | * | 59.7 | 124.5 | 88.6 | 62.9 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 143 | S | 33.1 | Very low | 31.3 | Very low | 93 Ų | 93 | 119.8 Ų | 119.8 | 65% | 0.65 | 77% | 0.769 | S | S | * | * | cis | -159.6 | 178.6 | 5.4 | -74.3 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 144 | D | 30.9 | Very low | 31.2 | Very low | 144 Ų | 144 | 123.3 Ų | 123.3 | 77% | 0.77 | 78% | 0.775 | S | S | * | * | trans | 89.2 | 136.3 | 142.6 | -75.3 | -46.2 | 0 | 0 | 0 | 120.3 | ||||
| 145 | T | 30 | Very low | 31.2 | Very low | 103 Ų | 103 | 119.6 Ų | 119.6 | 63% | 0.632 | 77% | 0.766 | S | S | * | * | cis | -155.5 | 154.3 | -19.8 | -31.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 146 | T | 29.8 | Very low | 31.2 | Very low | 122 Ų | 122 | 116.8 Ų | 116.8 | 75% | 0.748 | 76% | 0.755 | S | S | * | * | trans | 30.2 | 147.4 | 152.8 | 50.5 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 147 | S | 30.7 | Very low | 30.5 | Very low | 98 Ų | 98 | 121.3 Ų | 121.3 | 69% | 0.685 | 76% | 0.764 | S | S | * | * | cis | 179.9 | 173.7 | -9.3 | -96.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 148 | L | 30.5 | Very low | 30.6 | Very low | 179 Ų | 179 | 123 Ų | 123 | 94% | 0.937 | 76% | 0.761 | S | S | * | * | trans | 96.2 | 153.1 | 162.7 | -60.4 | 168.8 | 0 | 0 | 0 | 117.4 | ||||
| 149 | S | 33.4 | Very low | 31.1 | Very low | 127 Ų | 127 | 123.8 Ų | 123.8 | 89% | 0.888 | 76% | 0.757 | S | S | * | * | trans | -148.7 | 162.3 | -142.2 | 179.8 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 150 | G | 28.5 | Very low | 30.4 | Very low | 78 Ų | 78 | 121.4 Ų | 121.4 | 80% | 0.804 | 74% | 0.74 | S | S | * | * | trans | 114.6 | 138.8 | 155.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 151 | G | 28.6 | Very low | 30.5 | Very low | 85 Ų | 85 | 121.5 Ų | 121.5 | 88% | 0.876 | 74% | 0.741 | S | S | * | * | trans | 154.4 | 70.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 152 | L | 30.8 | Very low | 30.7 | Very low | 172 Ų | 172 | 124.7 Ų | 124.7 | 90% | 0.901 | 75% | 0.745 | S | S | * | * | trans | -85.5 | 158.4 | 169.1 | 176.7 | 66.9 | 0 | 0 | 0 | 110.8 | ||||
| 153 | A | 30.6 | Very low | 30.6 | Very low | 82 Ų | 82 | 124.9 Ų | 124.9 | 68% | 0.678 | 75% | 0.751 | S | S | * | * | trans | 115.3 | 106.5 | 165.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 154 | E | 29.3 | Very low | 30.7 | Very low | 176 Ų | 176 | 128.5 Ų | 128.5 | 82% | 0.822 | 76% | 0.762 | S | S | * | * | 86.7 | 149.8 | 64.4 | -85.1 | -142.4 | 94.4 | 0 | 0 | 114.1 | |||||
| 155 | T | 28.4 | Very low | 31.1 | Very low | 124 Ų | 124 | 127.4 Ų | 127.4 | 76% | 0.761 | 76% | 0.763 | S | S | * | * | trans | 75.8 | 132.9 | 164.5 | -90.4 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 156 | T | 27.7 | Very low | 31 | Very low | 96 Ų | 96 | 127.1 Ų | 127.1 | 59% | 0.589 | 77% | 0.771 | S | S | * | * | cis | -174.6 | 163.6 | -2.1 | -108.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 157 | K | 32.1 | Very low | 31.1 | Very low | 192 Ų | 192 | 126.9 Ų | 126.9 | 84% | 0.835 | 77% | 0.774 | S | S | * | * | trans | 77.2 | 102.2 | 162.7 | -83.2 | 154 | -156.3 | 173.3 | 0 | 120.7 | ||||
| 158 | E | 29.9 | Very low | 31.5 | Very low | 143 Ų | 143 | 128.4 Ų | 128.4 | 67% | 0.668 | 78% | 0.782 | S | S | * | * | -61.2 | 159.5 | 128.4 | -140.2 | -152.8 | 113.4 | 0 | 0 | 110 | T160 | E158-T160 WeakPolarHBondContact OE1-CB 3.32Å; E158-T160 PolarHBondContact OE1-N 2.8Å; E158-T160 PolarHBondContact OE1-OG1 3.35Å | |||
| 159 | P | 40.1 | Very low | 31.7 | Very low | 114 Ų | 114 | 130.7 Ų | 130.7 | 74% | 0.74 | 78% | 0.778 | S | S | * | * | -144.6 | 138.2 | 75.3 | 34.3 | -14.7 | 0 | 0 | 0 | 117.2 | |||||
| 160 | T | 28.4 | Very low | 31.4 | Very low | 85 Ų | 85 | 131 Ų | 131 | 52% | 0.521 | 78% | 0.775 | S | S | . | * | trans | 27.6 | 119 | 130.5 | -6.3 | 0 | 0 | 0 | 0 | 120.2 | E158 | E158-T160 WeakPolarHBondContact OE1-CB 3.32Å; E158-T160 PolarHBondContact OE1-N 2.8Å; E158-T160 PolarHBondContact OE1-OG1 3.35Å | ||
| 161 | N | 31.6 | Very low | 31.9 | Very low | 137 Ų | 137 | 131.3 Ų | 131.3 | 73% | 0.733 | 77% | 0.769 | S | S | * | * | 169.8 | 151.2 | 103 | -91.9 | -63.2 | 0 | 0 | 0 | 116.4 | |||||
| 162 | H | 30.4 | Very low | 32.1 | Very low | 159 Ų | 159 | 136 Ų | 136 | 74% | 0.736 | 77% | 0.768 | S | S | * | * | trans | -50 | 141.7 | -177.3 | -46 | -81.2 | 0 | 0 | 0 | 118.8 | ||||
| 163 | S | 28.2 | Very low | 32.4 | Very low | 114 Ų | 114 | 135.1 Ų | 135.1 | 80% | 0.797 | 76% | 0.757 | S | S | * | * | 167.3 | 144.3 | 102.5 | -73 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 164 | L | 35.5 | Very low | 32.4 | Very low | 169 Ų | 169 | 137.4 Ų | 137.4 | 89% | 0.885 | 76% | 0.758 | S | S | * | * | trans | -80 | 153.4 | 158.4 | -62.6 | 170.3 | 0 | 0 | 0 | 109 | ||||
| 165 | P | 38 | Very low | 32.6 | Very low | 121 Ų | 121 | 132.6 Ų | 132.6 | 79% | 0.786 | 76% | 0.756 | S | S | * | * | -151.5 | 163.6 | 92.6 | 38.3 | -20.5 | 0 | 0 | 0 | 117.4 | |||||
| 166 | A | 28.5 | Very low | 33 | Very low | 97 Ų | 97 | 136.4 Ų | 136.4 | 80% | 0.802 | 77% | 0.765 | S | S | * | * | trans | 56.3 | 124.5 | 146.9 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 167 | S | 32.8 | Very low | 33.2 | Very low | 116 Ų | 116 | 136.3 Ų | 136.3 | 81% | 0.811 | 77% | 0.774 | S | S | * | * | trans | -73.2 | 158.9 | 160.2 | -45.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 168 | P | 38.6 | Very low | 33.4 | Very low | 130 Ų | 130 | 135.3 Ų | 135.3 | 84% | 0.844 | 77% | 0.772 | S | S | * | * | -133.5 | 176.4 | 111.2 | 17.4 | 3.4 | 0 | 0 | 0 | 114.3 | |||||
| 169 | R | 33.6 | Very low | 33.5 | Very low | 228 Ų | 228 | 134.4 Ų | 134.4 | 86% | 0.86 | 78% | 0.777 | S | S | * | * | trans | -88.8 | 151.4 | -174.2 | -55.1 | 171.3 | 172.8 | -149.6 | -3.4 | 111.9 | ||||
| 170 | T | 27.7 | Very low | 33.5 | Very low | 133 Ų | 133 | 135 Ų | 135 | 82% | 0.816 | 78% | 0.781 | S | S | * | * | 167.7 | 139 | 101.4 | 40.5 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 171 | A | 38.5 | Very low | 33.9 | Very low | 84 Ų | 84 | 137.4 Ų | 137.4 | 69% | 0.694 | 79% | 0.79 | S | S | * | * | trans | 65 | 110.9 | 136.9 | 0 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 172 | E | 33.8 | Very low | 34.4 | Very low | 183 Ų | 183 | 138.7 Ų | 138.7 | 86% | 0.855 | 79% | 0.792 | S | S | * | * | trans | 57.2 | 151.9 | 141 | -27.8 | -163.9 | 155.4 | 0 | 0 | 119.3 | ||||
| 173 | K | 36.6 | Very low | 35 | Very low | 154 Ų | 154 | 137.1 Ų | 137.1 | 67% | 0.67 | 79% | 0.785 | S | S | * | * | cis | -164.4 | 158.9 | 5.4 | -147.7 | 176.2 | 153 | -82.6 | 0 | 110.7 | ||||
| 174 | D | 31.8 | Very low | 36.5 | Very low | 131 Ų | 131 | 135.7 Ų | 135.7 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | trans | 84.2 | 137.3 | 151.4 | -60.7 | -43 | 0 | 0 | 0 | 123.2 | ||||
| 175 | G | 32.8 | Very low | 37.7 | Very low | 75 Ų | 75 | 133.8 Ų | 133.8 | 77% | 0.773 | 76% | 0.758 | S | S | * | * | trans | 96.8 | 79.7 | 164.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 176 | E | 36.5 | Very low | 39 | Very low | 203 Ų | 203 | 133.5 Ų | 133.5 | 95% | 0.949 | 75% | 0.746 | S | S | * | * | 80.8 | 96.7 | 76.6 | -170.5 | 151.7 | 97.1 | 0 | 0 | 115.7 | |||||
| 177 | A | 32.5 | Very low | 40.7 | Very low | 94 Ų | 94 | 132.3 Ų | 132.3 | 78% | 0.777 | 72% | 0.724 | S | S | * | * | trans | -163.8 | 113.3 | 152.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 178 | E | 35.4 | Very low | 42.4 | Very low | 172 Ų | 172 | 133.4 Ų | 133.4 | 80% | 0.804 | 71% | 0.714 | S | S | * | * | trans | 36.9 | 96.2 | 149.2 | -63.9 | -64.2 | 112.9 | 0 | 0 | 120 | ||||
| 179 | T | 32.7 | Very low | 43.4 | Very low | 123 Ų | 123 | 127.5 Ų | 127.5 | 76% | 0.755 | 68% | 0.676 | S | S | * | * | -176.5 | 121 | 119.3 | 24.9 | 0 | 0 | 0 | 0 | 110.5 | D181 | T179-D181 PolarHBondContact O-N 2.81Å; T179-D181 VanDerWaalsContact O-N 3.08Å | |||
| 180 | P | 39.5 | Very low | 45 | Very low | 128 Ų | 128 | 121.5 Ų | 121.5 | 83% | 0.831 | 66% | 0.656 | S | S | * | * | trans | -83.5 | 67.3 | 164.9 | 34.9 | -31.9 | 0 | 0 | 0 | 108.8 | Q182 | P180-Q182 PolarHBondContact O-N 3.21Š| ||
| 181 | D | 35.8 | Very low | 46.9 | Very low | 134 Ų | 134 | 122.2 Ų | 122.2 | 72% | 0.717 | 64% | 0.644 | S | S | * | * | trans | -65.8 | 123.7 | 174.5 | -150.5 | -54.1 | 0 | 0 | 0 | 108.8 | T179 E183 | T179-D181 PolarHBondContact O-N 2.81Å; T179-D181 VanDerWaalsContact O-N 3.08Å; D181-E183 PolarHBondContact O-N 3.4Å | ||
| 182 | Q | 43.6 | Very low | 48.7 | Very low | 164 Ų | 164 | 123.7 Ų | 123.7 | 77% | 0.766 | 64% | 0.64 | S | S | * | * | trans | -80.4 | 68.7 | -173.3 | -172 | 175.7 | 64.5 | 0 | 0 | 108.1 | P180 T184 | P180-Q182 PolarHBondContact O-N 3.21Å; Q182-T184 VanDerWaalsContact C-N 3.27Å; Q182-T184 WeakPolarHBondContact O-CA 3.5Å; Q182-T184 PolarHBondContact O-N 3.29Å; Q182-T184 PolarHBondContact O-OG1 3.07Å | ||
| 183 | E | 43.5 | Very low | 51.3 | Low | 127 Ų | 127 | 116.9 Ų | 116.9 | 59% | 0.593 | 61% | 0.609 | S | S | * | * | trans | -49.2 | 94.1 | 175.5 | -85.9 | -153.9 | 147.4 | 0 | 0 | 108.2 | D181 R191 | D181-E183 PolarHBondContact O-N 3.4Å; E183-R191 IonicContact OE1-CZ 2.72Å; E183-R191 IonicContact OE1-NH1 3.09Å; E183-R191 PolarHBondContact OE1-NH1 2.6Å; E183-R191 IonicContact OE1-NH2 2.91Å; E183-R191 PolarHBondContact OE1-NH2 3.11Å; E183-R191 IonicContact OE2-NH1 3.33Å | ||
| 184 | T | 58 | Low | 54 | Low | 84 Ų | 84 | 113.3 Ų | 113.3 | 52% | 0.515 | 59% | 0.592 | S | S | . | * | trans | -75.6 | 149.3 | -163.5 | -29.8 | 0 | 0 | 0 | 0 | 107.6 | Q182 E186 E187 | Q182-T184 VanDerWaalsContact C-N 3.27Å; Q182-T184 WeakPolarHBondContact O-CA 3.5Å; Q182-T184 PolarHBondContact O-N 3.29Å; Q182-T184 PolarHBondContact O-OG1 3.07Å; T184-E186 PolarHBondContact O-N 2.67Å; T184-E187 PolarHBondContact O-N 3.43Å | ||
| 185 | E | 61.6 | Low | 56.9 | Low | 129 Ų | 129 | 107.3 Ų | 107.3 | 60% | 0.603 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -54.3 | -25.9 | -179.2 | -164.9 | -91.8 | 161.7 | 0 | 0 | 112.2 | K188 A189 | E185-K188 PolarHBondContact O-N 3.5Å; E185-A189 WeakPolarHBondContact O-CB 3.41Å; E185-A189 PolarHBondContact O-N 3.04Å |
| 186 | E | 65.1 | Low | 59.6 | Low | 114 Ų | 114 | 106.6 Ų | 106.6 | 53% | 0.533 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61 | -36.6 | 170.2 | -160.9 | -171.6 | 133 | 0 | 0 | 115 | T184 A189 K190 | T184-E186 PolarHBondContact O-N 2.67Å; E186-A189 PolarHBondContact O-N 3.42Å; E186-K190 VanDerWaalsContact O-CG 3.29Å; E186-K190 WeakPolarHBondContact O-CG 3.06Å; E186-K190 PolarHBondContact O-N 3.04Å; E186-K190 WeakPolarHBondContact OE1-CE 3.43Å; E186-K190 IonicContact OE1-NZ 3.68Å; E186-K190 PolarHBondContact OE1-NZ 3.3Å |
