| 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 | 52.7 | Low | 56.6 | Low | 233 Ų | 233 | 145.1 Ų | 145.1 | 100% | 1.148 | 81% | 0.81 | S | S | * | * | 0 | 100.7 | 0 | -64.1 | 173.6 | -177.4 | 0 | 0 | 104.1 | |||||
| 2 | E | 49.1 | Very low | 55.6 | Low | 164 Ų | 164 | 143.5 Ų | 143.5 | 77% | 0.766 | 81% | 0.807 | S | S | * | * | cis | -152.3 | 139.6 | 16.4 | -120.5 | 113.9 | 100.8 | 0 | 0 | 103.4 | ||||
| 3 | A | 54 | Low | 55.5 | Low | 80 Ų | 80 | 141.2 Ų | 141.2 | 66% | 0.661 | 81% | 0.806 | S | S | * | * | 55 | 131.2 | 89.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 4 | D | 55.6 | Low | 55.2 | Low | 153 Ų | 153 | 138.2 Ų | 138.2 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | cis | -170.1 | 166.3 | 21.2 | -133.5 | -66.8 | 0 | 0 | 0 | 108.6 | ||||
| 5 | A | 55.9 | Low | 54.4 | Low | 74 Ų | 74 | 136.4 Ų | 136.4 | 61% | 0.612 | 80% | 0.797 | S | S | * | * | trans | -61.2 | 158.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 6 | L | 67 | Low | 54.1 | Low | 163 Ų | 163 | 135.3 Ų | 135.3 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | trans | -167.6 | 121.2 | 131.2 | -97.8 | -177.6 | 0 | 0 | 0 | 111.1 | ||||
| 7 | L | 53.2 | Low | 53.3 | Low | 150 Ų | 150 | 134.4 Ų | 134.4 | 79% | 0.785 | 80% | 0.801 | S | S | * | * | trans | -53.7 | 158.3 | 164.2 | -71.2 | 92.3 | 0 | 0 | 0 | 111.8 | ||||
| 8 | H | 58.5 | Low | 53.2 | Low | 180 Ų | 180 | 133.8 Ų | 133.8 | 83% | 0.833 | 81% | 0.805 | S | S | * | * | trans | -176.9 | 98.1 | 134.7 | -93.4 | 89.9 | 0 | 0 | 0 | 107.3 | ||||
| 9 | A | 63.8 | Low | 52.7 | Low | 82 Ų | 82 | 132.2 Ų | 132.2 | 68% | 0.678 | 80% | 0.801 | S | S | * | * | 86.1 | 128.5 | 89.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 10 | P | 55.6 | Low | 52.3 | Low | 125 Ų | 125 | 130.6 Ų | 130.6 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | trans | -89.1 | 138.1 | -174.1 | 35.1 | -32.1 | 0 | 0 | 0 | 111.7 | ||||
| 11 | M | 57.6 | Low | 52 | Low | 192 Ų | 192 | 129.2 Ų | 129.2 | 95% | 0.946 | 79% | 0.792 | S | S | * | * | trans | -105.6 | 111.7 | 173.5 | -67.8 | -158.7 | 136.5 | 0 | 0 | 111.5 | ||||
| 12 | T | 44.9 | Very low | 51.7 | Low | 126 Ų | 126 | 123.4 Ų | 123.4 | 77% | 0.773 | 77% | 0.774 | S | S | * | * | trans | -54 | 168.4 | 160.5 | 50.2 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 13 | S | 53.8 | Low | 51.6 | Low | 113 Ų | 113 | 123.6 Ų | 123.6 | 79% | 0.79 | 78% | 0.78 | S | S | * | * | trans | 102.1 | 133.9 | 167.9 | 84.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 14 | S | 50.9 | Low | 51.2 | Low | 100 Ų | 100 | 125.4 Ų | 125.4 | 70% | 0.699 | 79% | 0.788 | S | S | * | * | cis | -157.1 | 137.8 | 14.3 | -54.4 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 15 | S | 43.8 | Very low | 51.4 | Low | 111 Ų | 111 | 125.2 Ų | 125.2 | 78% | 0.776 | 79% | 0.792 | S | S | * | * | trans | -13.6 | 139.1 | 145 | 45 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 16 | S | 49.1 | Very low | 50.9 | Low | 118 Ų | 118 | 125.4 Ų | 125.4 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | -172.9 | 98.3 | 123 | 29 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 17 | S | 41.2 | Very low | 49.9 | Very low | 121 Ų | 121 | 121.5 Ų | 121.5 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | trans | -71 | 135.7 | 153 | 46.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 18 | S | 51.1 | Low | 50.4 | Low | 124 Ų | 124 | 119.7 Ų | 119.7 | 87% | 0.867 | 80% | 0.8 | S | S | * | * | trans | -142.7 | 107.7 | 160.2 | 47.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 19 | S | 42.9 | Very low | 49.8 | Very low | 103 Ų | 103 | 116.9 Ų | 116.9 | 72% | 0.72 | 80% | 0.799 | S | S | * | * | trans | -91.8 | 163.1 | 159.8 | 47.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 20 | S | 45 | Very low | 49.6 | Very low | 99 Ų | 99 | 119.5 Ų | 119.5 | 69% | 0.692 | 81% | 0.806 | S | S | * | * | trans | 105.1 | 135.9 | 146.3 | -27.9 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 21 | S | 46.4 | Very low | 49.4 | Very low | 103 Ų | 103 | 119.6 Ų | 119.6 | 72% | 0.72 | 80% | 0.804 | S | S | * | * | trans | 76 | 109.1 | 145 | 21 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 22 | S | 45.8 | Very low | 49.4 | Very low | 110 Ų | 110 | 118.4 Ų | 118.4 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | 67.7 | 102.7 | 82.2 | -60.3 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 23 | D | 46.7 | Very low | 49.4 | Very low | 169 Ų | 169 | 115.9 Ų | 115.9 | 90% | 0.904 | 80% | 0.801 | S | S | * | * | trans | -154.4 | 134.2 | 146.3 | -97.8 | -46.8 | 0 | 0 | 0 | 112.8 | ||||
| 24 | S | 46.6 | Very low | 49.5 | Very low | 117 Ų | 117 | 114.9 Ų | 114.9 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -99.9 | 118.9 | -174.6 | -60.1 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 25 | V | 59.3 | Low | 49.6 | Very low | 149 Ų | 149 | 118.9 Ų | 118.9 | 90% | 0.903 | 81% | 0.807 | S | S | * | * | trans | -145.3 | 116.9 | 161.8 | -66.5 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 26 | G | 45 | Very low | 49.8 | Very low | 79 Ų | 79 | 122.3 Ų | 122.3 | 81% | 0.814 | 81% | 0.811 | S | S | * | * | 129 | 62 | 62 | 0 | 0 | 0 | 0 | 0 | 106.8 | S28 | G26-S28 PolarHBondContact O-N 3.19Š| |||
| 27 | G | 45.8 | Very low | 50.3 | Low | 80 Ų | 80 | 123.8 Ų | 123.8 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | -87 | 95.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | C29 | G27-C29 PolarHBondContact O-N 2.83Š| ||
| 28 | S | 64.8 | Low | 51.4 | Low | 112 Ų | 112 | 124.2 Ų | 124.2 | 78% | 0.783 | 81% | 0.809 | S | S | * | * | trans | -69.5 | 115.4 | 174.3 | -174.7 | 0 | 0 | 0 | 0 | 110.3 | G26 | G26-S28 PolarHBondContact O-N 3.19Š| ||
| 29 | C | 45.3 | Very low | 51.8 | Low | 121 Ų | 121 | 123.9 Ų | 123.9 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | -80.8 | 113.4 | 168.9 | 49.1 | 0 | 0 | 0 | 0 | 109.7 | G27 | G27-C29 PolarHBondContact O-N 2.83Š| ||
| 30 | V | 59.3 | Low | 52.3 | Low | 137 Ų | 137 | 126.4 Ų | 126.4 | 83% | 0.83 | 81% | 0.812 | S | S | * | * | trans | -94.4 | 113.8 | 163.7 | -85.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 31 | V | 52.1 | Low | 53.1 | Low | 127 Ų | 127 | 128.3 Ų | 128.3 | 77% | 0.77 | 82% | 0.819 | S | S | * | * | trans | -71.5 | 130.8 | 169.3 | 53.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 32 | N | 57.8 | Low | 53.3 | Low | 167 Ų | 167 | 126.4 Ų | 126.4 | 89% | 0.893 | 82% | 0.816 | S | S | * | * | trans | -164.6 | 114.1 | 153.1 | -85.9 | -20.8 | 0 | 0 | 0 | 104.1 | ||||
| 33 | G | 45 | Very low | 53.9 | Low | 73 Ų | 73 | 129.9 Ų | 129.9 | 75% | 0.753 | 82% | 0.817 | S | S | * | * | cis | 96.2 | 56.9 | 32.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 34 | A | 55.4 | Low | 54.3 | Low | 92 Ų | 92 | 127.2 Ų | 127.2 | 76% | 0.76 | 81% | 0.809 | S | S | * | * | trans | -158.7 | 106.4 | 162.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 35 | Q | 52.2 | Low | 54.9 | Low | 185 Ų | 185 | 129.5 Ų | 129.5 | 86% | 0.864 | 81% | 0.806 | S | S | * | * | trans | -35 | 133.9 | 154.5 | 58.2 | -130.4 | -4.2 | 0 | 0 | 116.1 | ||||
| 36 | E | 49.4 | Very low | 55.1 | Low | 183 Ų | 183 | 131.7 Ų | 131.7 | 86% | 0.855 | 80% | 0.804 | S | S | * | * | trans | -169.1 | 156 | 133 | -108 | -136 | 87.5 | 0 | 0 | 112.7 | ||||
| 37 | L | 59.5 | Low | 55.5 | Low | 149 Ų | 149 | 136 Ų | 136 | 78% | 0.78 | 81% | 0.808 | S | S | * | * | trans | -86.9 | 147 | -153.1 | -58.8 | 154.7 | 0 | 0 | 0 | 113.3 | ||||
| 38 | P | 63.4 | Low | 56 | Low | 130 Ų | 130 | 138.6 Ų | 138.6 | 84% | 0.844 | 81% | 0.808 | S | S | * | * | trans | -92.9 | 108.3 | 161.3 | 31.8 | -27.8 | 0 | 0 | 0 | 110.9 | ||||
| 39 | S | 59.4 | Low | 55.4 | Low | 117 Ų | 117 | 142.5 Ų | 142.5 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | trans | -81.7 | 126.8 | 167.8 | 49.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 40 | N | 54.1 | Low | 56.1 | Low | 156 Ų | 156 | 148 Ų | 148 | 83% | 0.834 | 81% | 0.814 | S | S | * | * | trans | -83.8 | 121.9 | -179.5 | -172.8 | -74.8 | 0 | 0 | 0 | 110.2 | ||||
| 41 | T | 61.5 | Low | 55.9 | Low | 139 Ų | 139 | 150.5 Ų | 150.5 | 85% | 0.853 | 81% | 0.814 | S | S | * | * | trans | -140.3 | 127.4 | 158.1 | 61.1 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 42 | G | 50.3 | Low | 56.4 | Low | 62 Ų | 62 | 156.4 Ų | 156.4 | 64% | 0.639 | 82% | 0.822 | S | S | * | * | cis | 119.7 | 88.3 | 32.8 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 43 | K | 59.4 | Low | 56.7 | Low | 183 Ų | 183 | 153.9 Ų | 153.9 | 80% | 0.796 | 81% | 0.813 | S | S | * | * | trans | -143.1 | 117.6 | 164.4 | -73.9 | -175.9 | -179.1 | 171.5 | 0 | 110.2 | ||||
| 44 | P | 55.1 | Low | 57.1 | Low | 113 Ų | 113 | 154.9 Ų | 154.9 | 73% | 0.734 | 81% | 0.814 | S | S | * | * | trans | -99.6 | 143.4 | 180 | 35.9 | -29.2 | 0 | 0 | 0 | 111.7 | ||||
| 45 | H | 58 | Low | 57.2 | Low | 165 Ų | 165 | 156 Ų | 156 | 76% | 0.764 | 82% | 0.817 | S | S | * | * | trans | -133.7 | 87.3 | 171.5 | -45.3 | -75.6 | 0 | 0 | 0 | 111.4 | ||||
| 46 | K | 64.6 | Low | 57.8 | Low | 196 Ų | 196 | 153.1 Ų | 153.1 | 85% | 0.852 | 81% | 0.814 | S | S | * | * | trans | 34.8 | 105.3 | 134.4 | -49.6 | 178.9 | -170.8 | 180 | 0 | 117.7 | ||||
| 47 | N | 52.4 | Low | 57.9 | Low | 170 Ų | 170 | 149.8 Ų | 149.8 | 91% | 0.909 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 130.5 | 172.6 | -144.9 | 18.9 | 0 | 0 | 0 | 111.4 | ||
| 48 | V | 56.9 | Low | 57.4 | Low | 134 Ų | 134 | 147.1 Ų | 147.1 | 81% | 0.812 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -101.3 | 134.7 | 173 | 167 | 0 | 0 | 0 | 0 | 110.4 | ||
| 49 | K | 52.8 | Low | 57.2 | Low | 193 Ų | 193 | 145.5 Ų | 145.5 | 84% | 0.839 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -101.9 | 119.4 | -163.8 | 174.5 | 167.2 | -177.7 | 167.5 | 0 | 111.6 | ||
| 50 | R | 59.4 | Low | 57 | Low | 237 Ų | 237 | 146.4 Ų | 146.4 | 89% | 0.894 | 81% | 0.811 | S | S | * | * | trans | -154.5 | 93.6 | 159.8 | -67.7 | -165.5 | 161.2 | 167.3 | -7.3 | 110.3 | ||||
| 51 | K | 55.1 | Low | 56.8 | Low | 189 Ų | 189 | 142.8 Ų | 142.8 | 82% | 0.822 | 81% | 0.81 | S | S | * | * | 53.4 | 97.6 | 95.1 | -162.6 | 172.6 | -174.5 | 179.1 | 0 | 114.8 | |||||
| 52 | R | 62.2 | Low | 56.1 | Low | 252 Ų | 252 | 140.4 Ų | 140.4 | 95% | 0.951 | 81% | 0.813 | S | S | * | * | trans | -139.3 | 135.9 | 149.4 | -66.9 | -173.5 | 75.8 | 160.7 | 0.1 | 109.1 | ||||
| 53 | T | 64.8 | Low | 56 | Low | 114 Ų | 114 | 141 Ų | 141 | 70% | 0.699 | 82% | 0.819 | S | S | * | * | trans | -98.5 | 147.6 | -165.8 | 43.3 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 54 | A | 54.4 | Low | 55.9 | Low | 94 Ų | 94 | 139.2 Ų | 139.2 | 78% | 0.777 | 82% | 0.823 | S | S | * | * | trans | 65.5 | 143 | 150.3 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 55 | S | 57.3 | Low | 55.8 | Low | 116 Ų | 116 | 138.3 Ų | 138.3 | 81% | 0.811 | 83% | 0.825 | S | S | * | * | cis | -172.7 | 169.3 | -8 | -99.6 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 56 | P | 63.2 | Low | 56.1 | Low | 124 Ų | 124 | 136.4 Ų | 136.4 | 81% | 0.805 | 83% | 0.828 | S | S | * | * | trans | -117.1 | 176.3 | -145.9 | 41.9 | -32 | 0 | 0 | 0 | 116.1 | ||||
| 57 | S | 51.6 | Low | 55.9 | Low | 112 Ų | 112 | 131.5 Ų | 131.5 | 78% | 0.783 | 82% | 0.823 | S | S | * | * | trans | -159.4 | 106.1 | 154.7 | -179 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 58 | A | 48.6 | Very low | 56.5 | Low | 93 Ų | 93 | 129.1 Ų | 129.1 | 77% | 0.769 | 82% | 0.817 | S | S | * | * | 51.6 | 127.6 | 100.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 59 | A | 60.1 | Low | 56.8 | Low | 97 Ų | 97 | 128.8 Ų | 128.8 | 80% | 0.802 | 82% | 0.818 | S | S | * | * | cis | -163.7 | 172.2 | 9.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 60 | P | 55.7 | Low | 56.4 | Low | 136 Ų | 136 | 128.7 Ų | 128.7 | 88% | 0.883 | 82% | 0.821 | S | S | * | * | trans | -106.6 | 163.3 | -159.1 | 39.3 | -30.9 | 0 | 0 | 0 | 115.3 | ||||
| 61 | G | 49.3 | Very low | 55.6 | Low | 79 Ų | 79 | 121.8 Ų | 121.8 | 81% | 0.814 | 81% | 0.814 | S | S | * | * | trans | -167.8 | 123.6 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 62 | G | 47.7 | Very low | 55.1 | Low | 89 Ų | 89 | 117.2 Ų | 117.2 | 92% | 0.918 | 81% | 0.812 | S | S | * | * | trans | -81.1 | 171.9 | -162.2 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 63 | G | 47.2 | Very low | 54.4 | Low | 74 Ų | 74 | 113.1 Ų | 113.1 | 76% | 0.763 | 81% | 0.807 | S | S | * | * | trans | 162.9 | 85.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 64 | V | 57.5 | Low | 53.5 | Low | 146 Ų | 146 | 111.6 Ų | 111.6 | 89% | 0.885 | 81% | 0.806 | S | S | * | * | trans | 33 | 118.3 | 147.4 | -158.9 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 65 | A | 53.9 | Low | 52.8 | Low | 94 Ų | 94 | 114.2 Ų | 114.2 | 78% | 0.777 | 81% | 0.807 | S | S | * | * | trans | -72.4 | 153.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 66 | P | 63.5 | Low | 52.3 | Low | 126 Ų | 126 | 116.2 Ų | 116.2 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | trans | -119.6 | 152.6 | 139.7 | 33.3 | -22.7 | 0 | 0 | 0 | 112.5 | ||||
| 67 | A | 60.6 | Low | 51.3 | Low | 92 Ų | 92 | 117 Ų | 117 | 76% | 0.76 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 153 | -167.1 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||
| 68 | P | 65.5 | Low | 51 | Low | 120 Ų | 120 | 117.8 Ų | 117.8 | 78% | 0.779 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 143.8 | 168.8 | 34.3 | -30.1 | 0 | 0 | 0 | 111.5 | ||
| 69 | P | 62.6 | Low | 50.3 | Low | 127 Ų | 127 | 116.3 Ų | 116.3 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 127.6 | 166.8 | 29.3 | -31.2 | 0 | 0 | 0 | 110.8 | ||
| 70 | E | 45.4 | Very low | 49.1 | Very low | 192 Ų | 192 | 115 Ų | 115 | 90% | 0.897 | 80% | 0.799 | S | S | * | * | trans | 22 | 127.3 | 142.5 | -148.9 | 169.2 | 130.2 | 0 | 0 | 119.5 | A72 | E70-A72 PolarHBondContact O-N 3.5Å; E70-A72 VanDerWaalsContact O-N 3.11Å | ||
| 71 | A | 41.9 | Very low | 48.4 | Very low | 91 Ų | 91 | 120.7 Ų | 120.7 | 75% | 0.752 | 80% | 0.803 | S | S | * | * | trans | -50.9 | 105.6 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | I73 | A71-I73 PolarHBondContact O-N 2.78Š| ||
| 72 | A | 44.5 | Very low | 48.4 | Very low | 94 Ų | 94 | 126.9 Ų | 126.9 | 78% | 0.777 | 80% | 0.802 | S | S | * | * | trans | -67.1 | 116.8 | 152 | 0 | 0 | 0 | 0 | 0 | 108.2 | E70 A74 | E70-A72 PolarHBondContact O-N 3.5Å; E70-A72 VanDerWaalsContact O-N 3.11Å; A72-A74 VanDerWaalsContact C-N 3.34Å; A72-A74 PolarHBondContact O-N 3.04Å | ||
| 73 | I | 47.9 | Very low | 48.5 | Very low | 166 Ų | 166 | 130 Ų | 130 | 85% | 0.851 | 79% | 0.786 | S | S | * | * | trans | -67.5 | 98.4 | 172.6 | -53.7 | 173.8 | 0 | 0 | 0 | 106.3 | A71 | A71-I73 PolarHBondContact O-N 2.78Š| ||
| 74 | A | 44.5 | Very low | 48.5 | Very low | 81 Ų | 81 | 136.9 Ų | 136.9 | 67% | 0.669 | 80% | 0.795 | S | S | * | * | trans | -60.1 | 141.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | A72 | A72-A74 VanDerWaalsContact C-N 3.34Å; A72-A74 PolarHBondContact O-N 3.04Å | ||
| 75 | D | 41.4 | Very low | 48.3 | Very low | 150 Ų | 150 | 138.5 Ų | 138.5 | 80% | 0.802 | 79% | 0.785 | S | S | * | * | trans | -54.8 | 125.6 | -176.4 | -50.5 | -96.1 | 0 | 0 | 0 | 113.9 | D77 | D75-D77 PolarHBondContact O-N 2.75Å; D75-D77 VanDerWaalsContact O-N 3.12Å | ||
| 76 | D | 46.6 | Very low | 47.6 | Very low | 158 Ų | 158 | 137.1 Ų | 137.1 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | trans | -79.5 | 70.8 | 150.2 | -89.1 | -69.1 | 0 | 0 | 0 | 108.2 | C78 | D76-C78 PolarHBondContact O-N 3.31Š| ||
| 77 | D | 42.2 | Very low | 46.8 | Very low | 141 Ų | 141 | 132.8 Ų | 132.8 | 75% | 0.754 | 75% | 0.752 | S | S | * | * | trans | -68.7 | 85.7 | 159.8 | -178.3 | -112 | 0 | 0 | 0 | 107.7 | D75 G79 | D75-D77 PolarHBondContact O-N 2.75Å; D75-D77 VanDerWaalsContact O-N 3.12Å; D77-G79 PolarHBondContact O-N 3.16Å | ||