| 187 | E | 64.4 | Low | 62.1 | Low | 73 Ų | 73 | 99.6 Ų | 99.6 | 34% | 0.341 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -74 | -39.1 | 177.5 | -149.4 | -136.9 | 135.7 | 0 | 0 | 111.3 | T184 A189 K190 R191 | T184-E187 PolarHBondContact O-N 3.43Å; E187-A189 VanDerWaalsContact C-N 3.29Å; E187-A189 PolarHBondContact O-N 3.08Å; E187-K190 WeakPolarHBondContact O-CB 3.08Å; E187-K190 PolarHBondContact O-N 2.85Å; E187-K190 VanDerWaalsContact O-N 3.15Å; E187-R191 WeakPolarHBondContact O-CG 3.18Å; E187-R191 PolarHBondContact O-N 3.05Å; E187-R191 IonicContact OE1-CZ 3.79Å; E187-R191 IonicContact OE1-NE 3.66Å; E187-R191 PolarHBondContact OE1-NE 3.28Å; E187-R191 IonicContact OE1-NH2 2.73Å; E187-R191 PolarHBondContact OE1-NH2 3.39Å; E187-R191 IonicContact OE2-CZ 2.83Å; E187-R191 IonicContact OE2-NH2 3.73Å; E187-R191 PolarHBondContact OE2-NH2 2.82Å |
| 188 | K | 67.3 | Low | 64.8 | Low | 139 Ų | 139 | 97 Ų | 97 | 60% | 0.604 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.1 | -39.2 | 168.8 | -171.9 | 174.4 | -178.8 | 175 | 0 | 111.3 | E185 R191 L192 | E185-K188 PolarHBondContact O-N 3.5Å; K188-R191 PolarHBondContact O-N 3.34Å; K188-L192 HydrophobicContact CG-CD1 4.09Å; K188-L192 WeakPolarHBondContact O-CB 3.41Å; K188-L192 VanDerWaalsContact O-CG 3.3Å; K188-L192 WeakPolarHBondContact O-CG 3.42Å; K188-L192 PolarHBondContact O-N 2.86Å |
| 189 | A | 61.1 | Low | 67.4 | Low | 6 Ų | 6 | 96.8 Ų | 96.8 | 5% | 0.05 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -64.7 | -37.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | E185 E186 E187 L192 L193 Y194 | E185-A189 WeakPolarHBondContact O-CB 3.41Å; E185-A189 PolarHBondContact O-N 3.04Å; E186-A189 PolarHBondContact O-N 3.42Å; E187-A189 VanDerWaalsContact C-N 3.29Å; E187-A189 PolarHBondContact O-N 3.08Å; A189-L192 CarbonylContact O-C 3.46Å; A189-L192 PolarHBondContact O-N 3.16Å; A189-L193 PolarHBondContact O-N 2.71Å; A189-Y194 HydrophobicContact CB-CD1 4.41Å; A189-Y194 PolarHBondContact O-N 3.1Å |
| 190 | K | 67.3 | Low | 70.2 | Confident | 101 Ų | 101 | 93.8 Ų | 93.8 | 44% | 0.439 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64.1 | -44.9 | 171.6 | -72.4 | 162.5 | -172 | 160.4 | 0 | 111.8 | E186 E187 L192 L193 | E186-K190 VanDerWaalsContact O-CG 3.29Å; E186-K190 WeakPolarHBondContact O-CG 3.06Å; E186-K190 PolarHBondContact O-N 3.04Å; E186-K190 WeakPolarHBondContact OE1-CE 3.43Å; E186-K190 IonicContact OE1-NZ 3.68Å; E186-K190 PolarHBondContact OE1-NZ 3.3Å; E187-K190 WeakPolarHBondContact O-CB 3.08Å; E187-K190 PolarHBondContact O-N 2.85Å; E187-K190 VanDerWaalsContact O-N 3.15Å; K190-L192 VanDerWaalsContact C-N 3.28Å; K190-L192 PolarHBondContact O-N 3.3Å; K190-L193 PolarHBondContact O-N 2.99Å; K190-L193 VanDerWaalsContact O-N 3.11Å |
| 191 | R | 68 | Low | 72.6 | Confident | 149 Ų | 149 | 91.1 Ų | 91.1 | 56% | 0.562 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -62.1 | -33.8 | 174.1 | -66.9 | 177.7 | -170.3 | 167.4 | 3.3 | 112 | E183 E187 K188 | E183-R191 IonicContact OE1-CZ 2.72Å; E183-R191 IonicContact OE1-NH1 3.09Å; E183-R191 PolarHBondContact OE1-NH1 2.6Å; E183-R191 IonicContact OE1-NH2 2.91Å; E183-R191 PolarHBondContact OE1-NH2 3.11Å; E183-R191 IonicContact OE2-NH1 3.33Å; E187-R191 WeakPolarHBondContact O-CG 3.18Å; E187-R191 PolarHBondContact O-N 3.05Å; E187-R191 IonicContact OE1-CZ 3.79Å; E187-R191 IonicContact OE1-NE 3.66Å; E187-R191 PolarHBondContact OE1-NE 3.28Å; E187-R191 IonicContact OE1-NH2 2.73Å; E187-R191 PolarHBondContact OE1-NH2 3.39Å; E187-R191 IonicContact OE2-CZ 2.83Å; E187-R191 IonicContact OE2-NH2 3.73Å; E187-R191 PolarHBondContact OE2-NH2 2.82Å; K188-R191 PolarHBondContact O-N 3.34Å |
| 192 | L | 75.9 | Confident | 75.3 | Confident | 115 Ų | 115 | 86.4 Ų | 86.4 | 60% | 0.602 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.6 | 4.2 | 174.9 | -68.4 | 173.1 | 0 | 0 | 0 | 114.5 | K188 A189 K190 Y194 | K188-L192 HydrophobicContact CG-CD1 4.09Å; K188-L192 WeakPolarHBondContact O-CB 3.41Å; K188-L192 VanDerWaalsContact O-CG 3.3Å; K188-L192 WeakPolarHBondContact O-CG 3.42Å; K188-L192 PolarHBondContact O-N 2.86Å; A189-L192 CarbonylContact O-C 3.46Å; A189-L192 PolarHBondContact O-N 3.16Å; K190-L192 VanDerWaalsContact C-N 3.28Å; K190-L192 PolarHBondContact O-N 3.3Å; L192-Y194 PolarHBondContact O-N 2.88Å |
| 193 | L | 88.9 | Confident | 77.5 | Confident | 40 Ų | 40 | 84.8 Ų | 84.8 | 21% | 0.209 | 43% | 0.427 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 53.9 | 35.6 | 180 | -55 | 177.4 | 0 | 0 | 0 | 113.5 | A189 K190 A201 V202 N203 S204 A205 | A189-L193 PolarHBondContact O-N 2.71Å; K190-L193 PolarHBondContact O-N 2.99Å; K190-L193 VanDerWaalsContact O-N 3.11Å; L193-A201 WeakPolarHBondContact O-CA 3.37Å; L193-V202 HydrophobicContact CB-CG2 4.34Å; L193-V202 WeakPolarHBondContact CB-O 3.4Å; L193-V202 WeakPolarHBondContact O-CG2 3.33Å; L193-V202 PolarHBondContact O-N 3.07Å; L193-N203 WeakPolarHBondContact CD1-O 3.24Å; L193-S204 VanDerWaalsContact CD2-C 3.48Å; L193-A205 VanDerWaalsContact CD2-CA 3.48Å; L193-A205 HydrophobicContact CD2-CB 3.96Å; L193-A205 VanDerWaalsContact CD2-N 3.25Å |
| 194 | Y | 92.9 | Very high | 79.8 | Confident | 79 Ų | 79 | 80.2 Ų | 80.2 | 31% | 0.31 | 41% | 0.409 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.6 | 136.6 | -170.5 | 176.5 | -107.9 | 0 | 0 | 0 | 112.4 | A189 L192 K199 A201 | A189-Y194 HydrophobicContact CB-CD1 4.41Å; A189-Y194 PolarHBondContact O-N 3.1Å; L192-Y194 PolarHBondContact O-N 2.88Å; Y194-K199 WeakPolarHBondContact OH-CA 3.3Å; Y194-A201 HydrophobicContact CD2-CB 4.22Å |
| 195 | C | 92.2 | Very high | 81.3 | Confident | 4 Ų | 4 | 79.5 Ų | 79.5 | 3% | 0.027 | 41% | 0.411 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.6 | 110.7 | 172.3 | -179.7 | 0 | 0 | 0 | 0 | 110.3 | L197 C198 K199 V200 L208 H211 H217 | C195-L197 PolarHBondContact O-N 3.12Å; C195-C198 HydrophobicContact CB-CB 4.42Å; C195-C198 PolarHBondContact SG-N 3.09Å; C195-C198 VanDerWaalsContact SG-N 3.43Å; C195-K199 WeakPolarHBondContact O-CA 3.43Å; C195-K199 PolarHBondContact O-N 2.83Å; C195-V200 PolarHBondContact N-O 3.3Å; C195-V200 PolarHBondContact O-N 3.21Å; C195-L208 HydrophobicContact CB-CD1 3.91Å; C195-H211 PolarHBondContact SG-NE2 2.97Å; C195-H211 VanDerWaalsContact SG-NE2 3.37Å; C195-H217 PolarHBondContact SG-CE1 3.38Å; C195-H217 PolarHBondContact SG-ND1 2.97Å |
| 196 | S | 88.8 | Confident | 82.8 | Confident | 60 Ų | 60 | 77.1 Ų | 77.1 | 42% | 0.42 | 41% | 0.409 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.2 | -35.2 | 178.8 | 57.5 | 0 | 0 | 0 | 0 | 113.6 | ||
| 197 | L | 89.3 | Confident | 84.1 | Confident | 56 Ų | 56 | 75.9 Ų | 75.9 | 29% | 0.293 | 40% | 0.404 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.4 | -39.6 | -179.8 | -61.9 | -174.8 | 0 | 0 | 0 | 113.2 | C195 L221 | C195-L197 PolarHBondContact O-N 3.12Å; L197-L221 HydrophobicContact CD1-CB 3.84Å; L197-L221 HydrophobicContact CD1-CD1 3.77Å; L197-L221 HydrophobicContact CD1-CG 3.69Å |
| 198 | C | 89.7 | Confident | 85.4 | Confident | 41 Ų | 41 | 72.8 Ų | 72.8 | 28% | 0.277 | 39% | 0.389 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.7 | -9.5 | -179.3 | -63 | 0 | 0 | 0 | 0 | 113.6 | C195 V200 H211 | C195-C198 HydrophobicContact CB-CB 4.42Å; C195-C198 PolarHBondContact SG-N 3.09Å; C195-C198 VanDerWaalsContact SG-N 3.43Å; C198-V200 VanDerWaalsContact C-N 3.32Å; C198-V200 HydrophobicContact CB-CG2 4.16Å; C198-V200 PolarHBondContact O-N 3.33Å; C198-H211 WeakPolarHBondContact CB-NE2 3.34Å; C198-H211 PolarHBondContact SG-NE2 3.13Å; C198-H211 VanDerWaalsContact SG-NE2 3.42Å |
| 199 | K | 90.6 | Very high | 86.6 | Confident | 166 Ų | 166 | 73.1 Ų | 73.1 | 72% | 0.722 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.2 | 41.5 | -173.8 | -54.7 | -173.7 | 179.5 | -176.5 | 0 | 113.6 | Y194 C195 | Y194-K199 WeakPolarHBondContact OH-CA 3.3Å; C195-K199 WeakPolarHBondContact O-CA 3.43Å; C195-K199 PolarHBondContact O-N 2.83Å |
| 200 | V | 89.9 | Confident | 88.2 | Confident | 61 Ų | 61 | 75.7 Ų | 75.7 | 37% | 0.37 | 41% | 0.414 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.9 | 126.6 | -179.4 | -177.7 | 0 | 0 | 0 | 0 | 109.9 | C195 C198 V202 | C195-V200 PolarHBondContact N-O 3.3Å; C195-V200 PolarHBondContact O-N 3.21Å; C198-V200 VanDerWaalsContact C-N 3.32Å; C198-V200 HydrophobicContact CB-CG2 4.16Å; C198-V200 PolarHBondContact O-N 3.33Å; V200-V202 HydrophobicContact CG1-CG1 4.01Å |
| 201 | A | 91.2 | Very high | 89.5 | Confident | 71 Ų | 71 | 73.1 Ų | 73.1 | 59% | 0.587 | 40% | 0.404 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90.4 | 138.8 | 163.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | L193 Y194 | L193-A201 WeakPolarHBondContact O-CA 3.37Å; Y194-A201 HydrophobicContact CD2-CB 4.22Å |
| 202 | V | 91.6 | Very high | 90.6 | Very high | 35 Ų | 35 | 69 Ų | 69 | 21% | 0.212 | 39% | 0.392 | C | S | . | . | trans | -123.5 | 171.2 | 178.3 | -62.8 | 0 | 0 | 0 | 0 | 110.8 | L193 V200 Q207 L208 | L193-V202 HydrophobicContact CB-CG2 4.34Å; L193-V202 WeakPolarHBondContact CB-O 3.4Å; L193-V202 WeakPolarHBondContact O-CG2 3.33Å; L193-V202 PolarHBondContact O-N 3.07Å; V200-V202 HydrophobicContact CG1-CG1 4.01Å; V202-Q207 HydrophobicContact CB-CB 3.97Å; V202-Q207 HydrophobicContact CG2-CB 3.93Å; V202-L208 HydrophobicContact CG2-CB 3.61Å; V202-L208 HydrophobicContact CG2-CD1 4.13Å; V202-L208 HydrophobicContact CG2-CG 4.46Å | ||
| 203 | N | 91.1 | Very high | 91.4 | Very high | 131 Ų | 131 | 67.9 Ų | 67.9 | 70% | 0.701 | 39% | 0.394 | S | S | * | . | S | Bend | trans | -96.6 | -11.9 | -165.3 | -173.6 | -103.3 | 0 | 0 | 0 | 114.4 | L193 | L193-N203 WeakPolarHBondContact CD1-O 3.24Š|
| 204 | S | 90.9 | Very high | 91.7 | Very high | 31 Ų | 31 | 67.1 Ų | 67.1 | 22% | 0.217 | 40% | 0.397 | C | S | . | . | S | Bend | trans | -143.4 | 159 | 171.3 | 73.9 | 0 | 0 | 0 | 0 | 113.1 | L193 S206 Q207 L208 | L193-S204 VanDerWaalsContact CD2-C 3.48Å; S204-S206 VanDerWaalsContact C-N 3.25Å; S204-S206 PolarHBondContact O-N 3.39Å; S204-S206 PolarHBondContact OG-OG 2.79Å; S204-Q207 WeakPolarHBondContact O-CB 3.5Å; S204-Q207 PolarHBondContact O-N 3.37Å; S204-Q207 VanDerWaalsContact OG-CG 3.26Å; S204-Q207 WeakPolarHBondContact OG-CG 3.47Å; S204-Q207 PolarHBondContact OG-N 2.99Å; S204-Q207 PolarHBondContact OG-NE2 3.32Å; S204-L208 PolarHBondContact O-N 3.06Å |
| 205 | A | 90.4 | Very high | 91.6 | Very high | 68 Ų | 68 | 68.8 Ų | 68.8 | 56% | 0.562 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -60.5 | -37.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | L193 Q207 L208 Q209 | L193-A205 VanDerWaalsContact CD2-CA 3.48Å; L193-A205 HydrophobicContact CD2-CB 3.96Å; L193-A205 VanDerWaalsContact CD2-N 3.25Å; A205-Q207 PolarHBondContact O-N 3.34Å; A205-L208 PolarHBondContact O-N 2.89Å; A205-L208 VanDerWaalsContact O-N 3.16Å; A205-Q209 WeakPolarHBondContact O-CB 3.41Å; A205-Q209 PolarHBondContact O-N 3.26Å |