| 78 | C | 44.5 | Very low | 46.5 | Very low | 128 Ų | 128 | 134.1 Ų | 134.1 | 87% | 0.865 | 76% | 0.763 | S | S | * | * | trans | -79 | 86.4 | 163.7 | -141.2 | 0 | 0 | 0 | 0 | 108.4 | D76 G80 | D76-C78 PolarHBondContact O-N 3.31Å; C78-G80 PolarHBondContact O-N 3.12Å | ||
| 79 | G | 34.3 | Very low | 45.8 | Very low | 61 Ų | 61 | 131.4 Ų | 131.4 | 63% | 0.629 | 76% | 0.758 | S | S | * | * | trans | -30.4 | 109.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | D77 | D77-G79 PolarHBondContact O-N 3.16Š| ||
| 80 | G | 34.1 | Very low | 45.7 | Very low | 69 Ų | 69 | 131.4 Ų | 131.4 | 71% | 0.711 | 76% | 0.756 | S | S | * | * | trans | -129 | 38.7 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112 | C78 R82 | C78-G80 PolarHBondContact O-N 3.12Å; G80-R82 PolarHBondContact O-N 3.28Å | ||
| 81 | R | 42.3 | Very low | 46.7 | Very low | 257 Ų | 257 | 130.2 Ų | 130.2 | 97% | 0.97 | 74% | 0.743 | S | S | * | * | trans | -63.3 | 73.2 | 163.7 | -70.6 | -175.9 | -177.8 | -125.6 | 1 | 109.3 | ||||
| 82 | R | 48.1 | Very low | 48 | Very low | 209 Ų | 209 | 131 Ų | 131 | 79% | 0.789 | 73% | 0.731 | S | S | * | * | trans | -157.2 | 94.6 | 166.6 | -119.9 | 167.1 | 83.6 | -152.3 | 8.7 | 112.5 | G80 | G80-R82 PolarHBondContact O-N 3.28Š| ||
| 83 | R | 49.4 | Very low | 49.5 | Very low | 154 Ų | 154 | 129.8 Ų | 129.8 | 58% | 0.581 | 72% | 0.715 | S | S | * | * | trans | 90.1 | 100.9 | 151.7 | -45.7 | -172.3 | 176.2 | -168.9 | 2.5 | 116 | R85 | R83-R85 HydrophobicContact CB-CB 4.36Å; R83-R85 HydrophobicContact CB-CG 3.73Å; R83-R85 VanDerWaalsContact CD-NE 3.32Å; R83-R85 PolarHBondContact O-N 3.41Å | ||
| 84 | K | 48.3 | Very low | 51.3 | Low | 219 Ų | 219 | 128 Ų | 128 | 95% | 0.952 | 71% | 0.712 | S | S | * | * | -35.4 | 77.2 | 120.6 | -165.6 | 165.2 | -175.3 | 172 | 0 | 110.4 | |||||
| 85 | R | 53.1 | Low | 53.7 | Low | 179 Ų | 179 | 126.2 Ų | 126.2 | 68% | 0.675 | 69% | 0.689 | S | S | * | * | trans | -102.9 | 93.1 | 160.9 | -85.8 | 175.3 | -170.1 | -101.9 | 14 | 102.9 | R83 | R83-R85 HydrophobicContact CB-CB 4.36Å; R83-R85 HydrophobicContact CB-CG 3.73Å; R83-R85 VanDerWaalsContact CD-NE 3.32Å; R83-R85 PolarHBondContact O-N 3.41Å | ||
| 86 | G | 39.5 | Very low | 56.1 | Low | 65 Ų | 65 | 124.8 Ų | 124.8 | 67% | 0.67 | 67% | 0.673 | S | S | * | * | 68 | 69.3 | 61.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 87 | S | 46.8 | Very low | 58.3 | Low | 35 Ų | 35 | 119 Ų | 119 | 25% | 0.245 | 65% | 0.649 | C | S | . | * | trans | -167.4 | 56.1 | 151.2 | -159.1 | 0 | 0 | 0 | 0 | 110 | G89 R91 | S87-G89 PolarHBondContact O-N 3.32Å; S87-R91 VanDerWaalsContact CB-CD 3.49Å; S87-R91 VanDerWaalsContact CB-CZ 3.45Å; S87-R91 WeakPolarHBondContact OG-CD 3.48Å; S87-R91 WeakPolarHBondContact OG-CG 3.46Å; S87-R91 PolarHBondContact OG-NE 3.39Å; S87-R91 VanDerWaalsContact OG-NE 3.16Å | ||
| 88 | A | 52.7 | Low | 60.8 | Low | 120 Ų | 120 | 112.9 Ų | 112.9 | 99% | 0.992 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.1 | 51.6 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 89 | G | 51.4 | Low | 63.2 | Low | 64 Ų | 64 | 111.2 Ų | 111.2 | 66% | 0.66 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -152.4 | -25.9 | -174.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | S87 | S87-G89 PolarHBondContact O-N 3.32Š|
| 90 | T | 60.3 | Low | 66 | Low | 127 Ų | 127 | 112.5 Ų | 112.5 | 78% | 0.779 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -159.3 | 10.2 | -175.3 | 54 | 0 | 0 | 0 | 0 | 115 | ||
| 91 | R | 67.2 | Low | 68.9 | Low | 166 Ų | 166 | 116 Ų | 116 | 63% | 0.626 | 58% | 0.575 | S | S | * | * | trans | -120.5 | 128.7 | -173.7 | -61.8 | -174 | -162.4 | 150.2 | 9.6 | 110.5 | S87 | S87-R91 VanDerWaalsContact CB-CD 3.49Å; S87-R91 VanDerWaalsContact CB-CZ 3.45Å; S87-R91 WeakPolarHBondContact OG-CD 3.48Å; S87-R91 WeakPolarHBondContact OG-CG 3.46Å; S87-R91 PolarHBondContact OG-NE 3.39Å; S87-R91 VanDerWaalsContact OG-NE 3.16Å | ||
| 92 | H | 69.6 | Low | 71.3 | Confident | 108 Ų | 108 | 111.2 Ų | 111.2 | 50% | 0.5 | 57% | 0.574 | S | S | . | * | trans | -52.3 | 151.4 | 178.7 | -56.2 | -82.1 | 0 | 0 | 0 | 112.4 | T94 M100 W106 | H92-T94 PolarHBondContact O-N 3.19Å; H92-T94 VanDerWaalsContact O-N 3.1Å; H92-T94 PolarHBondContact O-OG1 2.73Å; H92-M100 WeakPolarHBondContact CD2-CE 3.24Å; H92-M100 VanDerWaalsContact CD2-SD 3.54Å; H92-M100 WeakPolarHBondContact NE2-CE 3.42Å; H92-W106 HydrophobicContact CB-CH2 3.53Å; H92-W106 HydrophobicContact CB-CZ2 3.94Å | ||
| 93 | P | 74.7 | Confident | 73.3 | Confident | 69 Ų | 69 | 110.9 Ų | 110.9 | 45% | 0.448 | 57% | 0.573 | S | S | . | * | trans | -54.4 | 120.4 | 176.4 | 23.1 | -33.6 | 0 | 0 | 0 | 109.8 | F95 | P93-F95 HydrophobicContact CB-CD2 4.45Å; P93-F95 HydrophobicContact CB-CE2 3.84Å; P93-F95 HydrophobicContact CB-CZ 4.12Å; P93-F95 HydrophobicContact CG-CE2 3.98Å; P93-F95 PolarHBondContact O-N 3.19Å | ||
| 94 | T | 86.4 | Confident | 75.3 | Confident | 129 Ų | 129 | 105.7 Ų | 105.7 | 79% | 0.791 | 57% | 0.568 | S | S | * | * | trans | -94 | 93.2 | -177.1 | -55 | 0 | 0 | 0 | 0 | 108.8 | H92 | H92-T94 PolarHBondContact O-N 3.19Å; H92-T94 VanDerWaalsContact O-N 3.1Å; H92-T94 PolarHBondContact O-OG1 2.73Å | ||
| 95 | F | 93.9 | Very high | 77.5 | Confident | 42 Ų | 42 | 99.7 Ų | 99.7 | 18% | 0.184 | 54% | 0.542 | C | S | . | . | trans | -79.1 | 156 | 172.2 | -61.1 | -76 | 0 | 0 | 0 | 111.8 | P93 V98 A127 E128 A131 N149 F150 | P93-F95 HydrophobicContact CB-CD2 4.45Å; P93-F95 HydrophobicContact CB-CE2 3.84Å; P93-F95 HydrophobicContact CB-CZ 4.12Å; P93-F95 HydrophobicContact CG-CE2 3.98Å; P93-F95 PolarHBondContact O-N 3.19Å; F95-V98 HydrophobicContact CB-CB 4.03Å; F95-V98 HydrophobicContact CB-CG2 3.94Å; F95-V98 PolarHBondContact O-N 3.39Å; F95-A127 HydrophobicContact CD2-CB 3.7Å; F95-A127 HydrophobicContact CE2-CB 3.65Å; F95-E128 HydrophobicContact CE2-CG 4.36Å; F95-E128 HydrophobicContact CZ-CG 4.3Å; F95-A131 HydrophobicContact CB-CB 3.67Å; F95-A131 HydrophobicContact CD1-CB 3.99Å; F95-A131 HydrophobicContact CD2-CB 4.09Å; F95-A131 HydrophobicContact CG-CB 3.66Å; F95-N149 HydrophobicContact CD1-CB 4.29Å; F95-F150 HydrophobicContact CD1-CZ 4.33Å; F95-F150 HydrophobicContact CE1-CE1 4.15Å; F95-F150 AromaticContact CE1-CZ 3.82Å; F95-F150 HydrophobicContact CE1-CZ 3.82Å; F95-F150 HydrophobicContact CZ-CZ 4.22Å | ||
| 96 | R | 92.9 | Very high | 79.5 | Confident | 121 Ų | 121 | 92.5 Ų | 92.5 | 46% | 0.457 | 52% | 0.515 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | 135.4 | 179.8 | -61.3 | 169 | 64.7 | -141 | -6 | 109.7 | V98 H134 H147 N149 | R96-V98 PolarHBondContact O-N 2.86Å; R96-H134 PolarHBondContact O-ND1 3.1Å; R96-H147 PolarHBondContact NH1-O 3.26Å; R96-N149 VanDerWaalsContact CB-OD1 3.3Å; R96-N149 WeakPolarHBondContact CB-OD1 3.47Å; R96-N149 PolarHBondContact N-OD1 3.32Å; R96-N149 PolarHBondContact O-ND2 3.48Å |
| 97 | G | 93 | Very high | 82.2 | Confident | 35 Ų | 35 | 89.7 Ų | 89.7 | 36% | 0.361 | 48% | 0.484 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 74.4 | -0.5 | -178.1 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 98 | V | 95.1 | Very high | 84.6 | Confident | 14 Ų | 14 | 88 Ų | 88 | 9% | 0.085 | 47% | 0.472 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.6 | 130.7 | -178 | 178.2 | 0 | 0 | 0 | 0 | 109.7 | F95 R96 W106 A130 A131 | F95-V98 HydrophobicContact CB-CB 4.03Å; F95-V98 HydrophobicContact CB-CG2 3.94Å; F95-V98 PolarHBondContact O-N 3.39Å; R96-V98 PolarHBondContact O-N 2.86Å; V98-W106 HydrophobicContact CG1-CB 4.33Å; V98-W106 HydrophobicContact CG1-CD2 4.25Å; V98-W106 HydrophobicContact CG1-CE3 3.38Å; V98-W106 HydrophobicContact CG1-CZ3 3.94Å; V98-A130 HydrophobicContact CB-CB 4.43Å; V98-A130 HydrophobicContact CG1-CB 3.8Å; V98-A130 HydrophobicContact CG2-CB 3.76Å; V98-A131 HydrophobicContact CG2-CB 4.03Å |
| 99 | R | 94.2 | Very high | 86.6 | Confident | 92 Ų | 92 | 84.2 Ų | 84.2 | 35% | 0.347 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.8 | 141.3 | 174.1 | 62.4 | 179 | 176.7 | 77.6 | 0.4 | 110.9 | V107 E109 | R99-V107 HydrophobicContact CG-CB 4.05Å; R99-V107 PolarHBondContact N-O 3.49Å; R99-V107 VanDerWaalsContact N-O 3.07Å; R99-V107 PolarHBondContact O-N 3.34Å; R99-E109 IonicContact CZ-OE2 3.3Å; R99-E109 IonicContact NE-OE2 3.08Å; R99-E109 PolarHBondContact NE-OE2 3.42Å; R99-E109 IonicContact NH2-OE2 3.65Å; R99-E109 PolarHBondContact NH2-OE2 3.19Å; R99-E109 VanDerWaalsContact NH2-OE2 3.08Å |
| 100 | M | 93.9 | Very high | 88.7 | Confident | 88 Ų | 88 | 81.8 Ų | 81.8 | 43% | 0.433 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.7 | 127.1 | 172.2 | -162.1 | 174.5 | 67.1 | 0 | 0 | 109.5 | H92 W106 | H92-M100 WeakPolarHBondContact CD2-CE 3.24Å; H92-M100 VanDerWaalsContact CD2-SD 3.54Å; H92-M100 WeakPolarHBondContact NE2-CE 3.42Å; M100-W106 HydrophobicContact CB-CD2 4.36Å; M100-W106 HydrophobicContact CB-CE3 3.85Å; M100-W106 HydrophobicContact CB-CH2 4.1Å; M100-W106 HydrophobicContact CB-CZ2 4.49Å; M100-W106 HydrophobicContact CB-CZ3 3.75Å; M100-W106 HydrophobicContact CG-CD2 4.35Å; M100-W106 HydrophobicContact CG-CE3 4.33Å; M100-W106 HydrophobicContact CG-CH2 4.4Å; M100-W106 HydrophobicContact CG-CZ2 4.31Å; M100-W106 HydrophobicContact CG-CZ3 4.4Å; M100-W106 HydrophobicContact SD-CH2 4.09Å; M100-W106 HydrophobicContact SD-CZ2 3.82Å |
| 101 | R | 93.7 | Very high | 90.3 | Very high | 143 Ų | 143 | 83.5 Ų | 83.5 | 54% | 0.54 | 40% | 0.398 | S | S | . | . | trans | -90.1 | 158.2 | 170.4 | -178.4 | 167.5 | -86.2 | 176.3 | -6.4 | 109.3 | W103 G104 K105 | R101-W103 HydrophobicContact CG-CB 4.3Å; R101-W103 PolarHBondContact O-N 3.46Å; R101-G104 PolarHBondContact O-N 3.46Å; R101-K105 PolarHBondContact N-O 3.22Å | ||
| 102 | V | 93.6 | Very high | 91.3 | Very high | 156 Ų | 156 | 76.8 Ų | 76.8 | 95% | 0.945 | 37% | 0.374 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55 | -22.2 | 175 | -63 | 0 | 0 | 0 | 0 | 114 | G104 | V102-G104 PolarHBondContact O-N 3.28Š|
| 103 | W | 89.4 | Confident | 92.2 | Very high | 203 Ų | 203 | 77 Ų | 77 | 77% | 0.769 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | -11.2 | 171.9 | -177.5 | -109.7 | 0 | 0 | 0 | 113.7 | R101 K105 | R101-W103 HydrophobicContact CG-CB 4.3Å; R101-W103 PolarHBondContact O-N 3.46Å; W103-K105 VanDerWaalsContact C-N 3.32Å; W103-K105 HydrophobicContact CG-CG 4.44Å; W103-K105 PolarHBondContact O-N 3.28Å |
| 104 | G | 92.4 | Very high | 92.9 | Very high | 45 Ų | 45 | 85.1 Ų | 85.1 | 46% | 0.464 | 41% | 0.406 | S | S | . | . | S | Bend | trans | 82 | 4.9 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | R101 V102 | R101-G104 PolarHBondContact O-N 3.46Å; V102-G104 PolarHBondContact O-N 3.28Å |
| 105 | K | 94.2 | Very high | 93 | Very high | 93 Ų | 93 | 83.5 Ų | 83.5 | 40% | 0.404 | 39% | 0.389 | S | S | . | . | trans | -94 | 144.9 | 172.1 | -61.1 | -70.3 | -178.2 | -179.9 | 0 | 111 | R101 W103 | R101-K105 PolarHBondContact N-O 3.22Å; W103-K105 VanDerWaalsContact C-N 3.32Å; W103-K105 HydrophobicContact CG-CG 4.44Å; W103-K105 PolarHBondContact O-N 3.28Å | ||
| 106 | W | 95.8 | Very high | 92.9 | Very high | 28 Ų | 28 | 91.6 Ų | 91.6 | 11% | 0.106 | 42% | 0.424 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.1 | 130 | 174.2 | -62.9 | 93.7 | 0 | 0 | 0 | 109.2 | H92 V98 M100 T123 F124 A127 A130 | H92-W106 HydrophobicContact CB-CH2 3.53Å; H92-W106 HydrophobicContact CB-CZ2 3.94Å; V98-W106 HydrophobicContact CG1-CB 4.33Å; V98-W106 HydrophobicContact CG1-CD2 4.25Å; V98-W106 HydrophobicContact CG1-CE3 3.38Å; V98-W106 HydrophobicContact CG1-CZ3 3.94Å; M100-W106 HydrophobicContact CB-CD2 4.36Å; M100-W106 HydrophobicContact CB-CE3 3.85Å; M100-W106 HydrophobicContact CB-CH2 4.1Å; M100-W106 HydrophobicContact CB-CZ2 4.49Å; M100-W106 HydrophobicContact CB-CZ3 3.75Å; M100-W106 HydrophobicContact CG-CD2 4.35Å; M100-W106 HydrophobicContact CG-CE3 4.33Å; M100-W106 HydrophobicContact CG-CH2 4.4Å; M100-W106 HydrophobicContact CG-CZ2 4.31Å; M100-W106 HydrophobicContact CG-CZ3 4.4Å; M100-W106 HydrophobicContact SD-CH2 4.09Å; M100-W106 HydrophobicContact SD-CZ2 3.82Å; W106-T123 CarbonylContact O-C 3.47Å; W106-T123 VanDerWaalsContact O-CA 3.25Å; W106-T123 WeakPolarHBondContact O-CA 3.38Å; W106-F124 WeakPolarHBondContact CB-O 3.32Å; W106-F124 PolarHBondContact N-O 3.43Å; W106-F124 PolarHBondContact O-N 3.28Å; W106-A127 HydrophobicContact CD2-CB 3.74Å; W106-A127 HydrophobicContact CE3-CB 3.98Å; W106-A127 HydrophobicContact CG-CB 4.33Å; W106-A127 HydrophobicContact CH2-CB 3.81Å; W106-A127 HydrophobicContact CZ2-CB 3.66Å; W106-A127 HydrophobicContact CZ3-CB 3.98Å; W106-A130 HydrophobicContact CB-CB 3.91Å |
| 107 | V | 95.4 | Very high | 92.9 | Very high | 5 Ų | 5 | 89.5 Ų | 89.5 | 3% | 0.03 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.8 | 131.7 | 178.2 | -169.6 | 0 | 0 | 0 | 0 | 108.8 | R99 T123 | R99-V107 HydrophobicContact CG-CB 4.05Å; R99-V107 PolarHBondContact N-O 3.49Å; R99-V107 VanDerWaalsContact N-O 3.07Å; R99-V107 PolarHBondContact O-N 3.34Å; V107-T123 HydrophobicContact CB-CG2 4.43Å; V107-T123 HydrophobicContact CG1-CG2 4.16Å; V107-T123 HydrophobicContact CG2-CG2 3.97Å |
| 108 | S | 96.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 94.6 Ų | 94.6 | 0% | 0 | 44% | 0.436 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.5 | 125.3 | 175.3 | -164.5 | 0 | 0 | 0 | 0 | 109.8 | L121 G122 A130 H134 | S108-L121 WeakPolarHBondContact O-CB 3.41Å; S108-L121 PolarHBondContact O-N 2.69Å; S108-G122 PolarHBondContact N-O 3.4Å; S108-G122 PolarHBondContact O-N 3.33Å; S108-A130 WeakPolarHBondContact CB-O 3.48Å; S108-A130 PolarHBondContact OG-O 3.33Å; S108-H134 WeakPolarHBondContact OG-CB 3.27Å |
| 109 | E | 95.7 | Very high | 92.9 | Very high | 41 Ų | 41 | 94.3 Ų | 94.3 | 19% | 0.192 | 43% | 0.434 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.6 | 149.6 | 177.3 | 65 | -176.3 | -119.3 | 0 | 0 | 109.8 | R99 R118 I119 | R99-E109 IonicContact CZ-OE2 3.3Å; R99-E109 IonicContact NE-OE2 3.08Å; R99-E109 PolarHBondContact NE-OE2 3.42Å; R99-E109 IonicContact NH2-OE2 3.65Å; R99-E109 PolarHBondContact NH2-OE2 3.19Å; R99-E109 VanDerWaalsContact NH2-OE2 3.08Å; E109-R118 IonicContact OE1-NH1 3.09Å; E109-R118 PolarHBondContact OE1-NH1 2.85Å; E109-I119 WeakPolarHBondContact CA-O 3.23Å |
| 110 | I | 95 | Very high | 93 | Very high | 12 Ų | 12 | 96.9 Ų | 96.9 | 6% | 0.062 | 44% | 0.444 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 145.3 | 177.8 | -167 | 155 | 0 | 0 | 0 | 112 | I119 L121 A137 A138 I141 | I110-I119 HydrophobicContact CG2-CB 3.89Å; I110-I119 PolarHBondContact N-O 3.48Å; I110-I119 PolarHBondContact O-N 3.24Å; I110-L121 HydrophobicContact CB-CD1 4.4Å; I110-L121 HydrophobicContact CG2-CD1 4.43Å; I110-L121 HydrophobicContact CG2-CD2 4.22Å; I110-L121 HydrophobicContact CG2-CG 4.45Å; I110-A137 HydrophobicContact CB-CB 4.39Å; I110-A137 HydrophobicContact CD1-CB 3.98Å; I110-A137 HydrophobicContact CG2-CB 4.01Å; I110-A138 HydrophobicContact CD1-CB 4.02Å; I110-I141 HydrophobicContact CB-CD1 4.39Å; I110-I141 HydrophobicContact CD1-CD1 3.83Å; I110-I141 HydrophobicContact CG1-CD1 3.96Å; I110-I141 HydrophobicContact CG2-CD1 3.56Å |
| 111 | R | 93.7 | Very high | 93.1 | Very high | 164 Ų | 164 | 93.3 Ų | 93.3 | 62% | 0.619 | 43% | 0.426 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -109.9 | 122.1 | 173.7 | -62.3 | -176.3 | 179.4 | -178.6 | 2.2 | 109 | R118 | R111-R118 HydrophobicContact CG-CG 4.31Å; R111-R118 VanDerWaalsContact NH2-CZ 3.3Å |
| 112 | E | 89.5 | Confident | 93.2 | Very high | 25 Ų | 25 | 87 Ų | 87 | 12% | 0.117 | 41% | 0.405 | C | S | . | . | trans | -79.1 | 138.8 | 172 | -60.1 | -172.7 | -142.7 | 0 | 0 | 110 | R114 K115 I119 I141 | E112-R114 VanDerWaalsContact C-N 3.29Å; E112-R114 PolarHBondContact O-N 3.12Å; E112-K115 HydrophobicContact CB-CB 4.1Å; E112-K115 HydrophobicContact CB-CG 4.34Å; E112-K115 IonicContact OE1-NZ 2.82Å; E112-K115 PolarHBondContact OE1-NZ 3.01Å; E112-K115 WeakPolarHBondContact OE2-CD 3.47Å; E112-K115 WeakPolarHBondContact OE2-CE 3.29Å; E112-K115 WeakPolarHBondContact OE2-CG 3.43Å; E112-K115 IonicContact OE2-NZ 2.86Å; E112-K115 PolarHBondContact OE2-NZ 3Å; E112-I119 VanDerWaalsContact OE1-CD1 3.25Å; E112-I119 WeakPolarHBondContact OE1-CD1 3.3Å; E112-I141 HydrophobicContact CB-CG2 4.12Å; E112-I141 HydrophobicContact CG-CB 4.49Å; E112-I141 HydrophobicContact CG-CD1 3.65Å; E112-I141 HydrophobicContact CG-CG1 3.91Å; E112-I141 HydrophobicContact CG-CG2 3.74Å | ||