| 206 | S | 92 | Very high | 91.5 | Very high | 80 Ų | 80 | 77.2 Ų | 77.2 | 56% | 0.559 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -64.3 | -35 | 173.1 | 52 | 0 | 0 | 0 | 0 | 113.2 | S204 A210 | S204-S206 VanDerWaalsContact C-N 3.25Å; S204-S206 PolarHBondContact O-N 3.39Å; S204-S206 PolarHBondContact OG-OG 2.79Å; S206-A210 VanDerWaalsContact O-CB 3.27Å; S206-A210 WeakPolarHBondContact O-CB 3.38Å; S206-A210 PolarHBondContact O-N 2.73Å |
| 207 | Q | 92 | Very high | 91.7 | Very high | 88 Ų | 88 | 75 Ų | 75 | 41% | 0.411 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -68.5 | -35.9 | 171.5 | -71.5 | 166.1 | 31.8 | 0 | 0 | 111.6 | V202 S204 A205 H211 | V202-Q207 HydrophobicContact CB-CB 3.97Å; V202-Q207 HydrophobicContact CG2-CB 3.93Å; S204-Q207 WeakPolarHBondContact O-CB 3.5Å; S204-Q207 PolarHBondContact O-N 3.37Å; S204-Q207 VanDerWaalsContact OG-CG 3.26Å; S204-Q207 WeakPolarHBondContact OG-CG 3.47Å; S204-Q207 PolarHBondContact OG-N 2.99Å; S204-Q207 PolarHBondContact OG-NE2 3.32Å; A205-Q207 PolarHBondContact O-N 3.34Å; Q207-H211 VanDerWaalsContact O-CB 3.28Å; Q207-H211 WeakPolarHBondContact O-CB 3.38Å; Q207-H211 PolarHBondContact O-N 3.47Å |
| 208 | L | 93.3 | Very high | 91.8 | Very high | 8 Ų | 8 | 77.9 Ų | 77.9 | 4% | 0.042 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -70.2 | -42.1 | 177.3 | -175.1 | 64.2 | 0 | 0 | 0 | 110.7 | C195 V202 S204 A205 H211 N212 | C195-L208 HydrophobicContact CB-CD1 3.91Å; V202-L208 HydrophobicContact CG2-CB 3.61Å; V202-L208 HydrophobicContact CG2-CD1 4.13Å; V202-L208 HydrophobicContact CG2-CG 4.46Å; S204-L208 PolarHBondContact O-N 3.06Å; A205-L208 PolarHBondContact O-N 2.89Å; A205-L208 VanDerWaalsContact O-N 3.16Å; L208-H211 WeakPolarHBondContact O-CB 3.4Å; L208-H211 PolarHBondContact O-N 3.36Å; L208-N212 WeakPolarHBondContact O-CB 3.5Å; L208-N212 PolarHBondContact O-N 3.43Å; L208-N212 PolarHBondContact O-OD1 3.24Å |
| 209 | Q | 91.4 | Very high | 91.7 | Very high | 145 Ų | 145 | 79.3 Ų | 79.3 | 68% | 0.678 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -61.1 | -44.5 | 174 | -172.1 | -177.9 | -1.4 | 0 | 0 | 111.7 | A205 H211 N212 S213 | A205-Q209 WeakPolarHBondContact O-CB 3.41Å; A205-Q209 PolarHBondContact O-N 3.26Å; Q209-H211 VanDerWaalsContact C-N 3.33Å; Q209-H211 PolarHBondContact O-N 2.82Å; Q209-N212 PolarHBondContact O-N 3.47Å; Q209-S213 PolarHBondContact O-N 3.48Å; Q209-S213 PolarHBondContact O-OG 3.43Å; Q209-S213 VanDerWaalsContact O-OG 3.09Å |
| 210 | A | 94.7 | Very high | 91.6 | Very high | 60 Ų | 60 | 76.6 Ų | 76.6 | 50% | 0.496 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -68.1 | -29.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | S206 S213 G214 | S206-A210 VanDerWaalsContact O-CB 3.27Å; S206-A210 WeakPolarHBondContact O-CB 3.38Å; S206-A210 PolarHBondContact O-N 2.73Å; A210-S213 PolarHBondContact O-OG 2.98Å; A210-G214 PolarHBondContact O-N 3.42Å |
| 211 | H | 94.7 | Very high | 91.5 | Very high | 48 Ų | 48 | 76.8 Ų | 76.8 | 22% | 0.222 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -67.4 | -50.5 | 170.3 | 175.1 | 87.6 | 0 | 0 | 0 | 110.6 | C195 C198 Q207 L208 Q209 S213 G214 H217 | C195-H211 PolarHBondContact SG-NE2 2.97Å; C195-H211 VanDerWaalsContact SG-NE2 3.37Å; C198-H211 WeakPolarHBondContact CB-NE2 3.34Å; C198-H211 PolarHBondContact SG-NE2 3.13Å; C198-H211 VanDerWaalsContact SG-NE2 3.42Å; Q207-H211 VanDerWaalsContact O-CB 3.28Å; Q207-H211 WeakPolarHBondContact O-CB 3.38Å; Q207-H211 PolarHBondContact O-N 3.47Å; L208-H211 WeakPolarHBondContact O-CB 3.4Å; L208-H211 PolarHBondContact O-N 3.36Å; Q209-H211 VanDerWaalsContact C-N 3.33Å; Q209-H211 PolarHBondContact O-N 2.82Å; H211-S213 PolarHBondContact O-N 3.27Å; H211-G214 PolarHBondContact O-N 3.37Å; H211-H217 AromaticContact CD2-ND1 3.6Å; H211-H217 AromaticContact NE2-ND1 3.43Å; H211-H217 PolarHBondContact NE2-ND1 3.43Å; H211-H217 WeakPolarHBondContact O-CB 3.21Å |
| 212 | N | 92.2 | Very high | 91.2 | Very high | 61 Ų | 61 | 78.7 Ų | 78.7 | 33% | 0.326 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.5 | -37.3 | -177.3 | -68.8 | -5.8 | 0 | 0 | 0 | 112.5 | L208 Q209 G214 H217 | L208-N212 WeakPolarHBondContact O-CB 3.5Å; L208-N212 PolarHBondContact O-N 3.43Å; L208-N212 PolarHBondContact O-OD1 3.24Å; Q209-N212 PolarHBondContact O-N 3.47Å; N212-G214 VanDerWaalsContact C-N 3.29Å; N212-H217 PolarHBondContact O-CD2 3.37Å; N212-H217 PolarHBondContact OD1-CE1 2.87Å |
| 213 | S | 92.7 | Very high | 90.8 | Very high | 92 Ų | 92 | 81 Ų | 81 | 64% | 0.643 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.5 | -11.4 | 173.5 | 65.9 | 0 | 0 | 0 | 0 | 113.8 | Q209 A210 H211 | Q209-S213 PolarHBondContact O-N 3.48Å; Q209-S213 PolarHBondContact O-OG 3.43Å; Q209-S213 VanDerWaalsContact O-OG 3.09Å; A210-S213 PolarHBondContact O-OG 2.98Å; H211-S213 PolarHBondContact O-N 3.27Å |
| 214 | G | 93.6 | Very high | 90.1 | Very high | 25 Ų | 25 | 83.8 Ų | 83.8 | 26% | 0.258 | 46% | 0.462 | S | S | . | . | S | Bend | trans | -69.6 | 142.1 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113 | A210 H211 N212 K216 H217 K218 | A210-G214 PolarHBondContact O-N 3.42Å; H211-G214 PolarHBondContact O-N 3.37Å; N212-G214 VanDerWaalsContact C-N 3.29Å; G214-K216 PolarHBondContact O-N 3.29Å; G214-H217 PolarHBondContact O-N 2.96Å; G214-K218 PolarHBondContact O-N 3.45Å |
| 215 | T | 92 | Very high | 89.5 | Confident | 114 Ų | 114 | 85.6 Ų | 85.6 | 70% | 0.699 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -51.2 | -37.3 | -176.8 | -39.9 | 0 | 0 | 0 | 0 | 113.3 | T219 | T215-T219 HydrophobicContact CG2-CG2 4.44Å; T215-T219 WeakPolarHBondContact O-CG2 3.48Å; T215-T219 PolarHBondContact O-N 2.95Å; T215-T219 PolarHBondContact O-OG1 2.92Å |
| 216 | K | 89.6 | Confident | 88.5 | Confident | 180 Ų | 180 | 85.5 Ų | 85.5 | 78% | 0.783 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -65.5 | -41.3 | 178.8 | -65.7 | -176.8 | 178.6 | -178.4 | 0 | 113 | G214 T219 M220 | G214-K216 PolarHBondContact O-N 3.29Å; K216-T219 PolarHBondContact O-OG1 3.04Å; K216-M220 WeakPolarHBondContact O-CB 2.84Å; K216-M220 VanDerWaalsContact O-CG 3.24Å; K216-M220 WeakPolarHBondContact O-CG 3.39Å; K216-M220 PolarHBondContact O-N 2.8Å |
| 217 | H | 92.8 | Very high | 86.9 | Confident | 13 Ų | 13 | 90 Ų | 90 | 6% | 0.06 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -71.5 | -48 | 176.4 | 179.9 | 98.2 | 0 | 0 | 0 | 109.7 | C195 H211 N212 G214 T219 M220 L221 | C195-H217 PolarHBondContact SG-CE1 3.38Å; C195-H217 PolarHBondContact SG-ND1 2.97Å; H211-H217 AromaticContact CD2-ND1 3.6Å; H211-H217 AromaticContact NE2-ND1 3.43Å; H211-H217 PolarHBondContact NE2-ND1 3.43Å; H211-H217 WeakPolarHBondContact O-CB 3.21Å; N212-H217 PolarHBondContact O-CD2 3.37Å; N212-H217 PolarHBondContact OD1-CE1 2.87Å; G214-H217 PolarHBondContact O-N 2.96Å; H217-T219 PolarHBondContact O-N 3.13Å; H217-M220 CarbonylContact O-C 3.49Å; H217-M220 WeakPolarHBondContact O-CB 3.33Å; H217-M220 PolarHBondContact O-N 2.86Å; H217-L221 WeakPolarHBondContact O-CB 3.4Å; H217-L221 PolarHBondContact O-N 2.86Å |
| 218 | K | 90.9 | Very high | 84.7 | Confident | 118 Ų | 118 | 88.9 Ų | 88.9 | 51% | 0.513 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -54 | -49.2 | 178.8 | -179.2 | 169.9 | 174.5 | 171.9 | 0 | 112.8 | G214 M220 L221 E222 | G214-K218 PolarHBondContact O-N 3.45Å; K218-M220 VanDerWaalsContact C-N 3.31Å; K218-M220 PolarHBondContact O-N 2.85Å; K218-L221 WeakPolarHBondContact O-CB 3.24Å; K218-L221 PolarHBondContact O-N 2.69Å; K218-E222 WeakPolarHBondContact CE-OE1 3.1Å; K218-E222 HydrophobicContact CG-CG 4.45Å; K218-E222 IonicContact NZ-OE1 2.98Å; K218-E222 WeakPolarHBondContact O-CG 3.44Å; K218-E222 PolarHBondContact O-N 2.84Å |
| 219 | T | 89.1 | Confident | 82.3 | Confident | 71 Ų | 71 | 92.7 Ų | 92.7 | 44% | 0.436 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -66.4 | -31.9 | 178.3 | 53.1 | 0 | 0 | 0 | 0 | 113.3 | T215 K216 H217 A223 | T215-T219 HydrophobicContact CG2-CG2 4.44Å; T215-T219 WeakPolarHBondContact O-CG2 3.48Å; T215-T219 PolarHBondContact O-N 2.95Å; T215-T219 PolarHBondContact O-OG1 2.92Å; K216-T219 PolarHBondContact O-OG1 3.04Å; H217-T219 PolarHBondContact O-N 3.13Å; T219-A223 VanDerWaalsContact O-CB 3.3Å; T219-A223 WeakPolarHBondContact O-CB 3.37Å; T219-A223 PolarHBondContact O-N 2.78Å |
| 220 | M | 87.5 | Confident | 80.4 | Confident | 108 Ų | 108 | 93.6 Ų | 93.6 | 53% | 0.532 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -73.2 | -33 | 175.2 | -76.5 | -61 | -51.5 | 0 | 0 | 112.2 | K216 H217 K218 R224 | K216-M220 WeakPolarHBondContact O-CB 2.84Å; K216-M220 VanDerWaalsContact O-CG 3.24Å; K216-M220 WeakPolarHBondContact O-CG 3.39Å; K216-M220 PolarHBondContact O-N 2.8Å; H217-M220 CarbonylContact O-C 3.49Å; H217-M220 WeakPolarHBondContact O-CB 3.33Å; H217-M220 PolarHBondContact O-N 2.86Å; K218-M220 VanDerWaalsContact C-N 3.31Å; K218-M220 PolarHBondContact O-N 2.85Å; M220-R224 WeakPolarHBondContact O-CB 3.44Å; M220-R224 PolarHBondContact O-N 2.85Å |
| 221 | L | 87.6 | Confident | 78.1 | Confident | 66 Ų | 66 | 100.1 Ų | 100.1 | 35% | 0.346 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67.7 | -52.3 | 172.9 | -168.8 | 159.6 | 0 | 0 | 0 | 109.6 | L197 H217 K218 A223 R224 S225 | L197-L221 HydrophobicContact CD1-CB 3.84Å; L197-L221 HydrophobicContact CD1-CD1 3.77Å; L197-L221 HydrophobicContact CD1-CG 3.69Å; H217-L221 WeakPolarHBondContact O-CB 3.4Å; H217-L221 PolarHBondContact O-N 2.86Å; K218-L221 WeakPolarHBondContact O-CB 3.24Å; K218-L221 PolarHBondContact O-N 2.69Å; L221-A223 VanDerWaalsContact C-N 3.33Å; L221-A223 PolarHBondContact O-N 3.35Å; L221-R224 CarbonylContact O-C 3.4Å; L221-R224 PolarHBondContact O-N 2.64Å; L221-S225 WeakPolarHBondContact CD2-OG 3.28Å; L221-S225 WeakPolarHBondContact O-CB 3.29Å; L221-S225 PolarHBondContact O-N 3.41Å; L221-S225 PolarHBondContact O-OG 3.39Å |
| 222 | E | 84.9 | Confident | 75.8 | Confident | 110 Ų | 110 | 101.1 Ų | 101.1 | 51% | 0.514 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -55.8 | -43.5 | 177.2 | -71.4 | 165.5 | 165 | 0 | 0 | 112.6 | K218 R224 | K218-E222 WeakPolarHBondContact CE-OE1 3.1Å; K218-E222 HydrophobicContact CG-CG 4.45Å; K218-E222 IonicContact NZ-OE1 2.98Å; K218-E222 WeakPolarHBondContact O-CG 3.44Å; K218-E222 PolarHBondContact O-N 2.84Å; E222-R224 VanDerWaalsContact C-N 3.26Å; E222-R224 PolarHBondContact O-N 2.66Å |
| 223 | A | 83.4 | Confident | 73.3 | Confident | 84 Ų | 84 | 105.9 Ų | 105.9 | 69% | 0.694 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -69 | -20 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | T219 L221 | T219-A223 VanDerWaalsContact O-CB 3.3Å; T219-A223 WeakPolarHBondContact O-CB 3.37Å; T219-A223 PolarHBondContact O-N 2.78Å; L221-A223 VanDerWaalsContact C-N 3.33Å; L221-A223 PolarHBondContact O-N 3.35Å |