| 113 | P | 88.2 | Confident | 93.4 | Very high | 112 Ų | 112 | 83.2 Ų | 83.2 | 73% | 0.727 | 38% | 0.383 | S | S | * | . | S | Bend | trans | -68.8 | -28.5 | 179.9 | 26.4 | -33.6 | 0 | 0 | 0 | 112.8 | ||
| 114 | R | 88.6 | Confident | 93.7 | Very high | 239 Ų | 239 | 74.7 Ų | 74.7 | 90% | 0.902 | 35% | 0.351 | S | S | * | . | S | Bend | trans | -88.3 | -23.3 | -177.3 | -68.2 | -176.1 | 171.6 | -175.6 | -2.3 | 113.6 | E112 | E112-R114 VanDerWaalsContact C-N 3.29Å; E112-R114 PolarHBondContact O-N 3.12Å |
| 115 | K | 89.2 | Confident | 93.8 | Very high | 96 Ų | 96 | 76.3 Ų | 76.3 | 42% | 0.417 | 35% | 0.353 | S | S | . | . | trans | -108.3 | 148.5 | -175.8 | -56.4 | -174.5 | -167.6 | 145.9 | 0 | 110.3 | E112 S117 | E112-K115 HydrophobicContact CB-CB 4.1Å; E112-K115 HydrophobicContact CB-CG 4.34Å; E112-K115 IonicContact OE1-NZ 2.82Å; E112-K115 PolarHBondContact OE1-NZ 3.01Å; E112-K115 WeakPolarHBondContact OE2-CD 3.47Å; E112-K115 WeakPolarHBondContact OE2-CE 3.29Å; E112-K115 WeakPolarHBondContact OE2-CG 3.43Å; E112-K115 IonicContact OE2-NZ 2.86Å; E112-K115 PolarHBondContact OE2-NZ 3Å; K115-S117 VanDerWaalsContact C-N 3.26Å | ||
| 116 | K | 91.4 | Very high | 93.8 | Very high | 212 Ų | 212 | 73.7 Ų | 73.7 | 92% | 0.922 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -79 | -14.9 | 169.9 | -170.1 | 58.1 | 174.5 | -171.1 | 0 | 112.6 | ||
| 117 | S | 91.8 | Very high | 93.8 | Very high | 77 Ų | 77 | 72.5 Ų | 72.5 | 54% | 0.538 | 34% | 0.341 | S | S | . | . | trans | -75.3 | 153.4 | -179.4 | -167.8 | 0 | 0 | 0 | 0 | 112 | K115 | K115-S117 VanDerWaalsContact C-N 3.26Š| ||
| 118 | R | 94 | Very high | 93.8 | Very high | 142 Ų | 142 | 75.2 Ų | 75.2 | 54% | 0.536 | 35% | 0.354 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.2 | 143.8 | 171.6 | -54.8 | -173.8 | -172 | -176.7 | 12.1 | 108.2 | E109 R111 | E109-R118 IonicContact OE1-NH1 3.09Å; E109-R118 PolarHBondContact OE1-NH1 2.85Å; R111-R118 HydrophobicContact CG-CG 4.31Å; R111-R118 VanDerWaalsContact NH2-CZ 3.3Å |
| 119 | I | 94.9 | Very high | 93.8 | Very high | 7 Ų | 7 | 76.3 Ų | 76.3 | 4% | 0.036 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 117 | 172.7 | -58.3 | 171.3 | 0 | 0 | 0 | 107.1 | E109 I110 E112 L121 I141 P165 I168 Q169 | E109-I119 WeakPolarHBondContact CA-O 3.23Å; I110-I119 HydrophobicContact CG2-CB 3.89Å; I110-I119 PolarHBondContact N-O 3.48Å; I110-I119 PolarHBondContact O-N 3.24Å; E112-I119 VanDerWaalsContact OE1-CD1 3.25Å; E112-I119 WeakPolarHBondContact OE1-CD1 3.3Å; I119-L121 HydrophobicContact CG2-CD2 3.99Å; I119-I141 HydrophobicContact CD1-CD1 4.28Å; I119-P165 HydrophobicContact CD1-CB 4.31Å; I119-P165 HydrophobicContact CD1-CG 4.46Å; I119-P165 HydrophobicContact CG1-CB 4.29Å; I119-P165 HydrophobicContact CG2-CB 4.23Å; I119-I168 HydrophobicContact CD1-CD1 4.12Å; I119-Q169 HydrophobicContact CG2-CG 4.38Å |
| 120 | W | 95.6 | Very high | 93.8 | Very high | 147 Ų | 147 | 74.4 Ų | 74.4 | 56% | 0.557 | 35% | 0.35 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78.3 | 117.6 | 169.7 | 175.5 | 59.1 | 0 | 0 | 0 | 108.1 | G122 T123 Q169 | W120-G122 PolarHBondContact NE1-O 3.42Å; W120-T123 HydrophobicContact CZ2-CG2 4.07Å; W120-Q169 WeakPolarHBondContact O-CG 3.14Å; W120-Q169 PolarHBondContact O-NE2 3.49Å |
| 121 | L | 96.7 | Very high | 93.8 | Very high | 12 Ų | 12 | 73.8 Ų | 73.8 | 6% | 0.063 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.7 | -37.7 | -176 | -59.2 | 172.9 | 0 | 0 | 0 | 111.2 | S108 I110 I119 H134 A137 I168 A172 | S108-L121 WeakPolarHBondContact O-CB 3.41Å; S108-L121 PolarHBondContact O-N 2.69Å; I110-L121 HydrophobicContact CB-CD1 4.4Å; I110-L121 HydrophobicContact CG2-CD1 4.43Å; I110-L121 HydrophobicContact CG2-CD2 4.22Å; I110-L121 HydrophobicContact CG2-CG 4.45Å; I119-L121 HydrophobicContact CG2-CD2 3.99Å; L121-H134 HydrophobicContact CD1-CB 4.44Å; L121-A137 HydrophobicContact CD1-CB 3.53Å; L121-A137 HydrophobicContact CD2-CB 3.56Å; L121-A137 HydrophobicContact CG-CB 4.19Å; L121-I168 HydrophobicContact CD2-CG2 3.72Å; L121-A172 HydrophobicContact CD2-CB 4.42Å |
| 122 | G | 96.5 | Very high | 93.9 | Very high | 10 Ų | 10 | 67.2 Ų | 67.2 | 10% | 0.103 | 32% | 0.322 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 158.1 | -175 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | S108 W120 | S108-G122 PolarHBondContact N-O 3.4Å; S108-G122 PolarHBondContact O-N 3.33Å; W120-G122 PolarHBondContact NE1-O 3.42Å |
| 123 | T | 96.7 | Very high | 94.3 | Very high | 78 Ų | 78 | 66 Ų | 66 | 48% | 0.479 | 32% | 0.317 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.3 | 132.2 | 171.5 | 54.5 | 0 | 0 | 0 | 0 | 109.5 | W106 V107 W120 | W106-T123 CarbonylContact O-C 3.47Å; W106-T123 VanDerWaalsContact O-CA 3.25Å; W106-T123 WeakPolarHBondContact O-CA 3.38Å; V107-T123 HydrophobicContact CB-CG2 4.43Å; V107-T123 HydrophobicContact CG1-CG2 4.16Å; V107-T123 HydrophobicContact CG2-CG2 3.97Å; W120-T123 HydrophobicContact CZ2-CG2 4.07Å |
| 124 | F | 96.2 | Very high | 94.7 | Very high | 24 Ų | 24 | 61.6 Ų | 61.6 | 11% | 0.105 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126 | 153.4 | -170.7 | -56.7 | -78.8 | 0 | 0 | 0 | 111.1 | W106 M129 A130 A133 A176 | W106-F124 WeakPolarHBondContact CB-O 3.32Å; W106-F124 PolarHBondContact N-O 3.43Å; W106-F124 PolarHBondContact O-N 3.28Å; F124-M129 HydrophobicContact CB-CB 3.97Å; F124-M129 HydrophobicContact CD1-CB 4.23Å; F124-M129 HydrophobicContact CG-CB 4.22Å; F124-A130 HydrophobicContact CB-CB 4.07Å; F124-A130 VanDerWaalsContact CD2-CA 3.43Å; F124-A130 HydrophobicContact CD2-CB 3.68Å; F124-A130 HydrophobicContact CG-CB 4.22Å; F124-A133 HydrophobicContact CD2-CB 4.48Å; F124-A133 HydrophobicContact CE1-CB 4.43Å; F124-A133 HydrophobicContact CE2-CB 3.57Å; F124-A133 HydrophobicContact CZ-CB 3.54Å; F124-A176 HydrophobicContact CD1-CB 3.67Å; F124-A176 HydrophobicContact CE1-CB 3.2Å; F124-A176 HydrophobicContact CZ-CB 3.9Å |
| 125 | P | 94.5 | Very high | 95 | Very high | 78 Ų | 78 | 50.2 Ų | 50.2 | 51% | 0.506 | 24% | 0.244 | S | C | . | . | S | Bend | trans | -75.4 | -31.2 | 178 | 29.7 | -34.3 | 0 | 0 | 0 | 113 | M129 | P125-M129 HydrophobicContact CG-CE 3.92Å; P125-M129 HydrophobicContact CG-SD 3.65Å |
| 126 | T | 94.9 | Very high | 95.3 | Very high | 39 Ų | 39 | 45.7 Ų | 45.7 | 24% | 0.239 | 22% | 0.224 | C | C | . | . | S | Bend | trans | -112.7 | 158.4 | 178.4 | 70.2 | 0 | 0 | 0 | 0 | 111.8 | E128 M129 A130 | T126-E128 VanDerWaalsContact C-N 3.31Å; T126-E128 WeakPolarHBondContact CB-OE2 3.39Å; T126-M129 HydrophobicContact CG2-CE 3.66Å; T126-M129 WeakPolarHBondContact OG1-CB 3.34Å; T126-M129 WeakPolarHBondContact OG1-CE 3.1Å; T126-M129 WeakPolarHBondContact OG1-CG 3.34Å; T126-M129 PolarHBondContact OG1-N 3.37Å; T126-A130 PolarHBondContact O-N 3.43Å |
| 127 | A | 94.9 | Very high | 95.6 | Very high | 2 Ų | 2 | 35.6 Ų | 35.6 | 2% | 0.017 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -73.3 | -32.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | F95 W106 A130 A131 | F95-A127 HydrophobicContact CD2-CB 3.7Å; F95-A127 HydrophobicContact CE2-CB 3.65Å; W106-A127 HydrophobicContact CD2-CB 3.74Å; W106-A127 HydrophobicContact CE3-CB 3.98Å; W106-A127 HydrophobicContact CG-CB 4.33Å; W106-A127 HydrophobicContact CH2-CB 3.81Å; W106-A127 HydrophobicContact CZ2-CB 3.66Å; W106-A127 HydrophobicContact CZ3-CB 3.98Å; A127-A130 PolarHBondContact O-N 2.91Å; A127-A131 VanDerWaalsContact O-CB 3.29Å; A127-A131 WeakPolarHBondContact O-CB 3.49Å; A127-A131 PolarHBondContact O-N 3.42Å |
| 128 | E | 95.2 | Very high | 95.7 | Very high | 63 Ų | 63 | 32.4 Ų | 32.4 | 29% | 0.294 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -69 | -45.1 | -178.5 | -63.4 | 68.6 | -149.7 | 0 | 0 | 111 | F95 T126 A131 R132 | F95-E128 HydrophobicContact CE2-CG 4.36Å; F95-E128 HydrophobicContact CZ-CG 4.3Å; T126-E128 VanDerWaalsContact C-N 3.31Å; T126-E128 WeakPolarHBondContact CB-OE2 3.39Å; E128-A131 PolarHBondContact O-N 3.38Å; E128-R132 PolarHBondContact O-N 3.03Å; E128-R132 PolarHBondContact O-NE 3.28Å |
| 129 | M | 95.7 | Very high | 95.7 | Very high | 23 Ų | 23 | 27.7 Ų | 27.7 | 11% | 0.113 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -60.3 | -45.9 | 171.8 | -74 | 174.8 | -143.4 | 0 | 0 | 111 | F124 P125 T126 A131 R132 A133 A176 A179 A180 | F124-M129 HydrophobicContact CB-CB 3.97Å; F124-M129 HydrophobicContact CD1-CB 4.23Å; F124-M129 HydrophobicContact CG-CB 4.22Å; P125-M129 HydrophobicContact CG-CE 3.92Å; P125-M129 HydrophobicContact CG-SD 3.65Å; T126-M129 HydrophobicContact CG2-CE 3.66Å; T126-M129 WeakPolarHBondContact OG1-CB 3.34Å; T126-M129 WeakPolarHBondContact OG1-CE 3.1Å; T126-M129 WeakPolarHBondContact OG1-CG 3.34Å; T126-M129 PolarHBondContact OG1-N 3.37Å; M129-A131 VanDerWaalsContact C-N 3.29Å; M129-A131 PolarHBondContact O-N 3.39Å; M129-R132 PolarHBondContact O-N 2.85Å; M129-A133 PolarHBondContact O-N 2.94Å; M129-A176 HydrophobicContact CB-CB 4.36Å; M129-A179 HydrophobicContact CG-CB 3.9Å; M129-A180 HydrophobicContact CE-CB 3.68Å; M129-A180 HydrophobicContact SD-CB 4.14Å |
| 130 | A | 96.5 | Very high | 95.7 | Very high | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.2 | -37.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | V98 W106 S108 F124 T126 A127 H134 | V98-A130 HydrophobicContact CB-CB 4.43Å; V98-A130 HydrophobicContact CG1-CB 3.8Å; V98-A130 HydrophobicContact CG2-CB 3.76Å; W106-A130 HydrophobicContact CB-CB 3.91Å; S108-A130 WeakPolarHBondContact CB-O 3.48Å; S108-A130 PolarHBondContact OG-O 3.33Å; F124-A130 HydrophobicContact CB-CB 4.07Å; F124-A130 VanDerWaalsContact CD2-CA 3.43Å; F124-A130 HydrophobicContact CD2-CB 3.68Å; F124-A130 HydrophobicContact CG-CB 4.22Å; T126-A130 PolarHBondContact O-N 3.43Å; A127-A130 PolarHBondContact O-N 2.91Å; A130-H134 PolarHBondContact O-N 2.9Å; A130-H134 VanDerWaalsContact O-N 3.08Å |
| 131 | A | 96 | Very high | 95.6 | Very high | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -71.1 | -40.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112 | F95 V98 A127 E128 M129 H134 D135 N149 F150 | F95-A131 HydrophobicContact CB-CB 3.67Å; F95-A131 HydrophobicContact CD1-CB 3.99Å; F95-A131 HydrophobicContact CD2-CB 4.09Å; F95-A131 HydrophobicContact CG-CB 3.66Å; V98-A131 HydrophobicContact CG2-CB 4.03Å; A127-A131 VanDerWaalsContact O-CB 3.29Å; A127-A131 WeakPolarHBondContact O-CB 3.49Å; A127-A131 PolarHBondContact O-N 3.42Å; E128-A131 PolarHBondContact O-N 3.38Å; M129-A131 VanDerWaalsContact C-N 3.29Å; M129-A131 PolarHBondContact O-N 3.39Å; A131-H134 WeakPolarHBondContact O-CB 3.38Å; A131-H134 PolarHBondContact O-N 3.46Å; A131-D135 PolarHBondContact O-N 3.37Å; A131-N149 HydrophobicContact CB-CB 4.33Å; A131-F150 HydrophobicContact CB-CE2 3.55Å; A131-F150 HydrophobicContact CB-CZ 4.11Å |
| 132 | R | 95.5 | Very high | 95.4 | Very high | 25 Ų | 25 | 28.9 Ų | 28.9 | 9% | 0.094 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -63.1 | -42.6 | 173.7 | -77.7 | 179.9 | -81.9 | -158.5 | 7 | 111.9 | E128 M129 H134 D135 V136 F150 A179 D183 | E128-R132 PolarHBondContact O-N 3.03Å; E128-R132 PolarHBondContact O-NE 3.28Å; M129-R132 PolarHBondContact O-N 2.85Å; R132-H134 VanDerWaalsContact C-N 3.3Å; R132-H134 PolarHBondContact O-N 2.95Å; R132-D135 PolarHBondContact O-N 3.43Å; R132-V136 PolarHBondContact O-N 2.94Å; R132-F150 HydrophobicContact CG-CD2 3.69Å; R132-F150 HydrophobicContact CG-CE2 3.71Å; R132-A179 HydrophobicContact CB-CB 4.44Å; R132-A179 PolarHBondContact NH1-O 3.02Å; R132-A179 VanDerWaalsContact NH2-C 3.29Å; R132-A179 VanDerWaalsContact NH2-CA 3.3Å; R132-A179 PolarHBondContact NH2-O 3.49Å; R132-D183 IonicContact NH2-OD1 3.29Å; R132-D183 PolarHBondContact NH2-OD1 3.5Å; R132-D183 IonicContact NH2-OD2 3.46Å; R132-D183 PolarHBondContact NH2-OD2 3.34Å; R132-D183 VanDerWaalsContact NH2-OD2 3.09Å |
| 133 | A | 96.6 | Very high | 95.1 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.1 | -41.4 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | F124 M129 A137 A172 A176 | F124-A133 HydrophobicContact CD2-CB 4.48Å; F124-A133 HydrophobicContact CE1-CB 4.43Å; F124-A133 HydrophobicContact CE2-CB 3.57Å; F124-A133 HydrophobicContact CZ-CB 3.54Å; M129-A133 PolarHBondContact O-N 2.94Å; A133-A137 PolarHBondContact O-N 3.18Å; A133-A172 HydrophobicContact CB-CB 4.01Å; A133-A176 HydrophobicContact CB-CB 4.37Å |
| 134 | H | 96.8 | Very high | 94.7 | Very high | 19 Ų | 19 | 36.9 Ų | 36.9 | 9% | 0.088 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -66.9 | -38.1 | 177.3 | -176.3 | -90.5 | 0 | 0 | 0 | 112.5 | R96 S108 L121 A130 A131 R132 A137 A138 | R96-H134 PolarHBondContact O-ND1 3.1Å; S108-H134 WeakPolarHBondContact OG-CB 3.27Å; L121-H134 HydrophobicContact CD1-CB 4.44Å; A130-H134 PolarHBondContact O-N 2.9Å; A130-H134 VanDerWaalsContact O-N 3.08Å; A131-H134 WeakPolarHBondContact O-CB 3.38Å; A131-H134 PolarHBondContact O-N 3.46Å; R132-H134 VanDerWaalsContact C-N 3.3Å; R132-H134 PolarHBondContact O-N 2.95Å; H134-A137 PolarHBondContact O-N 3.18Å; H134-A138 WeakPolarHBondContact O-CB 3.44Å; H134-A138 PolarHBondContact O-N 2.98Å |
| 135 | D | 95.9 | Very high | 94.2 | Very high | 1 Ų | 1 | 38.2 Ų | 38.2 | 1% | 0.005 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -64.7 | -40.3 | -179.3 | -74.1 | -6.2 | 0 | 0 | 0 | 112.1 | A131 R132 A137 A138 L139 L148 N149 F150 L157 | A131-D135 PolarHBondContact O-N 3.37Å; R132-D135 PolarHBondContact O-N 3.43Å; D135-A137 VanDerWaalsContact C-N 3.35Å; D135-A137 PolarHBondContact O-N 3.17Å; D135-A138 PolarHBondContact O-N 2.85Å; D135-L139 WeakPolarHBondContact O-CG 3.48Å; D135-L139 PolarHBondContact O-N 3.06Å; D135-L148 HydrophobicContact CB-CB 4.31Å; D135-L148 HydrophobicContact CB-CD2 4.09Å; D135-N149 VanDerWaalsContact CG-N 3.3Å; D135-N149 PolarHBondContact OD1-N 2.87Å; D135-N149 PolarHBondContact OD1-ND2 2.94Å; D135-N149 WeakPolarHBondContact OD2-CB 3.42Å; D135-N149 PolarHBondContact OD2-N 2.95Å; D135-F150 WeakPolarHBondContact OD2-CD2 3.46Å; D135-F150 PolarHBondContact OD2-N 3.11Å; D135-L157 HydrophobicContact CB-CD1 3.71Å |
| 136 | V | 95.9 | Very high | 94.1 | Very high | 1 Ų | 1 | 35.1 Ų | 35.1 | 1% | 0.006 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -57.9 | -48.1 | 171.8 | 175 | 0 | 0 | 0 | 0 | 111.3 | R132 A138 L139 A140 L157 P158 A171 A175 | R132-V136 PolarHBondContact O-N 2.94Å; V136-A138 VanDerWaalsContact C-N 3.34Å; V136-A138 PolarHBondContact O-N 3.46Å; V136-L139 PolarHBondContact O-N 3.03Å; V136-A140 PolarHBondContact O-N 3.09Å; V136-L157 HydrophobicContact CG2-CB 4.12Å; V136-L157 HydrophobicContact CG2-CD1 4.31Å; V136-L157 HydrophobicContact CG2-CD2 3.99Å; V136-L157 HydrophobicContact CG2-CG 4.35Å; V136-P158 WeakPolarHBondContact CG1-O 3.12Å; V136-P158 HydrophobicContact CG2-CG 4.21Å; V136-A171 HydrophobicContact CG1-CB 3.67Å; V136-A175 HydrophobicContact CG2-CB 3.37Å |
| 137 | A | 96 | Very high | 93.9 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -65.8 | -39.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112 | I110 L121 A133 H134 D135 A140 I141 I168 | I110-A137 HydrophobicContact CB-CB 4.39Å; I110-A137 HydrophobicContact CD1-CB 3.98Å; I110-A137 HydrophobicContact CG2-CB 4.01Å; L121-A137 HydrophobicContact CD1-CB 3.53Å; L121-A137 HydrophobicContact CD2-CB 3.56Å; L121-A137 HydrophobicContact CG-CB 4.19Å; A133-A137 PolarHBondContact O-N 3.18Å; H134-A137 PolarHBondContact O-N 3.18Å; D135-A137 VanDerWaalsContact C-N 3.35Å; D135-A137 PolarHBondContact O-N 3.17Å; A137-A140 WeakPolarHBondContact O-CB 3.25Å; A137-A140 PolarHBondContact O-N 3.31Å; A137-I141 PolarHBondContact O-N 3.48Å; A137-I168 HydrophobicContact CB-CG2 3.57Å |