| 224 | R | 76.3 | Confident | 71.4 | Confident | 189 Ų | 189 | 107.4 Ų | 107.4 | 71% | 0.713 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -100.8 | -28.3 | 179.4 | -169.1 | -176.2 | 178.1 | -83 | 0.6 | 112.9 | M220 L221 E222 G226 | M220-R224 WeakPolarHBondContact O-CB 3.44Å; M220-R224 PolarHBondContact O-N 2.85Å; L221-R224 CarbonylContact O-C 3.4Å; L221-R224 PolarHBondContact O-N 2.64Å; E222-R224 VanDerWaalsContact C-N 3.26Å; E222-R224 PolarHBondContact O-N 2.66Å; R224-G226 PolarHBondContact O-N 3.08Å |
| 225 | S | 77.9 | Confident | 69.4 | Low | 69 Ų | 69 | 116.6 Ų | 116.6 | 48% | 0.483 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -66.8 | -20.3 | -176 | -80.1 | 0 | 0 | 0 | 0 | 113.7 | L221 D227 | L221-S225 WeakPolarHBondContact CD2-OG 3.28Å; L221-S225 WeakPolarHBondContact O-CB 3.29Å; L221-S225 PolarHBondContact O-N 3.41Å; L221-S225 PolarHBondContact O-OG 3.39Å; S225-D227 PolarHBondContact O-N 3.3Å |
| 226 | G | 69.3 | Low | 67.2 | Low | 67 Ų | 67 | 119.1 Ų | 119.1 | 69% | 0.691 | 64% | 0.641 | S | S | * | * | trans | 65.9 | -12.9 | 152.2 | 0 | 0 | 0 | 0 | 0 | 119.1 | R224 G228 | R224-G226 PolarHBondContact O-N 3.08Å; G226-G228 VanDerWaalsContact C-N 3.27Å; G226-G228 PolarHBondContact O-N 3.18Å | ||
| 227 | D | 58.6 | Low | 65 | Low | 174 Ų | 174 | 113.1 Ų | 113.1 | 93% | 0.93 | 63% | 0.63 | S | S | * | * | trans | -77.5 | 75.4 | -177.4 | -84.3 | -55.5 | 0 | 0 | 0 | 111.7 | S225 | S225-D227 PolarHBondContact O-N 3.3Š| ||
| 228 | G | 47 | Very low | 62.7 | Low | 65 Ų | 65 | 119.3 Ų | 119.3 | 67% | 0.67 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -154.5 | 64.4 | -178 | 0 | 0 | 0 | 0 | 0 | 111.6 | G226 | G226-G228 VanDerWaalsContact C-N 3.27Å; G226-G228 PolarHBondContact O-N 3.18Å |
| 229 | A | 41.6 | Very low | 60.4 | Low | 88 Ų | 88 | 122.9 Ų | 122.9 | 73% | 0.727 | 68% | 0.684 | S | S | * | * | trans | 31.9 | 106.5 | 167 | 0 | 0 | 0 | 0 | 0 | 117.8 | K231 | A229-K231 PolarHBondContact O-N 3.04Š| ||
| 230 | I | 52.2 | Low | 57.9 | Low | 164 Ų | 164 | 124.7 Ų | 124.7 | 84% | 0.841 | 70% | 0.7 | S | S | * | * | trans | -58.2 | 101.3 | 164.4 | -58.1 | 168.9 | 0 | 0 | 0 | 109.6 | ||||
| 231 | K | 46.8 | Very low | 55.5 | Low | 196 Ų | 196 | 129 Ų | 129 | 85% | 0.852 | 72% | 0.715 | S | S | * | * | trans | -106.9 | 81.3 | 157.5 | -76.9 | -174.1 | 177.2 | 177.5 | 0 | 108.9 | A229 | A229-K231 PolarHBondContact O-N 3.04Š| ||
| 232 | S | 45.9 | Very low | 53.1 | Low | 69 Ų | 69 | 134 Ų | 134 | 48% | 0.483 | 74% | 0.739 | S | S | . | * | trans | -62.7 | 156.6 | 160.3 | 42.5 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 233 | F | 40.3 | Very low | 50.8 | Low | 162 Ų | 162 | 133.5 Ų | 133.5 | 71% | 0.711 | 75% | 0.754 | S | S | * | * | trans | 82.5 | 145.6 | 173.8 | -44.7 | -59.1 | 0 | 0 | 0 | 115.3 | ||||
| 234 | P | 51.3 | Low | 49.1 | Very low | 123 Ų | 123 | 133.8 Ų | 133.8 | 80% | 0.799 | 76% | 0.756 | S | S | * | * | cis | -98.1 | 141 | 22.1 | -2.4 | 23.9 | 0 | 0 | 0 | 116.7 | I236 | P234-I236 PolarHBondContact O-N 3.24Š| ||
| 235 | R | 52.9 | Low | 48 | Very low | 218 Ų | 218 | 130.6 Ų | 130.6 | 82% | 0.823 | 76% | 0.76 | S | S | * | * | trans | -72.2 | 103.6 | 162.5 | -173.9 | -168 | -61.4 | -158 | 2.3 | 108.3 | G237 | R235-G237 PolarHBondContact O-N 3.46Š| ||
| 236 | I | 45.8 | Very low | 46 | Very low | 167 Ų | 167 | 133 Ų | 133 | 86% | 0.856 | 78% | 0.777 | S | S | * | * | trans | -73.3 | 111.6 | 171.7 | -81.7 | 171.4 | 0 | 0 | 0 | 108.9 | P234 | P234-I236 PolarHBondContact O-N 3.24Š| ||
| 237 | G | 42.1 | Very low | 45.1 | Very low | 55 Ų | 55 | 137.2 Ų | 137.2 | 57% | 0.567 | 78% | 0.779 | S | S | * | * | trans | -83.1 | 134.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | R235 | R235-G237 PolarHBondContact O-N 3.46Š| ||
| 238 | V | 46.3 | Very low | 44.3 | Very low | 142 Ų | 142 | 134.6 Ų | 134.6 | 86% | 0.861 | 77% | 0.771 | S | S | * | * | trans | 41.5 | 104.2 | 131.9 | -172.1 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 239 | K | 40.9 | Very low | 44.2 | Very low | 194 Ų | 194 | 135.7 Ų | 135.7 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | 172.1 | 138.4 | 129.9 | 62.3 | -167.6 | 177.8 | -174.5 | 0 | 108 | |||||
| 240 | S | 37.7 | Very low | 44.2 | Very low | 108 Ų | 108 | 138.3 Ų | 138.3 | 76% | 0.755 | 78% | 0.776 | S | S | * | * | cis | -155 | 158.7 | 15.7 | -51.9 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 241 | K | 35.8 | Very low | 43.7 | Very low | 199 Ų | 199 | 133.8 Ų | 133.8 | 87% | 0.865 | 77% | 0.77 | S | S | * | * | trans | 69.5 | 91.5 | 138.3 | -156.8 | 166.9 | -175.2 | 177.2 | 0 | 121.1 | ||||
| 242 | M | 38.2 | Very low | 43.8 | Very low | 170 Ų | 170 | 131 Ų | 131 | 84% | 0.837 | 76% | 0.763 | S | S | * | * | 39.4 | 110.6 | 128.8 | -176.1 | 59.2 | 155.2 | 0 | 0 | 120.8 | |||||
| 243 | A | 36.5 | Very low | 43.9 | Very low | 100 Ų | 100 | 135.4 Ų | 135.4 | 83% | 0.826 | 78% | 0.776 | S | S | * | * | trans | -153.7 | 157.8 | 136.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 244 | A | 47 | Very low | 44.4 | Very low | 91 Ų | 91 | 132.1 Ų | 132.1 | 75% | 0.752 | 77% | 0.766 | S | S | * | * | trans | -91.4 | 170.8 | -159.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 245 | P | 54.2 | Low | 45 | Very low | 121 Ų | 121 | 132.5 Ų | 132.5 | 79% | 0.786 | 76% | 0.755 | S | S | * | * | trans | -111.4 | 162.9 | -159.7 | 41.2 | -34.5 | 0 | 0 | 0 | 117.1 | ||||
| 246 | S | 35.8 | Very low | 46.1 | Very low | 120 Ų | 120 | 125.9 Ų | 125.9 | 84% | 0.839 | 74% | 0.739 | S | S | * | * | trans | -161.2 | 126.2 | 146.8 | 59.4 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 247 | E | 50.1 | Low | 47.8 | Very low | 156 Ų | 156 | 120 Ų | 120 | 73% | 0.729 | 71% | 0.707 | S | S | * | * | trans | -71.6 | 173.8 | -177.7 | -80.8 | -63.3 | 128.7 | 0 | 0 | 114.2 | S249 | E247-S249 PolarHBondContact OE2-N 2.95Š| ||
| 248 | P | 42 | Very low | 50.2 | Low | 119 Ų | 119 | 121.8 Ų | 121.8 | 77% | 0.773 | 70% | 0.7 | S | S | * | * | cis | -132.6 | 146.7 | 20.7 | 39.2 | -20.4 | 0 | 0 | 0 | 120.5 | ||||
| 249 | S | 45.8 | Very low | 52.4 | Low | 88 Ų | 88 | 115.3 Ų | 115.3 | 62% | 0.615 | 66% | 0.661 | S | S | * | * | trans | -11.7 | 127.4 | 149.1 | -175.6 | 0 | 0 | 0 | 0 | 118.6 | E247 | E247-S249 PolarHBondContact OE2-N 2.95Š| ||
| 250 | T | 40.6 | Very low | 54.8 | Low | 143 Ų | 143 | 112.9 Ų | 112.9 | 88% | 0.877 | 65% | 0.653 | S | S | * | * | trans | -127.6 | 110.9 | 134 | -64.5 | 0 | 0 | 0 | 0 | 107.4 | L252 | T250-L252 PolarHBondContact O-N 3.11Š| ||
| 251 | G | 42.1 | Very low | 57.2 | Low | 69 Ų | 69 | 112 Ų | 112 | 71% | 0.711 | 64% | 0.639 | S | S | * | * | trans | -70.2 | 97 | -167.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 252 | L | 48.1 | Very low | 59.7 | Low | 137 Ų | 137 | 103.3 Ų | 103.3 | 72% | 0.717 | 60% | 0.603 | S | S | * | * | trans | -142.3 | 137.8 | 147 | -147.4 | 85.5 | 0 | 0 | 0 | 108.6 | T250 N254 | T250-L252 PolarHBondContact O-N 3.11Å; L252-N254 PolarHBondContact O-N 3.19Å | ||
| 253 | Q | 49.1 | Very low | 62.1 | Low | 162 Ų | 162 | 101.8 Ų | 101.8 | 76% | 0.757 | 60% | 0.598 | S | S | * | * | trans | -72.6 | 78.6 | 175 | -67.2 | 178.9 | 4.3 | 0 | 0 | 109.3 | K255 | Q253-K255 VanDerWaalsContact O-CG 3.27Å; Q253-K255 WeakPolarHBondContact O-CG 3.44Å; Q253-K255 PolarHBondContact O-N 2.96Å | ||
| 254 | N | 49.9 | Very low | 64.6 | Low | 92 Ų | 92 | 99.6 Ų | 99.6 | 49% | 0.492 | 58% | 0.575 | S | S | . | * | trans | -68.8 | 80.8 | 174.9 | -66.5 | -11.2 | 0 | 0 | 0 | 108.2 | L252 T256 | L252-N254 PolarHBondContact O-N 3.19Å; N254-T256 PolarHBondContact O-N 3.33Å; N254-T256 PolarHBondContact O-OG1 2.88Å | ||
| 255 | K | 64.1 | Low | 66.7 | Low | 132 Ų | 132 | 101.4 Ų | 101.4 | 57% | 0.574 | 57% | 0.567 | S | S | * | * | trans | -58.9 | 91.5 | 159.1 | -3.7 | -179.3 | 179.5 | -66 | 0 | 104.6 | Q253 F257 | Q253-K255 VanDerWaalsContact O-CG 3.27Å; Q253-K255 WeakPolarHBondContact O-CG 3.44Å; Q253-K255 PolarHBondContact O-N 2.96Å; K255-F257 HydrophobicContact CB-CE2 4.16Å; K255-F257 HydrophobicContact CB-CZ 4.14Å; K255-F257 HydrophobicContact CD-CZ 4.09Å; K255-F257 HydrophobicContact CG-CE2 4.42Å; K255-F257 HydrophobicContact CG-CZ 4.36Å; K255-F257 WeakPolarHBondContact O-CD2 3.4Å; K255-F257 WeakPolarHBondContact O-CE2 3.06Å; K255-F257 PolarHBondContact O-N 3.41Å; K255-F257 VanDerWaalsContact O-N 3.1Å | ||
| 256 | T | 75.7 | Confident | 68.4 | Low | 78 Ų | 78 | 96.6 Ų | 96.6 | 48% | 0.479 | 54% | 0.535 | S | S | . | . | trans | -69.8 | 111.3 | -177 | -57.3 | 0 | 0 | 0 | 0 | 107 | N254 H258 H265 | N254-T256 PolarHBondContact O-N 3.33Å; N254-T256 PolarHBondContact O-OG1 2.88Å; T256-H258 PolarHBondContact O-N 3.36Å; T256-H265 HydrophobicContact CG2-CB 3.72Å | ||
| 257 | F | 81.9 | Confident | 70.9 | Confident | 44 Ų | 44 | 96.6 Ų | 96.6 | 19% | 0.193 | 53% | 0.526 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.7 | 106 | -174 | -71.9 | -81.6 | 0 | 0 | 0 | 108.3 | K255 V266 E269 L272 | K255-F257 HydrophobicContact CB-CE2 4.16Å; K255-F257 HydrophobicContact CB-CZ 4.14Å; K255-F257 HydrophobicContact CD-CZ 4.09Å; K255-F257 HydrophobicContact CG-CE2 4.42Å; K255-F257 HydrophobicContact CG-CZ 4.36Å; K255-F257 WeakPolarHBondContact O-CD2 3.4Å; K255-F257 WeakPolarHBondContact O-CE2 3.06Å; K255-F257 PolarHBondContact O-N 3.41Å; K255-F257 VanDerWaalsContact O-N 3.1Å; F257-V266 HydrophobicContact CB-CG2 4.21Å; F257-V266 PolarHBondContact N-O 2.86Å; F257-V266 VanDerWaalsContact N-O 3.09Å; F257-V266 WeakPolarHBondContact O-CG2 3.41Å; F257-V266 PolarHBondContact O-N 2.72Å; F257-E269 HydrophobicContact CD1-CB 4.12Å; F257-E269 HydrophobicContact CD1-CG 4.08Å; F257-E269 HydrophobicContact CD2-CB 4.23Å; F257-E269 HydrophobicContact CE1-CB 3.66Å; F257-E269 HydrophobicContact CE1-CG 3.6Å; F257-E269 HydrophobicContact CE2-CB 3.79Å; F257-E269 VanDerWaalsContact CE2-N 3.27Å; F257-E269 HydrophobicContact CG-CB 4.38Å; F257-E269 HydrophobicContact CZ-CB 3.48Å; F257-E269 VanDerWaalsContact CZ-CB 3.48Å; F257-E269 HydrophobicContact CZ-CG 3.91Å; F257-L272 HydrophobicContact CB-CB 3.76Å; F257-L272 HydrophobicContact CB-CD2 3.75Å; F257-L272 HydrophobicContact CB-CG 4.24Å; F257-L272 HydrophobicContact CD1-CD2 4.16Å; F257-L272 HydrophobicContact CG-CB 4.49Å; F257-L272 HydrophobicContact CG-CD2 4.42Å |
| 258 | H | 91.6 | Very high | 72.7 | Confident | 92 Ų | 92 | 91.4 Ų | 91.4 | 43% | 0.426 | 51% | 0.507 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.9 | 148.4 | -177.1 | 72.2 | -63.8 | 0 | 0 | 0 | 111.4 | T256 E260 | T256-H258 PolarHBondContact O-N 3.36Å; H258-E260 VanDerWaalsContact CD2-CG 3.42Å; H258-E260 WeakPolarHBondContact CD2-CG 3.28Å; H258-E260 IonicContact CD2-OE1 3.89Å; H258-E260 IonicContact CE1-OE1 3.76Å; H258-E260 WeakPolarHBondContact NE2-CG 3.5Å; H258-E260 IonicContact NE2-OE1 2.6Å; H258-E260 PolarHBondContact NE2-OE1 2.85Å |
| 259 | C | 92.7 | Very high | 75 | Confident | 6 Ų | 6 | 90 Ų | 90 | 4% | 0.041 | 49% | 0.49 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.9 | 100.2 | 172.8 | -179.7 | 0 | 0 | 0 | 0 | 110.1 | I261 C262 D263 V264 L272 H275 H281 | C259-I261 VanDerWaalsContact C-N 3.27Å; C259-I261 PolarHBondContact O-N 2.84Å; C259-C262 HydrophobicContact CB-CB 4.48Å; C259-C262 CarbonylContact O-C 3.57Å; C259-C262 PolarHBondContact O-N 2.84Å; C259-C262 VanDerWaalsContact O-N 3.09Å; C259-D263 WeakPolarHBondContact O-CA 3.34Å; C259-D263 PolarHBondContact O-N 3.23Å; C259-V264 PolarHBondContact N-O 2.93Å; C259-V264 PolarHBondContact O-N 3.06Å; C259-L272 HydrophobicContact CB-CD1 3.71Å; C259-H275 PolarHBondContact SG-CD2 3.15Å; C259-H275 PolarHBondContact SG-NE2 2.97Å; C259-H281 PolarHBondContact SG-CE1 2.83Å; C259-H281 PolarHBondContact SG-ND1 2.98Å |
| 260 | E | 91.1 | Very high | 77.2 | Confident | 144 Ų | 144 | 90.9 Ų | 90.9 | 67% | 0.673 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.3 | -31.6 | -177.7 | -61.2 | 172.8 | -177.2 | 0 | 0 | 113.2 | H258 C262 | H258-E260 VanDerWaalsContact CD2-CG 3.42Å; H258-E260 WeakPolarHBondContact CD2-CG 3.28Å; H258-E260 IonicContact CD2-OE1 3.89Å; H258-E260 IonicContact CE1-OE1 3.76Å; H258-E260 WeakPolarHBondContact NE2-CG 3.5Å; H258-E260 IonicContact NE2-OE1 2.6Å; H258-E260 PolarHBondContact NE2-OE1 2.85Å; E260-C262 PolarHBondContact O-N 2.91Å |
| 261 | I | 88.5 | Confident | 79.6 | Confident | 90 Ų | 90 | 88.4 Ų | 88.4 | 46% | 0.462 | 47% | 0.47 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | -14.8 | 179.7 | -58.7 | 176.8 | 0 | 0 | 0 | 112.1 | C259 R284 A285 | C259-I261 VanDerWaalsContact C-N 3.27Å; C259-I261 PolarHBondContact O-N 2.84Å; I261-R284 HydrophobicContact CG2-CB 4.01Å; I261-A285 HydrophobicContact CD1-CB 3.85Å; I261-A285 HydrophobicContact CG2-CB 4.15Å |
| 262 | C | 89.1 | Confident | 82 | Confident | 16 Ų | 16 | 86.2 Ų | 86.2 | 11% | 0.108 | 44% | 0.442 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -131.8 | -4 | -175.6 | -69.2 | 0 | 0 | 0 | 0 | 114.5 | C259 E260 V264 H275 R284 | C259-C262 HydrophobicContact CB-CB 4.48Å; C259-C262 CarbonylContact O-C 3.57Å; C259-C262 PolarHBondContact O-N 2.84Å; C259-C262 VanDerWaalsContact O-N 3.09Å; E260-C262 PolarHBondContact O-N 2.91Å; C262-V264 HydrophobicContact CB-CG2 3.97Å; C262-V264 WeakPolarHBondContact O-CG2 3.3Å; C262-V264 PolarHBondContact O-N 2.66Å; C262-H275 WeakPolarHBondContact CB-NE2 3.26Å; C262-H275 PolarHBondContact SG-NE2 3.14Å; C262-R284 WeakPolarHBondContact SG-CD 3.14Å; C262-R284 PolarHBondContact SG-NH1 3.08Å |
| 263 | D | 89.1 | Confident | 84.2 | Confident | 137 Ų | 137 | 85.7 Ų | 85.7 | 73% | 0.733 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 46.9 | 37.8 | -169.3 | -60.3 | -49.2 | 0 | 0 | 0 | 114.3 | C259 | C259-D263 WeakPolarHBondContact O-CA 3.34Å; C259-D263 PolarHBondContact O-N 3.23Å |
| 264 | V | 88.5 | Confident | 86.4 | Confident | 55 Ų | 55 | 84.6 Ų | 84.6 | 33% | 0.333 | 43% | 0.429 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.2 | 128.3 | 178.7 | -174.9 | 0 | 0 | 0 | 0 | 110.6 | C259 C262 V266 | C259-V264 PolarHBondContact N-O 2.93Å; C259-V264 PolarHBondContact O-N 3.06Å; C262-V264 HydrophobicContact CB-CG2 3.97Å; C262-V264 WeakPolarHBondContact O-CG2 3.3Å; C262-V264 PolarHBondContact O-N 2.66Å; V264-V266 HydrophobicContact CG1-CG1 4.2Å |
| 265 | H | 91.1 | Very high | 88.5 | Confident | 129 Ų | 129 | 82.1 Ų | 82.1 | 60% | 0.597 | 42% | 0.415 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -96.4 | 130.9 | 170.1 | -66.5 | 81.9 | 0 | 0 | 0 | 109.5 | T256 | T256-H265 HydrophobicContact CG2-CB 3.72Å |
| 266 | V | 90.4 | Very high | 90 | Very high | 19 Ų | 19 | 79.6 Ų | 79.6 | 12% | 0.115 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.6 | 152.7 | 179.3 | -82.8 | 0 | 0 | 0 | 0 | 111.2 | F257 V264 Q271 L272 | F257-V266 HydrophobicContact CB-CG2 4.21Å; F257-V266 PolarHBondContact N-O 2.86Å; F257-V266 VanDerWaalsContact N-O 3.09Å; F257-V266 WeakPolarHBondContact O-CG2 3.41Å; F257-V266 PolarHBondContact O-N 2.72Å; V264-V266 HydrophobicContact CG1-CG1 4.2Å; V266-Q271 HydrophobicContact CB-CB 4.2Å; V266-Q271 HydrophobicContact CB-CG 3.96Å; V266-Q271 HydrophobicContact CG1-CG 3.84Å; V266-L272 HydrophobicContact CG2-CB 3.66Å; V266-L272 HydrophobicContact CG2-CD1 3.87Å; V266-L272 HydrophobicContact CG2-CG 4.35Å |
| 267 | N | 86.9 | Confident | 90.8 | Very high | 120 Ų | 120 | 80.2 Ų | 80.2 | 64% | 0.642 | 41% | 0.414 | S | S | * | . | S | Bend | trans | -79.4 | -22.4 | -165.2 | -172.7 | -84.1 | 0 | 0 | 0 | 112.9 | ||
| 268 | S | 88.8 | Confident | 91.4 | Very high | 47 Ų | 47 | 80 Ų | 80 | 33% | 0.329 | 42% | 0.418 | S | S | . | . | S | Bend | trans | -137.4 | 154.4 | 179.7 | 73.3 | 0 | 0 | 0 | 0 | 113.8 | T270 Q271 L272 | S268-T270 VanDerWaalsContact C-N 3.25Å; S268-T270 PolarHBondContact O-N 3.41Å; S268-Q271 WeakPolarHBondContact O-CB 3.09Å; S268-Q271 PolarHBondContact O-N 3.17Å; S268-Q271 WeakPolarHBondContact OG-CB 3.19Å; S268-Q271 PolarHBondContact OG-N 2.83Å; S268-L272 PolarHBondContact O-N 3.45Å |
| 269 | E | 89.3 | Confident | 91.5 | Very high | 91 Ų | 91 | 85.1 Ų | 85.1 | 43% | 0.425 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -58.7 | -39.6 | 178.1 | -163.1 | -177 | 144.5 | 0 | 0 | 111.5 | F257 Q271 L272 K273 | F257-E269 HydrophobicContact CD1-CB 4.12Å; F257-E269 HydrophobicContact CD1-CG 4.08Å; F257-E269 HydrophobicContact CD2-CB 4.23Å; F257-E269 HydrophobicContact CE1-CB 3.66Å; F257-E269 HydrophobicContact CE1-CG 3.6Å; F257-E269 HydrophobicContact CE2-CB 3.79Å; F257-E269 VanDerWaalsContact CE2-N 3.27Å; F257-E269 HydrophobicContact CG-CB 4.38Å; F257-E269 HydrophobicContact CZ-CB 3.48Å; F257-E269 VanDerWaalsContact CZ-CB 3.48Å; F257-E269 HydrophobicContact CZ-CG 3.91Å; E269-Q271 VanDerWaalsContact C-N 3.32Å; E269-Q271 PolarHBondContact O-N 2.79Å; E269-L272 PolarHBondContact O-N 3.44Å; E269-K273 HydrophobicContact CG-CD 4.48Å; E269-K273 WeakPolarHBondContact O-CG 3.44Å; E269-K273 PolarHBondContact O-N 3.5Å; E269-K273 WeakPolarHBondContact OE1-CE 3.3Å; E269-K273 IonicContact OE1-NZ 2.64Å; E269-K273 PolarHBondContact OE1-NZ 3.07Å |
| 270 | T | 91.9 | Very high | 91.3 | Very high | 106 Ų | 106 | 95 Ų | 95 | 65% | 0.65 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -63.1 | -39.9 | 176.2 | -45.8 | 0 | 0 | 0 | 0 | 111.3 | S268 L272 K273 Q274 | S268-T270 VanDerWaalsContact C-N 3.25Å; S268-T270 PolarHBondContact O-N 3.41Å; T270-L272 VanDerWaalsContact C-N 3.34Å; T270-K273 PolarHBondContact O-N 3.23Å; T270-Q274 WeakPolarHBondContact O-CB 3.43Å; T270-Q274 PolarHBondContact O-N 3.16Å |
| 271 | Q | 91 | Very high | 91.4 | Very high | 90 Ų | 90 | 88.7 Ų | 88.7 | 42% | 0.421 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -68.7 | -33.6 | 176.3 | -164.9 | 176 | 53.4 | 0 | 0 | 111.4 | V266 S268 E269 H275 | V266-Q271 HydrophobicContact CB-CB 4.2Å; V266-Q271 HydrophobicContact CB-CG 3.96Å; V266-Q271 HydrophobicContact CG1-CG 3.84Å; S268-Q271 WeakPolarHBondContact O-CB 3.09Å; S268-Q271 PolarHBondContact O-N 3.17Å; S268-Q271 WeakPolarHBondContact OG-CB 3.19Å; S268-Q271 PolarHBondContact OG-N 2.83Å; E269-Q271 VanDerWaalsContact C-N 3.32Å; E269-Q271 PolarHBondContact O-N 2.79Å; Q271-H275 WeakPolarHBondContact O-CB 3.48Å; Q271-H275 PolarHBondContact O-N 2.91Å |
| 272 | L | 94.2 | Very high | 91.6 | Very high | 23 Ų | 23 | 91.5 Ų | 91.5 | 12% | 0.12 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -68.9 | -46.2 | 170.4 | -175.2 | 65.4 | 0 | 0 | 0 | 112.1 | F257 C259 V266 S268 E269 T270 Q274 H275 I276 | F257-L272 HydrophobicContact CB-CB 3.76Å; F257-L272 HydrophobicContact CB-CD2 3.75Å; F257-L272 HydrophobicContact CB-CG 4.24Å; F257-L272 HydrophobicContact CD1-CD2 4.16Å; F257-L272 HydrophobicContact CG-CB 4.49Å; F257-L272 HydrophobicContact CG-CD2 4.42Å; C259-L272 HydrophobicContact CB-CD1 3.71Å; V266-L272 HydrophobicContact CG2-CB 3.66Å; V266-L272 HydrophobicContact CG2-CD1 3.87Å; V266-L272 HydrophobicContact CG2-CG 4.35Å; S268-L272 PolarHBondContact O-N 3.45Å; E269-L272 PolarHBondContact O-N 3.44Å; T270-L272 VanDerWaalsContact C-N 3.34Å; L272-Q274 VanDerWaalsContact C-N 3.27Å; L272-Q274 PolarHBondContact O-N 3.31Å; L272-H275 CarbonylContact O-C 3.55Å; L272-H275 WeakPolarHBondContact O-CA 3.43Å; L272-H275 WeakPolarHBondContact O-CB 3.4Å; L272-H275 PolarHBondContact O-N 3.34Å; L272-H275 VanDerWaalsContact O-N 3.08Å; L272-I276 HydrophobicContact CD1-CD1 4.05Å; L272-I276 HydrophobicContact CD1-CG1 4.21Å; L272-I276 HydrophobicContact CD2-CD1 4.16Å; L272-I276 HydrophobicContact CG-CD1 3.72Å; L272-I276 HydrophobicContact CG-CG1 4.28Å; L272-I276 WeakPolarHBondContact O-CB 3.48Å; L272-I276 VanDerWaalsContact O-CG1 3.32Å; L272-I276 WeakPolarHBondContact O-CG1 3.4Å; L272-I276 PolarHBondContact O-N 2.85Å |
| 273 | K | 92.8 | Very high | 91.7 | Very high | 126 Ų | 126 | 94.3 Ų | 94.3 | 55% | 0.548 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -60.2 | -37.8 | 175.8 | -73.1 | 175.6 | -177.9 | 172 | 0 | 111.6 | E269 T270 S277 | E269-K273 HydrophobicContact CG-CD 4.48Å; E269-K273 WeakPolarHBondContact O-CG 3.44Å; E269-K273 PolarHBondContact O-N 3.5Å; E269-K273 WeakPolarHBondContact OE1-CE 3.3Å; E269-K273 IonicContact OE1-NZ 2.64Å; E269-K273 PolarHBondContact OE1-NZ 3.07Å; T270-K273 PolarHBondContact O-N 3.23Å; K273-S277 WeakPolarHBondContact O-CB 3.37Å; K273-S277 PolarHBondContact O-N 2.96Å; K273-S277 PolarHBondContact O-OG 2.88Å |
| 274 | Q | 95 | Very high | 91.7 | Very high | 140 Ų | 140 | 93.7 Ų | 93.7 | 65% | 0.654 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -69.5 | -37.6 | 172.9 | -168.9 | 178.4 | 8.6 | 0 | 0 | 112.5 | T270 L272 S277 S278 | T270-Q274 WeakPolarHBondContact O-CB 3.43Å; T270-Q274 PolarHBondContact O-N 3.16Å; L272-Q274 VanDerWaalsContact C-N 3.27Å; L272-Q274 PolarHBondContact O-N 3.31Å; Q274-S277 WeakPolarHBondContact CA-OG 3.49Å; Q274-S277 PolarHBondContact O-OG 2.72Å; Q274-S278 PolarHBondContact O-N 3.32Å; Q274-S278 VanDerWaalsContact O-N 3.16Å |