| 138 | A | 95 | Very high | 93.9 | Very high | 10 Ų | 10 | 41.2 Ų | 41.2 | 8% | 0.083 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.3 | -43.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | I110 H134 D135 V136 A140 I141 K142 A146 L148 | I110-A138 HydrophobicContact CD1-CB 4.02Å; H134-A138 WeakPolarHBondContact O-CB 3.44Å; H134-A138 PolarHBondContact O-N 2.98Å; D135-A138 PolarHBondContact O-N 2.85Å; V136-A138 VanDerWaalsContact C-N 3.34Å; V136-A138 PolarHBondContact O-N 3.46Å; A138-A140 VanDerWaalsContact C-N 3.31Å; A138-A140 PolarHBondContact O-N 2.9Å; A138-I141 PolarHBondContact O-N 3.43Å; A138-K142 VanDerWaalsContact O-CB 3.27Å; A138-K142 WeakPolarHBondContact O-CB 3.46Å; A138-K142 PolarHBondContact O-N 3.41Å; A138-A146 HydrophobicContact CB-CB 4.23Å; A138-A146 WeakPolarHBondContact O-CB 3.41Å; A138-L148 HydrophobicContact CB-CD2 3.98Å |
| 139 | L | 94.3 | Very high | 93.9 | Very high | 43 Ų | 43 | 39.8 Ų | 39.8 | 23% | 0.225 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.4 | -41.6 | 173.4 | -78.5 | 173.3 | 0 | 0 | 0 | 112.1 | D135 V136 G143 A146 L148 L157 | D135-L139 WeakPolarHBondContact O-CG 3.48Å; D135-L139 PolarHBondContact O-N 3.06Å; V136-L139 PolarHBondContact O-N 3.03Å; L139-G143 WeakPolarHBondContact O-CA 3.3Å; L139-G143 PolarHBondContact O-N 3.29Å; L139-A146 HydrophobicContact CD2-CB 4.24Å; L139-L148 HydrophobicContact CD1-CD1 3.95Å; L139-L148 HydrophobicContact CD2-CD1 3.97Å; L139-L148 HydrophobicContact CD2-CD2 4.21Å; L139-L148 HydrophobicContact CG-CD1 3.9Å; L139-L148 HydrophobicContact CG-CD2 3.87Å; L139-L148 HydrophobicContact CG-CG 4.48Å; L139-L157 HydrophobicContact CD1-CB 4.33Å; L139-L157 HydrophobicContact CD1-CD1 3.9Å |
| 140 | A | 94.1 | Very high | 93.8 | Very high | 22 Ų | 22 | 40.3 Ų | 40.3 | 18% | 0.182 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -65.2 | -43.1 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113 | V136 A137 A138 P160 I168 | V136-A140 PolarHBondContact O-N 3.09Å; A137-A140 WeakPolarHBondContact O-CB 3.25Å; A137-A140 PolarHBondContact O-N 3.31Å; A138-A140 VanDerWaalsContact C-N 3.31Å; A138-A140 PolarHBondContact O-N 2.9Å; A140-P160 HydrophobicContact CB-CG 3.4Å; A140-I168 HydrophobicContact CB-CD1 4.1Å; A140-I168 HydrophobicContact CB-CG1 3.88Å |
| 141 | I | 93.5 | Very high | 93.5 | Very high | 39 Ų | 39 | 44.7 Ų | 44.7 | 20% | 0.2 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -86.8 | -42.9 | -172.9 | -69.9 | 156.9 | 0 | 0 | 0 | 112.2 | I110 E112 I119 A137 A138 I168 | I110-I141 HydrophobicContact CB-CD1 4.39Å; I110-I141 HydrophobicContact CD1-CD1 3.83Å; I110-I141 HydrophobicContact CG1-CD1 3.96Å; I110-I141 HydrophobicContact CG2-CD1 3.56Å; E112-I141 HydrophobicContact CB-CG2 4.12Å; E112-I141 HydrophobicContact CG-CB 4.49Å; E112-I141 HydrophobicContact CG-CD1 3.65Å; E112-I141 HydrophobicContact CG-CG1 3.91Å; E112-I141 HydrophobicContact CG-CG2 3.74Å; I119-I141 HydrophobicContact CD1-CD1 4.28Å; A137-I141 PolarHBondContact O-N 3.48Å; A138-I141 PolarHBondContact O-N 3.43Å; I141-I168 HydrophobicContact CD1-CD1 4.32Å; I141-I168 HydrophobicContact CG1-CD1 4.13Å |
| 142 | K | 92.9 | Very high | 93.3 | Very high | 129 Ų | 129 | 51 Ų | 51 | 56% | 0.561 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -94.8 | -17 | -174.9 | -171.7 | 64 | 160 | 177.6 | 0 | 112 | A138 A146 | A138-K142 VanDerWaalsContact O-CB 3.27Å; A138-K142 WeakPolarHBondContact O-CB 3.46Å; A138-K142 PolarHBondContact O-N 3.41Å; K142-A146 HydrophobicContact CB-CB 3.91Å; K142-A146 HydrophobicContact CG-CB 4.18Å |
| 143 | G | 90.6 | Very high | 93.1 | Very high | 31 Ų | 31 | 51.9 Ų | 51.9 | 32% | 0.32 | 27% | 0.273 | S | S | . | . | G | 310 helix | trans | 78.3 | -154.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L139 G145 A146 | L139-G143 WeakPolarHBondContact O-CA 3.3Å; L139-G143 PolarHBondContact O-N 3.29Å; G143-G145 PolarHBondContact O-N 3.03Å; G143-A146 VanDerWaalsContact O-CB 3.3Å; G143-A146 WeakPolarHBondContact O-CB 3.5Å; G143-A146 PolarHBondContact O-N 3.19Å; G143-A146 VanDerWaalsContact O-N 3.11Å |
| 144 | R | 87 | Confident | 92.7 | Very high | 225 Ų | 225 | 53 Ų | 53 | 85% | 0.849 | 28% | 0.282 | S | S | * | . | G | 310 helix | trans | -64 | -20.4 | -177.2 | -65.1 | 178.8 | -177.3 | -114 | 5.3 | 114.2 | A146 | R144-A146 VanDerWaalsContact C-N 3.26Å; R144-A146 PolarHBondContact O-N 2.83Å |
| 145 | G | 87.1 | Confident | 92.4 | Very high | 52 Ų | 52 | 59.5 Ų | 59.5 | 54% | 0.536 | 31% | 0.312 | S | S | . | . | G | 310 helix | trans | -86.9 | 14 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114 | G143 H147 | G143-G145 PolarHBondContact O-N 3.03Å; G145-H147 PolarHBondContact O-N 3.26Å |
| 146 | A | 91.7 | Very high | 92.1 | Very high | 14 Ų | 14 | 65.4 Ų | 65.4 | 12% | 0.116 | 34% | 0.344 | C | S | . | . | P | Polyproline II helix | trans | -68.8 | 126.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | A138 L139 K142 G143 R144 L148 | A138-A146 HydrophobicContact CB-CB 4.23Å; A138-A146 WeakPolarHBondContact O-CB 3.41Å; L139-A146 HydrophobicContact CD2-CB 4.24Å; K142-A146 HydrophobicContact CB-CB 3.91Å; K142-A146 HydrophobicContact CG-CB 4.18Å; G143-A146 VanDerWaalsContact O-CB 3.3Å; G143-A146 WeakPolarHBondContact O-CB 3.5Å; G143-A146 PolarHBondContact O-N 3.19Å; G143-A146 VanDerWaalsContact O-N 3.11Å; R144-A146 VanDerWaalsContact C-N 3.26Å; R144-A146 PolarHBondContact O-N 2.83Å; A146-L148 HydrophobicContact CB-CD2 3.73Å; A146-L148 PolarHBondContact O-N 3.07Å |
| 147 | H | 91.8 | Very high | 91.8 | Very high | 145 Ų | 145 | 66.1 Ų | 66.1 | 67% | 0.671 | 35% | 0.348 | S | S | * | . | P | Polyproline II helix | trans | -74.2 | 120.6 | 165.3 | -59.1 | 170.9 | 0 | 0 | 0 | 107.4 | R96 G145 | R96-H147 PolarHBondContact NH1-O 3.26Å; G145-H147 PolarHBondContact O-N 3.26Å |
| 148 | L | 94.1 | Very high | 91.6 | Very high | 24 Ų | 24 | 68.2 Ų | 68.2 | 13% | 0.126 | 36% | 0.361 | C | S | . | . | P | Polyproline II helix | trans | -103.6 | 166.8 | -179.5 | -53.4 | -175.2 | 0 | 0 | 0 | 111.5 | D135 A138 L139 A146 A154 | D135-L148 HydrophobicContact CB-CB 4.31Å; D135-L148 HydrophobicContact CB-CD2 4.09Å; A138-L148 HydrophobicContact CB-CD2 3.98Å; L139-L148 HydrophobicContact CD1-CD1 3.95Å; L139-L148 HydrophobicContact CD2-CD1 3.97Å; L139-L148 HydrophobicContact CD2-CD2 4.21Å; L139-L148 HydrophobicContact CG-CD1 3.9Å; L139-L148 HydrophobicContact CG-CD2 3.87Å; L139-L148 HydrophobicContact CG-CG 4.48Å; A146-L148 HydrophobicContact CB-CD2 3.73Å; A146-L148 PolarHBondContact O-N 3.07Å; L148-A154 HydrophobicContact CD1-CB 3.63Å |
| 149 | N | 94.2 | Very high | 91.5 | Very high | 33 Ų | 33 | 75.9 Ų | 75.9 | 18% | 0.176 | 39% | 0.388 | C | S | . | . | S | Bend | trans | -78.3 | -40.7 | 168.4 | -62.9 | -69.1 | 0 | 0 | 0 | 110.6 | F95 R96 A131 D135 P151 | F95-N149 HydrophobicContact CD1-CB 4.29Å; R96-N149 VanDerWaalsContact CB-OD1 3.3Å; R96-N149 WeakPolarHBondContact CB-OD1 3.47Å; R96-N149 PolarHBondContact N-OD1 3.32Å; R96-N149 PolarHBondContact O-ND2 3.48Å; A131-N149 HydrophobicContact CB-CB 4.33Å; D135-N149 VanDerWaalsContact CG-N 3.3Å; D135-N149 PolarHBondContact OD1-N 2.87Å; D135-N149 PolarHBondContact OD1-ND2 2.94Å; D135-N149 WeakPolarHBondContact OD2-CB 3.42Å; D135-N149 PolarHBondContact OD2-N 2.95Å; N149-P151 VanDerWaalsContact O-CD 3.24Å; N149-P151 WeakPolarHBondContact O-CD 3.37Å |
| 150 | F | 93.5 | Very high | 91.4 | Very high | 33 Ų | 33 | 75.2 Ų | 75.2 | 15% | 0.145 | 39% | 0.386 | C | S | . | . | trans | -115.2 | 81.2 | -179.7 | -53.2 | -72.8 | 0 | 0 | 0 | 111 | F95 A131 R132 D135 H152 L153 | F95-F150 HydrophobicContact CD1-CZ 4.33Å; F95-F150 HydrophobicContact CE1-CE1 4.15Å; F95-F150 AromaticContact CE1-CZ 3.82Å; F95-F150 HydrophobicContact CE1-CZ 3.82Å; F95-F150 HydrophobicContact CZ-CZ 4.22Å; A131-F150 HydrophobicContact CB-CE2 3.55Å; A131-F150 HydrophobicContact CB-CZ 4.11Å; R132-F150 HydrophobicContact CG-CD2 3.69Å; R132-F150 HydrophobicContact CG-CE2 3.71Å; D135-F150 WeakPolarHBondContact OD2-CD2 3.46Å; D135-F150 PolarHBondContact OD2-N 3.11Å; F150-H152 AromaticContact CD1-CE1 3.79Å; F150-H152 PolarHBondContact O-N 2.88Å; F150-L153 HydrophobicContact CB-CB 4.19Å; F150-L153 HydrophobicContact CB-CD1 3.95Å; F150-L153 HydrophobicContact CB-CG 4.12Å; F150-L153 HydrophobicContact CG-CD1 4.26Å; F150-L153 PolarHBondContact O-N 3.08Å | ||