| 275 | H | 95.4 | Very high | 91.7 | Very high | 40 Ų | 40 | 93.6 Ų | 93.6 | 19% | 0.185 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -61.6 | -50.6 | 171.9 | 175.1 | 94.5 | 0 | 0 | 0 | 111.3 | C259 C262 Q271 L272 S277 S278 H281 | C259-H275 PolarHBondContact SG-CD2 3.15Å; C259-H275 PolarHBondContact SG-NE2 2.97Å; C262-H275 WeakPolarHBondContact CB-NE2 3.26Å; C262-H275 PolarHBondContact SG-NE2 3.14Å; Q271-H275 WeakPolarHBondContact O-CB 3.48Å; Q271-H275 PolarHBondContact O-N 2.91Å; L272-H275 CarbonylContact O-C 3.55Å; L272-H275 WeakPolarHBondContact O-CA 3.43Å; L272-H275 WeakPolarHBondContact O-CB 3.4Å; L272-H275 PolarHBondContact O-N 3.34Å; L272-H275 VanDerWaalsContact O-N 3.08Å; H275-S277 PolarHBondContact O-N 3.45Å; H275-S278 WeakPolarHBondContact O-CB 3.49Å; H275-S278 PolarHBondContact O-N 3.18Å; H275-S278 VanDerWaalsContact O-N 3.07Å; H275-S278 PolarHBondContact O-OG 2.71Å; H275-H281 AromaticContact CD2-ND1 3.43Å; H275-H281 PolarHBondContact CD2-ND1 2.78Å; H275-H281 AromaticContact NE2-CG 3.99Å; H275-H281 AromaticContact NE2-ND1 3.28Å; H275-H281 PolarHBondContact NE2-ND1 3.26Å; H275-H281 WeakPolarHBondContact O-CB 3.5Å |
| 276 | I | 94.6 | Very high | 91.5 | Very high | 79 Ų | 79 | 90.5 Ų | 90.5 | 41% | 0.405 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.2 | -43 | -177.6 | -68.3 | 170.1 | 0 | 0 | 0 | 111.5 | L272 S278 H281 | L272-I276 HydrophobicContact CD1-CD1 4.05Å; L272-I276 HydrophobicContact CD1-CG1 4.21Å; L272-I276 HydrophobicContact CD2-CD1 4.16Å; L272-I276 HydrophobicContact CG-CD1 3.72Å; L272-I276 HydrophobicContact CG-CG1 4.28Å; L272-I276 WeakPolarHBondContact O-CB 3.48Å; L272-I276 VanDerWaalsContact O-CG1 3.32Å; L272-I276 WeakPolarHBondContact O-CG1 3.4Å; L272-I276 PolarHBondContact O-N 2.85Å; I276-S278 PolarHBondContact O-N 3.33Å; I276-H281 PolarHBondContact O-CD2 3.22Å |
| 277 | S | 93.7 | Very high | 90.7 | Very high | 91 Ų | 91 | 92.7 Ų | 92.7 | 64% | 0.636 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -72.7 | -10.6 | 175.5 | 55.6 | 0 | 0 | 0 | 0 | 114.1 | K273 Q274 H275 | K273-S277 WeakPolarHBondContact O-CB 3.37Å; K273-S277 PolarHBondContact O-N 2.96Å; K273-S277 PolarHBondContact O-OG 2.88Å; Q274-S277 WeakPolarHBondContact CA-OG 3.49Å; Q274-S277 PolarHBondContact O-OG 2.72Å; H275-S277 PolarHBondContact O-N 3.45Å |
| 278 | S | 93.9 | Very high | 89.7 | Confident | 39 Ų | 39 | 93.7 Ų | 93.7 | 27% | 0.273 | 48% | 0.478 | S | S | . | . | S | Bend | trans | -66.3 | 143.1 | 177.9 | 82.1 | 0 | 0 | 0 | 0 | 111.7 | Q274 H275 I276 R280 H281 K282 | Q274-S278 PolarHBondContact O-N 3.32Å; Q274-S278 VanDerWaalsContact O-N 3.16Å; H275-S278 WeakPolarHBondContact O-CB 3.49Å; H275-S278 PolarHBondContact O-N 3.18Å; H275-S278 VanDerWaalsContact O-N 3.07Å; H275-S278 PolarHBondContact O-OG 2.71Å; I276-S278 PolarHBondContact O-N 3.33Å; S278-R280 PolarHBondContact O-N 3.38Å; S278-R280 VanDerWaalsContact O-N 3.12Å; S278-H281 PolarHBondContact O-N 3.49Å; S278-H281 VanDerWaalsContact O-N 3.09Å; S278-H281 PolarHBondContact OG-N 3.16Å; S278-K282 PolarHBondContact O-N 3.09Å |
| 279 | R | 93 | Very high | 88.5 | Confident | 200 Ų | 200 | 97 Ų | 97 | 76% | 0.755 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -51.5 | -38 | 175.5 | -179 | 173.9 | 178.8 | 173.8 | 4.5 | 112.6 | K282 D283 | R279-K282 PolarHBondContact O-N 2.73Å; R279-D283 WeakPolarHBondContact CG-OD2 3.48Å; R279-D283 IonicContact NE-OD2 2.66Å; R279-D283 WeakPolarHBondContact O-CB 2.99Å; R279-D283 PolarHBondContact O-N 2.82Å |
| 280 | R | 90 | Very high | 87.2 | Confident | 212 Ų | 212 | 96.4 Ų | 96.4 | 80% | 0.8 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67 | -38.8 | -179.2 | -66.6 | -175.5 | 178.1 | -146.5 | -0.5 | 113.2 | S278 R284 | S278-R280 PolarHBondContact O-N 3.38Å; S278-R280 VanDerWaalsContact O-N 3.12Å; R280-R284 WeakPolarHBondContact O-CG 3.17Å; R280-R284 PolarHBondContact O-N 3.01Å |
| 281 | H | 93.3 | Very high | 85.7 | Confident | 12 Ų | 12 | 100.6 Ų | 100.6 | 6% | 0.056 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -70.5 | -47.7 | 173.1 | 177.2 | 99.8 | 0 | 0 | 0 | 110.2 | C259 H275 I276 S278 D283 R284 A285 | C259-H281 PolarHBondContact SG-CE1 2.83Å; C259-H281 PolarHBondContact SG-ND1 2.98Å; H275-H281 AromaticContact CD2-ND1 3.43Å; H275-H281 PolarHBondContact CD2-ND1 2.78Å; H275-H281 AromaticContact NE2-CG 3.99Å; H275-H281 AromaticContact NE2-ND1 3.28Å; H275-H281 PolarHBondContact NE2-ND1 3.26Å; H275-H281 WeakPolarHBondContact O-CB 3.5Å; I276-H281 PolarHBondContact O-CD2 3.22Å; S278-H281 PolarHBondContact O-N 3.49Å; S278-H281 VanDerWaalsContact O-N 3.09Å; S278-H281 PolarHBondContact OG-N 3.16Å; H281-D283 VanDerWaalsContact C-N 3.3Å; H281-D283 PolarHBondContact O-N 3.37Å; H281-R284 PolarHBondContact O-N 3.28Å; H281-A285 WeakPolarHBondContact O-CB 3.33Å; H281-A285 PolarHBondContact O-N 3.31Å |
| 282 | K | 92.6 | Very high | 84.7 | Confident | 150 Ų | 150 | 102.1 Ų | 102.1 | 65% | 0.652 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -57.5 | -39.8 | 179.1 | -169.1 | 173 | -177.4 | 175 | 0 | 113 | S278 R279 A286 | S278-K282 PolarHBondContact O-N 3.09Å; R279-K282 PolarHBondContact O-N 2.73Å; K282-A286 WeakPolarHBondContact O-CB 3.27Å; K282-A286 PolarHBondContact O-N 2.94Å; K282-A286 VanDerWaalsContact O-N 3.1Å |
| 283 | D | 90.2 | Very high | 82.8 | Confident | 74 Ų | 74 | 110.8 Ų | 110.8 | 40% | 0.396 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -66.8 | -33.9 | 176.4 | -73.8 | -29 | 0 | 0 | 0 | 112.5 | R279 H281 | R279-D283 WeakPolarHBondContact CG-OD2 3.48Å; R279-D283 IonicContact NE-OD2 2.66Å; R279-D283 WeakPolarHBondContact O-CB 2.99Å; R279-D283 PolarHBondContact O-N 2.82Å; H281-D283 VanDerWaalsContact C-N 3.3Å; H281-D283 PolarHBondContact O-N 3.37Å |
| 284 | R | 89.1 | Confident | 81 | Confident | 125 Ų | 125 | 113.8 Ų | 113.8 | 47% | 0.472 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -75.6 | -43.3 | 174 | -72.4 | 172.5 | 172.9 | -165.7 | -6 | 112.4 | I261 C262 R280 H281 A286 G287 | I261-R284 HydrophobicContact CG2-CB 4.01Å; C262-R284 WeakPolarHBondContact SG-CD 3.14Å; C262-R284 PolarHBondContact SG-NH1 3.08Å; R280-R284 WeakPolarHBondContact O-CG 3.17Å; R280-R284 PolarHBondContact O-N 3.01Å; H281-R284 PolarHBondContact O-N 3.28Å; R284-A286 PolarHBondContact O-N 3.28Å; R284-G287 PolarHBondContact O-N 3.42Å; R284-G287 VanDerWaalsContact O-N 3.13Å |
| 285 | A | 88.3 | Confident | 79.3 | Confident | 53 Ų | 53 | 110.6 Ų | 110.6 | 44% | 0.438 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -61.8 | -29.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | I261 H281 G287 | I261-A285 HydrophobicContact CD1-CB 3.85Å; I261-A285 HydrophobicContact CG2-CB 4.15Å; H281-A285 WeakPolarHBondContact O-CB 3.33Å; H281-A285 PolarHBondContact O-N 3.31Å; A285-G287 PolarHBondContact O-N 3.38Å; A285-G287 VanDerWaalsContact O-N 3.08Å |
| 286 | A | 86.3 | Confident | 77.7 | Confident | 63 Ų | 63 | 114.3 Ų | 114.3 | 52% | 0.521 | 61% | 0.606 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -73.7 | 14.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | K282 R284 K288 | K282-A286 WeakPolarHBondContact O-CB 3.27Å; K282-A286 PolarHBondContact O-N 2.94Å; K282-A286 VanDerWaalsContact O-N 3.1Å; R284-A286 PolarHBondContact O-N 3.28Å; A286-K288 PolarHBondContact O-N 3.5Å |
| 287 | G | 74.7 | Confident | 75.6 | Confident | 66 Ų | 66 | 119.6 Ų | 119.6 | 68% | 0.68 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 66.8 | 6.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | R284 A285 P289 | R284-G287 PolarHBondContact O-N 3.42Å; R284-G287 VanDerWaalsContact O-N 3.13Å; A285-G287 PolarHBondContact O-N 3.38Å; A285-G287 VanDerWaalsContact O-N 3.08Å; G287-P289 WeakPolarHBondContact O-CD 3.5Å |
| 288 | K | 65.4 | Low | 73.4 | Confident | 141 Ų | 141 | 119.1 Ų | 119.1 | 61% | 0.613 | 62% | 0.624 | S | S | * | * | trans | -76 | 117 | 179.5 | -66.1 | 178.9 | -178.7 | 176.6 | 0 | 108.3 | A286 A290 | A286-K288 PolarHBondContact O-N 3.5Å; K288-A290 PolarHBondContact O-N 2.81Å | ||
| 289 | P | 64.6 | Low | 71.4 | Confident | 117 Ų | 117 | 123 Ų | 123 | 76% | 0.76 | 65% | 0.648 | S | S | * | * | trans | -58.1 | 133.5 | 178.6 | 23.9 | -33.1 | 0 | 0 | 0 | 108.9 | G287 K291 | G287-P289 WeakPolarHBondContact O-CD 3.5Å; P289-K291 PolarHBondContact O-N 3.07Å | ||
| 290 | A | 60.5 | Low | 69.4 | Low | 78 Ų | 78 | 119.1 Ų | 119.1 | 65% | 0.645 | 65% | 0.647 | S | S | * | * | trans | -59.1 | 111 | -176 | 0 | 0 | 0 | 0 | 0 | 109.4 | K288 | K288-A290 PolarHBondContact O-N 2.81Š| ||
| 291 | K | 61.7 | Low | 67.7 | Low | 193 Ų | 193 | 117.3 Ų | 117.3 | 84% | 0.839 | 65% | 0.648 | S | S | * | * | trans | -53.2 | 130.2 | 172.8 | -65 | -171.8 | 179.3 | -171.3 | 0 | 107.8 | P289 K293 | P289-K291 PolarHBondContact O-N 3.07Å; K291-K293 PolarHBondContact O-N 3.35Å | ||
| 292 | P | 68.8 | Low | 65.8 | Low | 123 Ų | 123 | 126.9 Ų | 126.9 | 80% | 0.799 | 68% | 0.683 | S | S | * | * | trans | -53.8 | 138.7 | -179.8 | 20.7 | -31.7 | 0 | 0 | 0 | 109.5 | F294 | P292-F294 PolarHBondContact O-N 3.05Š| ||
| 293 | K | 55.9 | Low | 63.9 | Low | 205 Ų | 205 | 126.3 Ų | 126.3 | 89% | 0.891 | 69% | 0.686 | S | S | * | * | trans | -53.4 | 114.4 | -166.4 | -62.7 | 171.2 | -175.9 | 170.8 | 0 | 110.2 | K291 S295 | K291-K293 PolarHBondContact O-N 3.35Å; K293-S295 PolarHBondContact O-N 3.03Å | ||
| 294 | F | 54.8 | Low | 62.2 | Low | 188 Ų | 188 | 130 Ų | 130 | 83% | 0.825 | 70% | 0.701 | S | S | * | * | trans | -60.3 | 111.1 | 166.6 | -177 | -96.7 | 0 | 0 | 0 | 107.9 | P292 P296 | P292-F294 PolarHBondContact O-N 3.05Å; F294-P296 HydrophobicContact CD1-CG 4.42Å; F294-P296 HydrophobicContact CE1-CG 4.49Å; F294-P296 WeakPolarHBondContact O-CD 3.47Å | ||
| 295 | S | 59.3 | Low | 60.4 | Low | 74 Ų | 74 | 127 Ų | 127 | 52% | 0.517 | 70% | 0.7 | S | S | . | * | trans | -93.2 | 115.7 | 177.4 | -175.7 | 0 | 0 | 0 | 0 | 108.7 | K293 Y297 | K293-S295 PolarHBondContact O-N 3.03Å; S295-Y297 WeakPolarHBondContact CB-O 3.39Å; S295-Y297 PolarHBondContact O-N 2.92Å; S295-Y297 VanDerWaalsContact O-N 3.11Å; S295-Y297 PolarHBondContact OG-N 3.44Å; S295-Y297 PolarHBondContact OG-O 3.46Å | ||
| 296 | P | 61.5 | Low | 58.8 | Low | 117 Ų | 117 | 129.3 Ų | 129.3 | 76% | 0.76 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -70.3 | 0.8 | 173.8 | -17.8 | 33.2 | 0 | 0 | 0 | 113.6 | F294 | F294-P296 HydrophobicContact CD1-CG 4.42Å; F294-P296 HydrophobicContact CE1-CG 4.49Å; F294-P296 WeakPolarHBondContact O-CD 3.47Å |
| 297 | Y | 49.3 | Very low | 57.4 | Low | 191 Ų | 191 | 133.3 Ų | 133.3 | 75% | 0.749 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -120.5 | 130.2 | 170.9 | -119 | -102.7 | 0 | 0 | 0 | 109.1 | S295 | S295-Y297 WeakPolarHBondContact CB-O 3.39Å; S295-Y297 PolarHBondContact O-N 2.92Å; S295-Y297 VanDerWaalsContact O-N 3.11Å; S295-Y297 PolarHBondContact OG-N 3.44Å; S295-Y297 PolarHBondContact OG-O 3.46Å |
| 298 | A | 48.8 | Very low | 56.3 | Low | 80 Ų | 80 | 132.9 Ų | 132.9 | 66% | 0.661 | 70% | 0.702 | S | S | * | * | trans | -59.5 | 131 | 166.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | T300 | A298-T300 PolarHBondContact O-N 3.37Š| ||
| 299 | P | 50.6 | Low | 55.7 | Low | 120 Ų | 120 | 131.6 Ų | 131.6 | 78% | 0.779 | 70% | 0.698 | S | S | * | * | trans | -63.9 | 112.7 | 172.2 | 26.7 | -32 | 0 | 0 | 0 | 107.8 | Q301 | P299-Q301 PolarHBondContact O-N 3.48Š| ||
| 300 | T | 52.4 | Low | 55 | Low | 120 Ų | 120 | 136 Ų | 136 | 74% | 0.736 | 70% | 0.7 | S | S | * | * | trans | -59.8 | 131.8 | 174.5 | 36.2 | 0 | 0 | 0 | 0 | 109.1 | A298 R302 | A298-T300 PolarHBondContact O-N 3.37Å; T300-R302 PolarHBondContact O-N 2.95Å | ||
| 301 | Q | 53.8 | Low | 54.7 | Low | 174 Ų | 174 | 138.6 Ų | 138.6 | 81% | 0.813 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | 33.1 | -174.1 | -160.6 | -171.4 | 24 | 0 | 0 | 113.4 | P299 | P299-Q301 PolarHBondContact O-N 3.48Š|
| 302 | R | 52.6 | Low | 54.1 | Low | 213 Ų | 213 | 133.7 Ų | 133.7 | 80% | 0.804 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.9 | -9.6 | -167.4 | -139.9 | 176.2 | -172.7 | 177.2 | 2.4 | 114.7 | T300 | T300-R302 PolarHBondContact O-N 2.95Š|
| 303 | L | 53.6 | Low | 53.3 | Low | 137 Ų | 137 | 134.3 Ų | 134.3 | 72% | 0.717 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -105.7 | -16.4 | 179.7 | -141.4 | 75.6 | 0 | 0 | 0 | 115.2 | L306 | L303-L306 HydrophobicContact CD1-CD1 4.47Š|
| 304 | Q | 53.6 | Low | 52.9 | Low | 151 Ų | 151 | 133.6 Ų | 133.6 | 71% | 0.706 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -75.3 | -30.1 | 172 | -76.3 | 179.4 | -30.2 | 0 | 0 | 112.5 | L306 Q307 A308 | Q304-L306 VanDerWaalsContact C-N 3.34Å; Q304-L306 PolarHBondContact O-N 3.1Å; Q304-Q307 PolarHBondContact O-N 3.42Å; Q304-A308 PolarHBondContact O-N 2.99Å |
| 305 | S | 51.8 | Low | 52.6 | Low | 64 Ų | 64 | 133.1 Ų | 133.1 | 45% | 0.448 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -59.9 | -40.5 | 175.9 | 177.6 | 0 | 0 | 0 | 0 | 112.7 | Q307 A308 Q309 | S305-Q307 VanDerWaalsContact C-N 3.33Å; S305-Q307 PolarHBondContact O-N 3.44Å; S305-A308 PolarHBondContact O-N 3.18Å; S305-Q309 PolarHBondContact O-N 3.2Å |
| 306 | L | 55.5 | Low | 52.2 | Low | 101 Ų | 101 | 136 Ų | 136 | 53% | 0.529 | 68% | 0.683 | S | S | . | * | H | α-helix | trans | -72.6 | -19.8 | -178.6 | -67.6 | 179.5 | 0 | 0 | 0 | 114.3 | L303 Q304 R310 | L303-L306 HydrophobicContact CD1-CD1 4.47Å; Q304-L306 VanDerWaalsContact C-N 3.34Å; Q304-L306 PolarHBondContact O-N 3.1Å; L306-R310 WeakPolarHBondContact O-CG 3.34Å |
| 307 | Q | 56.1 | Low | 51.7 | Low | 146 Ų | 146 | 137.8 Ų | 137.8 | 68% | 0.682 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -85.6 | -35.5 | 170.8 | -74.6 | -176.5 | -24.8 | 0 | 0 | 111.8 | Q304 S305 R310 L311 | Q304-Q307 PolarHBondContact O-N 3.42Å; S305-Q307 VanDerWaalsContact C-N 3.33Å; S305-Q307 PolarHBondContact O-N 3.44Å; Q307-R310 PolarHBondContact O-N 3.01Å; Q307-L311 PolarHBondContact O-N 3.05Å |
| 308 | A | 52.1 | Low | 51.3 | Low | 57 Ų | 57 | 135.5 Ų | 135.5 | 47% | 0.471 | 68% | 0.682 | S | S | . | * | H | α-helix | trans | -62.2 | -42.3 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q304 S305 R310 L311 T312 | Q304-A308 PolarHBondContact O-N 2.99Å; S305-A308 PolarHBondContact O-N 3.18Å; A308-R310 VanDerWaalsContact C-N 3.29Å; A308-R310 PolarHBondContact O-N 3.27Å; A308-L311 PolarHBondContact O-N 3.5Å; A308-T312 PolarHBondContact O-N 2.87Å; A308-T312 PolarHBondContact O-OG1 3.07Å |
| 309 | Q | 52.3 | Low | 51.4 | Low | 115 Ų | 115 | 139.3 Ų | 139.3 | 54% | 0.537 | 69% | 0.691 | S | S | . | * | H | α-helix | trans | -65.7 | -24.1 | 177.8 | -77.2 | -174.7 | -79.2 | 0 | 0 | 114.4 | S305 T312 L313 | S305-Q309 PolarHBondContact O-N 3.2Å; Q309-T312 PolarHBondContact O-OG1 3.49Å; Q309-L313 PolarHBondContact O-N 3.22Å |
| 310 | R | 50.7 | Low | 50.8 | Low | 209 Ų | 209 | 139.2 Ų | 139.2 | 79% | 0.789 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -80.8 | -21.8 | 175.2 | -66.5 | -175.8 | 90.6 | 177.2 | 6.8 | 112.9 | L306 Q307 A308 | L306-R310 WeakPolarHBondContact O-CG 3.34Å; Q307-R310 PolarHBondContact O-N 3.01Å; A308-R310 VanDerWaalsContact C-N 3.29Å; A308-R310 PolarHBondContact O-N 3.27Å |
| 311 | L | 52.8 | Low | 50 | Low | 133 Ų | 133 | 143.1 Ų | 143.1 | 70% | 0.696 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -84.1 | -34.1 | 175.6 | -69.7 | 169.9 | 0 | 0 | 0 | 112.5 | Q307 A308 | Q307-L311 PolarHBondContact O-N 3.05Å; A308-L311 PolarHBondContact O-N 3.5Å |
| 312 | T | 50.1 | Low | 49.7 | Very low | 89 Ų | 89 | 140 Ų | 140 | 55% | 0.546 | 69% | 0.689 | S | S | . | * | H | α-helix | trans | -76.2 | -25.3 | 177 | 52.5 | 0 | 0 | 0 | 0 | 113.7 | A308 Q309 N316 | A308-T312 PolarHBondContact O-N 2.87Å; A308-T312 PolarHBondContact O-OG1 3.07Å; Q309-T312 PolarHBondContact O-OG1 3.49Å; T312-N316 PolarHBondContact O-ND2 3.39Å |
| 313 | L | 50.8 | Low | 48.9 | Very low | 136 Ų | 136 | 137.8 Ų | 137.8 | 71% | 0.712 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -73.7 | -35.2 | 173.1 | -169.3 | 62.7 | 0 | 0 | 0 | 112.4 | Q309 K315 N316 | Q309-L313 PolarHBondContact O-N 3.22Å; L313-K315 VanDerWaalsContact C-N 3.32Å; L313-K315 PolarHBondContact O-N 3.34Å; L313-N316 PolarHBondContact O-N 2.98Å |
| 314 | R | 49 | Very low | 47.9 | Very low | 191 Ų | 191 | 135.3 Ų | 135.3 | 72% | 0.721 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -67.3 | -30.1 | -179.6 | -159.4 | -177.1 | -172.6 | -156 | 1.6 | 113.1 | N316 | R314-N316 VanDerWaalsContact C-N 3.26Å; R314-N316 PolarHBondContact O-N 3.16Å |
| 315 | K | 47.3 | Very low | 47.1 | Very low | 177 Ų | 177 | 133.3 Ų | 133.3 | 77% | 0.77 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | -9.2 | -177.2 | -168.8 | 166.7 | 178.9 | 177.9 | 0 | 114.5 | L313 | L313-K315 VanDerWaalsContact C-N 3.32Å; L313-K315 PolarHBondContact O-N 3.34Å |
| 316 | N | 52.6 | Low | 46.4 | Very low | 134 Ų | 134 | 135.9 Ų | 135.9 | 72% | 0.717 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.8 | 8.4 | -179.2 | -69.4 | -71.8 | 0 | 0 | 0 | 113.6 | T312 L313 R314 | T312-N316 PolarHBondContact O-ND2 3.39Å; L313-N316 PolarHBondContact O-N 2.98Å; R314-N316 VanDerWaalsContact C-N 3.26Å; R314-N316 PolarHBondContact O-N 3.16Å |
| 317 | Q | 49.1 | Very low | 45.4 | Very low | 155 Ų | 155 | 136.7 Ų | 136.7 | 72% | 0.724 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -97.1 | -10.8 | -179.4 | -157.3 | 163.6 | 27.3 | 0 | 0 | 113.7 | ||
| 318 | D | 41.6 | Very low | 44.8 | Very low | 143 Ų | 143 | 137.1 Ų | 137.1 | 77% | 0.765 | 73% | 0.726 | S | S | * | * | trans | -96.1 | 14.7 | -175.8 | -62.6 | -62.8 | 0 | 0 | 0 | 114.6 | ||||
| 319 | L | 50.7 | Low | 44 | Very low | 161 Ų | 161 | 142.2 Ų | 142.2 | 84% | 0.843 | 75% | 0.745 | S | S | * | * | trans | -100.9 | 53.7 | 179.7 | -167.1 | 57.5 | 0 | 0 | 0 | 113.3 | ||||
| 320 | T | 37.8 | Very low | 43.3 | Very low | 117 Ų | 117 | 146.1 Ų | 146.1 | 72% | 0.718 | 76% | 0.755 | S | S | * | * | trans | -136.6 | 71.9 | 174 | 53 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 321 | K | 37.3 | Very low | 42.8 | Very low | 203 Ų | 203 | 142.2 Ų | 142.2 | 88% | 0.883 | 75% | 0.745 | S | S | * | * | trans | 65 | 171.2 | 146.6 | -62 | 174.5 | -179 | 176.4 | 0 | 117.5 | ||||
| 322 | P | 47.6 | Very low | 42.1 | Very low | 108 Ų | 108 | 142.1 Ų | 142.1 | 70% | 0.701 | 75% | 0.745 | S | S | * | * | cis | -127.3 | 164 | -36.4 | 31.6 | -15 | 0 | 0 | 0 | 113.1 | ||||
| 323 | L | 34.5 | Very low | 41.7 | Very low | 167 Ų | 167 | 142.8 Ų | 142.8 | 87% | 0.874 | 75% | 0.753 | S | S | * | * | 164.6 | 141.9 | 121.3 | -90.5 | 160.3 | 0 | 0 | 0 | 114.4 | |||||
| 324 | A | 34 | Very low | 41.2 | Very low | 84 Ų | 84 | 143.1 Ų | 143.1 | 69% | 0.694 | 76% | 0.76 | S | S | * | * | trans | -26.2 | 137.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 325 | S | 35.3 | Very low | 40.5 | Very low | 109 Ų | 109 | 137.9 Ų | 137.9 | 76% | 0.762 | 76% | 0.758 | S | S | * | * | -174.3 | 144.7 | 94.8 | -77.6 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 326 | C | 37.8 | Very low | 39.9 | Very low | 118 Ų | 118 | 134.3 Ų | 134.3 | 80% | 0.797 | 76% | 0.761 | S | S | * | * | trans | 10.9 | 151.5 | 142.5 | -52.8 | 0 | 0 | 0 | 0 | 120 | ||||
| 327 | V | 33.9 | Very low | 39.1 | Very low | 119 Ų | 119 | 132.4 Ų | 132.4 | 72% | 0.721 | 76% | 0.764 | S | S | * | * | cis | 177.9 | 142.4 | 0.6 | 132.4 | 0 | 0 | 0 | 0 | 105 | ||||
| 328 | L | 43.5 | Very low | 38.4 | Very low | 154 Ų | 154 | 129.9 Ų | 129.9 | 81% | 0.806 | 77% | 0.77 | S | S | * | * | trans | 25.1 | 124.8 | 155.5 | -54.3 | 172.9 | 0 | 0 | 0 | 122.6 | ||||
| 329 | L | 35.8 | Very low | 38.2 | Very low | 164 Ų | 164 | 131 Ų | 131 | 86% | 0.859 | 78% | 0.775 | S | S | * | * | -174.2 | 123.2 | 114.7 | -137.4 | 59.9 | 0 | 0 | 0 | 108.4 | |||||
| 330 | R | 37.9 | Very low | 38.2 | Very low | 198 Ų | 198 | 128.9 Ų | 128.9 | 75% | 0.747 | 77% | 0.77 | S | S | * | * | cis | 84 | 121.1 | 42.5 | -138.6 | -149.9 | 157.2 | 160.4 | -5.9 | 114.2 | ||||
| 331 | Q | 39.1 | Very low | 39 | Very low | 127 Ų | 127 | 128.4 Ų | 128.4 | 59% | 0.593 | 77% | 0.77 | S | S | * | * | trans | 78.3 | 154.3 | 156.4 | -56.9 | -53.8 | -97.8 | 0 | 0 | 117.9 | ||||
| 332 | L | 38.6 | Very low | 39.1 | Very low | 131 Ų | 131 | 127.1 Ų | 127.1 | 69% | 0.686 | 77% | 0.771 | S | S | * | * | cis | -160.9 | 132.5 | -8.5 | -100.9 | 157.7 | 0 | 0 | 0 | 106.6 | ||||
| 333 | S | 42.8 | Very low | 38.8 | Very low | 102 Ų | 102 | 126.1 Ų | 126.1 | 71% | 0.713 | 77% | 0.772 | S | S | * | * | 73.4 | 160.4 | 98.7 | -69.4 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 334 | V | 38.9 | Very low | 39.6 | Very low | 144 Ų | 144 | 123 Ų | 123 | 87% | 0.873 | 76% | 0.762 | S | S | * | * | trans | 87.7 | 136.6 | 165.8 | -174.1 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 335 | A | 34.3 | Very low | 39.7 | Very low | 81 Ų | 81 | 128.3 Ų | 128.3 | 67% | 0.669 | 77% | 0.77 | S | S | * | * | cis | -171.2 | 163.7 | -27.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 336 | A | 36.1 | Very low | 39.5 | Very low | 101 Ų | 101 | 127.8 Ų | 127.8 | 84% | 0.835 | 77% | 0.766 | S | S | * | * | trans | 47.8 | 155.9 | 137.4 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 337 | A | 34.3 | Very low | 39.2 | Very low | 94 Ų | 94 | 129.2 Ų | 129.2 | 78% | 0.777 | 77% | 0.765 | S | S | * | * | cis | -174.6 | 177.9 | -17.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 338 | A | 34.4 | Very low | 39.1 | Very low | 102 Ų | 102 | 132 Ų | 132 | 84% | 0.843 | 77% | 0.77 | S | S | * | * | trans | 84.9 | 159.1 | 152.7 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 339 | L | 37.2 | Very low | 38.5 | Very low | 168 Ų | 168 | 131.1 Ų | 131.1 | 88% | 0.88 | 77% | 0.771 | S | S | * | * | trans | -113.2 | -152.2 | -166.5 | -63.6 | 164.1 | 0 | 0 | 0 | 112 | ||||
| 340 | P | 51.7 | Low | 38.1 | Very low | 115 Ų | 115 | 127.3 Ų | 127.3 | 75% | 0.747 | 76% | 0.764 | S | S | * | * | -112.9 | -151.7 | -117.5 | 42.7 | -21.7 | 0 | 0 | 0 | 111.3 | |||||
| 341 | P | 53.9 | Low | 38.2 | Very low | 108 Ų | 108 | 123.8 Ų | 123.8 | 70% | 0.701 | 76% | 0.764 | S | S | * | * | cis | -133.6 | 177.2 | -10.7 | 41.8 | -24.6 | 0 | 0 | 0 | 115.5 | ||||
| 342 | L | 38.8 | Very low | 37.7 | Very low | 175 Ų | 175 | 125.1 Ų | 125.1 | 92% | 0.916 | 78% | 0.775 | S | S | * | * | 169.6 | 146.3 | 128.6 | -89.7 | 168.5 | 0 | 0 | 0 | 110.5 | |||||
| 343 | A | 42.1 | Very low | 37.5 | Very low | 88 Ų | 88 | 123.4 Ų | 123.4 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | trans | -101.8 | 175.8 | -178.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 344 | P | 50.7 | Low | 37 | Very low | 100 Ų | 100 | 123.3 Ų | 123.3 | 65% | 0.649 | 77% | 0.774 | S | S | * | * | -155.7 | 157.9 | 75.4 | 43.6 | -24.8 | 0 | 0 | 0 | 118.2 | |||||
| 345 | F | 36.3 | Very low | 36.7 | Very low | 197 Ų | 197 | 125.6 Ų | 125.6 | 86% | 0.864 | 77% | 0.774 | S | S | * | * | trans | 54.1 | 142.1 | 160.4 | -50.6 | -55.5 | 0 | 0 | 0 | 118.2 | ||||
| 346 | S | 30.8 | Very low | 36.5 | Very low | 98 Ų | 98 | 125.5 Ų | 125.5 | 69% | 0.685 | 77% | 0.774 | S | S | * | * | cis | -171.4 | 163 | -1.2 | -103 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 347 | L | 31.3 | Very low | 36.5 | Very low | 147 Ų | 147 | 128.7 Ų | 128.7 | 77% | 0.77 | 78% | 0.776 | S | S | * | * | cis | -145.9 | 144.1 | 9 | -104.7 | 137.3 | 0 | 0 | 0 | 110.9 | ||||
| 348 | Q | 32.4 | Very low | 36.5 | Very low | 177 Ų | 177 | 134.6 Ų | 134.6 | 83% | 0.827 | 79% | 0.785 | S | S | * | * | trans | 35 | 117.2 | 140.6 | -151.3 | 159.1 | 10.6 | 0 | 0 | 122.7 | ||||
| 349 | T | 30.9 | Very low | 36.3 | Very low | 136 Ų | 136 | 138.4 Ų | 138.4 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | trans | -115.1 | 142.8 | 158.2 | 47.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 350 | A | 28 | Very low | 36.2 | Very low | 85 Ų | 85 | 135.4 Ų | 135.4 | 70% | 0.702 | 78% | 0.777 | S | S | * | * | trans | 177.5 | 136.5 | 152.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 351 | T | 39 | Very low | 35.4 | Very low | 124 Ų | 124 | 138.6 Ų | 138.6 | 76% | 0.761 | 78% | 0.782 | S | S | * | * | cis | 73 | 102.9 | 22.3 | 77.4 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 352 | N | 30.2 | Very low | 34.8 | Very low | 154 Ų | 154 | 138.4 Ų | 138.4 | 82% | 0.824 | 78% | 0.781 | S | S | * | * | trans | -168.5 | 123.3 | 144.6 | -92.1 | -28 | 0 | 0 | 0 | 106.6 | ||||
| 353 | S | 33.3 | Very low | 34.9 | Very low | 95 Ų | 95 | 136.6 Ų | 136.6 | 66% | 0.664 | 77% | 0.772 | S | S | * | * | 65.5 | 125.4 | 74.5 | 90.2 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 354 | S | 31.7 | Very low | 34.8 | Very low | 100 Ų | 100 | 138.5 Ų | 138.5 | 70% | 0.699 | 78% | 0.777 | S | S | * | * | cis | -166.5 | 165.2 | 16.8 | -74.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 355 | H | 32.4 | Very low | 34.3 | Very low | 192 Ų | 192 | 142 Ų | 142 | 89% | 0.889 | 78% | 0.784 | S | S | * | * | trans | 54.7 | 134 | 154.8 | -84.8 | -118.9 | 0 | 0 | 0 | 118.3 | ||||
| 356 | A | 31.6 | Very low | 34.3 | Very low | 79 Ų | 79 | 136.9 Ų | 136.9 | 65% | 0.653 | 78% | 0.779 | S | S | * | * | -178.4 | 171.7 | 52.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 357 | L | 34.9 | Very low | 34.4 | Very low | 169 Ų | 169 | 140.6 Ų | 140.6 | 89% | 0.885 | 79% | 0.79 | S | S | * | * | trans | 60.6 | 89.3 | 158.3 | -51.9 | -176.1 | 0 | 0 | 0 | 119.5 | ||||
| 358 | F | 34.7 | Very low | 34.9 | Very low | 218 Ų | 218 | 141.1 Ų | 141.1 | 96% | 0.956 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -100.3 | 125.2 | 143.8 | -88.5 | -80.2 | 0 | 0 | 0 | 109.8 | ||
| 359 | H | 31.2 | Very low | 35.6 | Very low | 181 Ų | 181 | 141.7 Ų | 141.7 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 129.2 | -177.5 | -171.9 | 84.1 | 0 | 0 | 0 | 110.7 | ||
| 360 | S | 33.8 | Very low | 36.1 | Very low | 105 Ų | 105 | 140.4 Ų | 140.4 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -91.9 | 136.8 | 180 | 55 | 0 | 0 | 0 | 0 | 112.4 | ||
| 361 | Q | 35.5 | Very low | 36.4 | Very low | 182 Ų | 182 | 141.3 Ų | 141.3 | 85% | 0.85 | 80% | 0.797 | S | S | * | * | trans | -136.8 | 155.4 | 153.1 | -98.2 | -139.2 | -47 | 0 | 0 | 111.7 | ||||
| 362 | P | 41.9 | Very low | 36.7 | Very low | 105 Ų | 105 | 142.2 Ų | 142.2 | 68% | 0.682 | 80% | 0.802 | S | S | * | * | trans | -111.2 | 165.9 | -142.3 | 40.2 | -34.7 | 0 | 0 | 0 | 115.9 | ||||
| 363 | L | 41.1 | Very low | 37.8 | Very low | 137 Ų | 137 | 137.4 Ų | 137.4 | 72% | 0.717 | 79% | 0.789 | S | S | * | * | trans | -54 | 156.2 | 155.5 | -99.5 | 89.6 | 0 | 0 | 0 | 111.8 | Q365 | L363-Q365 HydrophobicContact CD2-CB 4.19Å; L363-Q365 HydrophobicContact CD2-CG 4.16Å | ||
| 364 | P | 39.9 | Very low | 38.4 | Very low | 128 Ų | 128 | 139 Ų | 139 | 83% | 0.831 | 80% | 0.797 | S | S | * | * | -107 | 139.9 | 129.3 | 31.9 | -26.6 | 0 | 0 | 0 | 110.4 | |||||
| 365 | Q | 39.3 | Very low | 39 | Very low | 172 Ų | 172 | 142 Ų | 142 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -111.5 | 149.3 | -173.3 | -156 | 178.8 | 4.8 | 0 | 0 | 111.2 | L363 | L363-Q365 HydrophobicContact CD2-CB 4.19Å; L363-Q365 HydrophobicContact CD2-CG 4.16Å | ||
| 366 | A | 35.5 | Very low | 39.5 | Very low | 91 Ų | 91 | 138.3 Ų | 138.3 | 75% | 0.752 | 80% | 0.798 | S | S | * | * | trans | 66.5 | 123.4 | 162.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 367 | L | 34.8 | Very low | 39.9 | Very low | 176 Ų | 176 | 139.8 Ų | 139.8 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | -149.7 | 139.5 | 117.3 | -105.1 | 168.2 | 0 | 0 | 0 | 109.5 | |||||
| 368 | L | 40.4 | Very low | 40.4 | Very low | 157 Ų | 157 | 137.2 Ų | 137.2 | 82% | 0.822 | 80% | 0.797 | S | S | * | * | trans | -80.3 | 136.7 | -170.9 | -63 | 154.3 | 0 | 0 | 0 | 111.1 | ||||
| 369 | H | 47.3 | Very low | 40.9 | Very low | 189 Ų | 189 | 135.8 Ų | 135.8 | 88% | 0.875 | 79% | 0.793 | S | S | * | * | trans | -147.7 | 153.1 | 156 | -100.4 | -80.5 | 0 | 0 | 0 | 111.7 | ||||
| 370 | P | 41.6 | Very low | 41.5 | Very low | 109 Ų | 109 | 133.6 Ų | 133.6 | 71% | 0.708 | 79% | 0.792 | S | S | * | * | trans | -87.2 | 159.3 | -152.9 | 33.3 | -37.1 | 0 | 0 | 0 | 115.5 | T372 | P370-T372 PolarHBondContact O-N 3.48Š| ||
| 371 | A | 35.3 | Very low | 42.1 | Very low | 105 Ų | 105 | 133.5 Ų | 133.5 | 87% | 0.868 | 79% | 0.792 | S | S | * | * | trans | -69 | 116 | 174 | 0 | 0 | 0 | 0 | 0 | 112 | G373 | A371-G373 PolarHBondContact O-N 2.99Š| ||
| 372 | T | 44.8 | Very low | 42.7 | Very low | 143 Ų | 143 | 130.8 Ų | 130.8 | 88% | 0.877 | 79% | 0.787 | S | S | * | * | trans | -78.7 | 106.3 | 165.7 | 44.8 | 0 | 0 | 0 | 0 | 109.9 | P370 | P370-T372 PolarHBondContact O-N 3.48Š| ||
| 373 | G | 53.3 | Low | 43.1 | Very low | 52 Ų | 52 | 133.3 Ų | 133.3 | 54% | 0.536 | 79% | 0.794 | S | S | . | * | trans | -69.3 | 170.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | A371 I375 | A371-G373 PolarHBondContact O-N 2.99Å; G373-I375 PolarHBondContact O-N 3.02Å | ||
| 374 | P | 44.4 | Very low | 43.5 | Very low | 130 Ų | 130 | 135.9 Ų | 135.9 | 84% | 0.844 | 80% | 0.8 | S | S | * | * | trans | -70.4 | 112.9 | 176.5 | 29.3 | -33.1 | 0 | 0 | 0 | 110.5 | C376 | P374-C376 PolarHBondContact O-N 3.02Š| ||
| 375 | I | 44.8 | Very low | 43.6 | Very low | 163 Ų | 163 | 135 Ų | 135 | 84% | 0.836 | 80% | 0.796 | S | S | * | * | trans | -80.5 | 111.4 | 173.4 | -55.8 | 175.4 | 0 | 0 | 0 | 108.2 | G373 S377 | G373-I375 PolarHBondContact O-N 3.02Å; I375-S377 PolarHBondContact O-N 3.21Å | ||
| 376 | C | 44.4 | Very low | 44.7 | Very low | 113 Ų | 113 | 132.1 Ų | 132.1 | 76% | 0.764 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 123.4 | 167.3 | -61.4 | 0 | 0 | 0 | 0 | 109.4 | P374 P378 | P374-C376 PolarHBondContact O-N 3.02Å; C376-P378 WeakPolarHBondContact O-CD 3.41Å |
| 377 | S | 39.6 | Very low | 45 | Very low | 110 Ų | 110 | 141.3 Ų | 141.3 | 77% | 0.769 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -68 | 122.1 | 168.2 | -63.4 | 0 | 0 | 0 | 0 | 109.8 | I375 | I375-S377 PolarHBondContact O-N 3.21Š|
| 378 | P | 43.9 | Very low | 45.5 | Very low | 115 Ų | 115 | 139.6 Ų | 139.6 | 75% | 0.747 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 149.2 | 171.1 | 29.3 | -33.5 | 0 | 0 | 0 | 110.7 | C376 T380 | C376-P378 WeakPolarHBondContact O-CD 3.41Å; P378-T380 PolarHBondContact O-N 3.29Å |
| 379 | H | 46.3 | Very low | 45.8 | Very low | 189 Ų | 189 | 138.7 Ų | 138.7 | 88% | 0.875 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -63 | 126.3 | 178 | -63.6 | -102.6 | 0 | 0 | 0 | 110.6 | S381 | H379-S381 PolarHBondContact O-N 3.42Š|
| 380 | T | 44.6 | Very low | 45.7 | Very low | 134 Ų | 134 | 135.9 Ų | 135.9 | 82% | 0.822 | 81% | 0.807 | S | S | * | * | trans | -72.7 | 112.1 | 170.1 | 50 | 0 | 0 | 0 | 0 | 109.6 | P378 V382 | P378-T380 PolarHBondContact O-N 3.29Å; T380-V382 PolarHBondContact O-N 2.84Å | ||
| 381 | S | 46.4 | Very low | 45.9 | Very low | 104 Ų | 104 | 137.5 Ų | 137.5 | 73% | 0.727 | 81% | 0.813 | S | S | * | * | trans | -59.7 | 127.3 | 172.5 | 48.2 | 0 | 0 | 0 | 0 | 111.4 | H379 L383 | H379-S381 PolarHBondContact O-N 3.42Å; S381-L383 PolarHBondContact O-N 2.63Å | ||
| 382 | V | 47.5 | Very low | 46.6 | Very low | 124 Ų | 124 | 139.5 Ų | 139.5 | 75% | 0.752 | 81% | 0.81 | S | S | * | * | trans | -69.8 | 114.5 | 169.3 | 176.5 | 0 | 0 | 0 | 0 | 108.4 | T380 F384 | T380-V382 PolarHBondContact O-N 2.84Å; V382-F384 HydrophobicContact CG1-CD2 3.91Å; V382-F384 HydrophobicContact CG1-CE2 4.33Å | ||
| 383 | L | 48.9 | Very low | 46.7 | Very low | 159 Ų | 159 | 139.3 Ų | 139.3 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | trans | -98.2 | 106.7 | 162.2 | -80.6 | 170.1 | 0 | 0 | 0 | 108.5 | S381 | S381-L383 PolarHBondContact O-N 2.63Š| ||
| 384 | F | 51.4 | Low | 46.3 | Very low | 191 Ų | 191 | 145.5 Ų | 145.5 | 84% | 0.838 | 82% | 0.824 | S | S | * | * | trans | -71.2 | 136.5 | 156.5 | -100.4 | -101.1 | 0 | 0 | 0 | 108.4 | V382 | V382-F384 HydrophobicContact CG1-CD2 3.91Å; V382-F384 HydrophobicContact CG1-CE2 4.33Å | ||
| 385 | S | 40.9 | Very low | 46.4 | Very low | 108 Ų | 108 | 146.7 Ų | 146.7 | 76% | 0.755 | 82% | 0.823 | S | S | * | * | trans | -135.8 | 133.2 | 154.1 | -74.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 386 | P | 62.2 | Low | 46.5 | Very low | 113 Ų | 113 | 145.3 Ų | 145.3 | 73% | 0.734 | 82% | 0.822 | S | S | * | * | trans | -83.8 | 143 | 178.7 | 34.3 | -33.2 | 0 | 0 | 0 | 110.8 | ||||
| 387 | F | 42.3 | Very low | 46.7 | Very low | 284 Ų | 284 | 148.3 Ų | 148.3 | 100% | 1.246 | 83% | 0.827 | S | S | * | * | -170.6 | 0 | 128.3 | -102 | -66.7 | 0 | 0 | 0 | 109.1 |
Retrieved 387 of 387 residues in 257 ms
(Link to these results)