| 151 | P | 91.9 | Very high | 91.2 | Very high | 93 Ų | 93 | 78.9 Ų | 78.9 | 60% | 0.604 | 42% | 0.417 | S | S | * | . | G | 310 helix | trans | -63.4 | -26.4 | -178.4 | 25.6 | -34.6 | 0 | 0 | 0 | 113.1 | N149 A154 | N149-P151 VanDerWaalsContact O-CD 3.24Å; N149-P151 WeakPolarHBondContact O-CD 3.37Å; P151-A154 VanDerWaalsContact O-CB 3.32Å; P151-A154 WeakPolarHBondContact O-CB 3.36Å; P151-A154 PolarHBondContact O-N 3.34Å |
| 152 | H | 91.9 | Very high | 91.2 | Very high | 131 Ų | 131 | 79.5 Ų | 79.5 | 61% | 0.606 | 42% | 0.424 | S | S | * | . | G | 310 helix | trans | -69.6 | -31 | 178.2 | 55.1 | -82.5 | 0 | 0 | 0 | 112.8 | F150 A154 | F150-H152 AromaticContact CD1-CE1 3.79Å; F150-H152 PolarHBondContact O-N 2.88Å; H152-A154 VanDerWaalsContact C-N 3.34Å |
| 153 | L | 90 | Very high | 91.2 | Very high | 44 Ų | 44 | 77.7 Ų | 77.7 | 23% | 0.23 | 42% | 0.424 | C | S | . | . | G | 310 helix | trans | -87.8 | -1.2 | 179.1 | -57.9 | 178.2 | 0 | 0 | 0 | 113 | F150 H155 D156 L157 | F150-L153 HydrophobicContact CB-CB 4.19Å; F150-L153 HydrophobicContact CB-CD1 3.95Å; F150-L153 HydrophobicContact CB-CG 4.12Å; F150-L153 HydrophobicContact CG-CD1 4.26Å; F150-L153 PolarHBondContact O-N 3.08Å; L153-H155 PolarHBondContact O-N 3.06Å; L153-D156 PolarHBondContact O-N 2.78Å; L153-L157 WeakPolarHBondContact O-CG 3.43Å; L153-L157 PolarHBondContact O-N 3.11Å; L153-L157 VanDerWaalsContact O-N 3.17Å |
| 154 | A | 89.4 | Confident | 91.4 | Very high | 23 Ų | 23 | 77.9 Ų | 77.9 | 19% | 0.19 | 42% | 0.421 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.3 | -26.8 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | L148 P151 H152 | L148-A154 HydrophobicContact CD1-CB 3.63Å; P151-A154 VanDerWaalsContact O-CB 3.32Å; P151-A154 WeakPolarHBondContact O-CB 3.36Å; P151-A154 PolarHBondContact O-N 3.34Å; H152-A154 VanDerWaalsContact C-N 3.34Å |
| 155 | H | 89 | Confident | 91.8 | Very high | 156 Ų | 156 | 70.4 Ų | 70.4 | 72% | 0.722 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.7 | -27.6 | 178.8 | -64.7 | -74.7 | 0 | 0 | 0 | 113.5 | L153 | L153-H155 PolarHBondContact O-N 3.06Š|
| 156 | D | 91.1 | Very high | 92.2 | Very high | 126 Ų | 126 | 70.9 Ų | 70.9 | 67% | 0.674 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | -14.6 | -175.4 | -53.1 | -36.4 | 0 | 0 | 0 | 112.4 | L153 | L153-D156 PolarHBondContact O-N 2.78Š|
| 157 | L | 89.6 | Confident | 92.5 | Very high | 16 Ų | 16 | 73 Ų | 73 | 8% | 0.084 | 41% | 0.409 | C | S | . | . | S | Bend | trans | -65.9 | 136 | 179.6 | -72.1 | 177.6 | 0 | 0 | 0 | 112 | D135 V136 L139 L153 R159 A175 | D135-L157 HydrophobicContact CB-CD1 3.71Å; V136-L157 HydrophobicContact CG2-CB 4.12Å; V136-L157 HydrophobicContact CG2-CD1 4.31Å; V136-L157 HydrophobicContact CG2-CD2 3.99Å; V136-L157 HydrophobicContact CG2-CG 4.35Å; L139-L157 HydrophobicContact CD1-CB 4.33Å; L139-L157 HydrophobicContact CD1-CD1 3.9Å; L153-L157 WeakPolarHBondContact O-CG 3.43Å; L153-L157 PolarHBondContact O-N 3.11Å; L153-L157 VanDerWaalsContact O-N 3.17Å; L157-R159 PolarHBondContact O-N 3.18Å; L157-A175 HydrophobicContact CD2-CB 4.02Å |
| 158 | P | 91.2 | Very high | 92.7 | Very high | 44 Ų | 44 | 66.1 Ų | 66.1 | 29% | 0.286 | 38% | 0.377 | S | S | . | . | P | Polyproline II helix | trans | -62.9 | 129.6 | 176.4 | 27 | -34.8 | 0 | 0 | 0 | 110.2 | V136 A171 K174 A175 | V136-P158 WeakPolarHBondContact CG1-O 3.12Å; V136-P158 HydrophobicContact CG2-CG 4.21Å; P158-A171 WeakPolarHBondContact CG-O 3.22Å; P158-K174 HydrophobicContact CG-CB 4.18Å; P158-A175 HydrophobicContact CG-CB 3.8Å |
| 159 | R | 91.9 | Very high | 92.8 | Very high | 170 Ų | 170 | 68.3 Ų | 68.3 | 64% | 0.642 | 39% | 0.387 | S | S | * | . | P | Polyproline II helix | trans | -86.3 | 126.6 | 176.6 | -63.9 | -175 | -178.9 | -154.3 | -0.2 | 109.7 | L157 | L157-R159 PolarHBondContact O-N 3.18Š|
| 160 | P | 92.9 | Very high | 93 | Very high | 29 Ų | 29 | 69.3 Ų | 69.3 | 19% | 0.188 | 40% | 0.4 | C | S | . | . | P | Polyproline II helix | trans | -66.9 | 146.7 | 173.8 | 25.3 | -28.9 | 0 | 0 | 0 | 110.4 | A140 S162 D167 I168 A171 | A140-P160 HydrophobicContact CB-CG 3.4Å; P160-S162 VanDerWaalsContact C-N 3.29Å; P160-S162 PolarHBondContact O-N 3.34Å; P160-D167 HydrophobicContact CB-CB 4.32Å; P160-I168 HydrophobicContact CB-CG1 4.36Å; P160-I168 HydrophobicContact CG-CG1 4.3Å; P160-A171 HydrophobicContact CB-CB 3.81Å; P160-A171 HydrophobicContact CG-CB 4.41Å |
| 161 | A | 90.8 | Very high | 93.1 | Very high | 100 Ų | 100 | 68.1 Ų | 68.1 | 83% | 0.826 | 40% | 0.396 | S | S | * | . | S | Bend | trans | -66.8 | -31.3 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 162 | S | 93.6 | Very high | 93.4 | Very high | 51 Ų | 51 | 63.7 Ų | 63.7 | 36% | 0.357 | 37% | 0.367 | S | S | . | . | S | Bend | trans | -145.6 | 173.7 | 177.8 | 88.4 | 0 | 0 | 0 | 0 | 111.9 | P160 S164 D167 | P160-S162 VanDerWaalsContact C-N 3.29Å; P160-S162 PolarHBondContact O-N 3.34Å; S162-S164 PolarHBondContact O-N 2.88Å; S162-S164 VanDerWaalsContact OG-CB 3.24Å; S162-S164 WeakPolarHBondContact OG-CB 3.16Å; S162-S164 PolarHBondContact OG-N 3.44Å; S162-S164 PolarHBondContact OG-OG 2.85Å; S162-D167 WeakPolarHBondContact CB-OD2 3.47Å; S162-D167 PolarHBondContact OG-OD2 2.93Å |
| 163 | T | 92.7 | Very high | 93.6 | Very high | 91 Ų | 91 | 60 Ų | 60 | 56% | 0.558 | 36% | 0.359 | S | S | * | . | S | Bend | trans | -81.9 | 15.2 | 172.3 | 57.8 | 0 | 0 | 0 | 0 | 113.1 | ||
| 164 | S | 94.3 | Very high | 93.9 | Very high | 36 Ų | 36 | 64.7 Ų | 64.7 | 25% | 0.252 | 38% | 0.378 | S | S | . | . | S | Bend | trans | -70.2 | 147.4 | 174.3 | 85 | 0 | 0 | 0 | 0 | 110.3 | S162 A166 D167 I168 | S162-S164 PolarHBondContact O-N 2.88Å; S162-S164 VanDerWaalsContact OG-CB 3.24Å; S162-S164 WeakPolarHBondContact OG-CB 3.16Å; S162-S164 PolarHBondContact OG-N 3.44Å; S162-S164 PolarHBondContact OG-OG 2.85Å; S164-A166 VanDerWaalsContact C-N 3.26Å; S164-A166 PolarHBondContact O-N 3.45Å; S164-D167 PolarHBondContact O-N 3.33Å; S164-D167 WeakPolarHBondContact OG-CB 3.41Å; S164-D167 PolarHBondContact OG-N 3.47Å; S164-D167 PolarHBondContact OG-OD2 3.24Å; S164-I168 WeakPolarHBondContact O-CD1 2.95Å; S164-I168 VanDerWaalsContact O-CG1 3.26Å; S164-I168 WeakPolarHBondContact O-CG1 3.32Å; S164-I168 PolarHBondContact O-N 3.39Å; S164-I168 VanDerWaalsContact O-N 3.15Å |
| 165 | P | 95 | Very high | 94.2 | Very high | 68 Ų | 68 | 63.8 Ų | 63.8 | 44% | 0.442 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -59 | -38.1 | 179.1 | -21 | 31 | 0 | 0 | 0 | 112.9 | I119 I168 Q169 | I119-P165 HydrophobicContact CD1-CB 4.31Å; I119-P165 HydrophobicContact CD1-CG 4.46Å; I119-P165 HydrophobicContact CG1-CB 4.29Å; I119-P165 HydrophobicContact CG2-CB 4.23Å; P165-I168 PolarHBondContact O-N 3.37Å; P165-Q169 WeakPolarHBondContact O-CB 3.13Å; P165-Q169 WeakPolarHBondContact O-CG 3.45Å; P165-Q169 PolarHBondContact O-N 3.47Å |
| 166 | A | 96.3 | Very high | 94.5 | Very high | 61 Ų | 61 | 56.7 Ų | 56.7 | 50% | 0.504 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -67.2 | -44.8 | -178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | S164 I168 Q169 A170 | S164-A166 VanDerWaalsContact C-N 3.26Å; S164-A166 PolarHBondContact O-N 3.45Å; A166-I168 VanDerWaalsContact C-N 3.33Å; A166-I168 PolarHBondContact O-N 3.01Å; A166-Q169 PolarHBondContact O-N 3.19Å; A166-A170 WeakPolarHBondContact O-CB 3.39Å; A166-A170 PolarHBondContact O-N 3.47Å |
| 167 | D | 96.9 | Very high | 94.7 | Very high | 59 Ų | 59 | 53.1 Ų | 53.1 | 32% | 0.316 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -66.7 | -38.3 | 178.5 | -63.9 | -37.2 | 0 | 0 | 0 | 111.5 | P160 S162 S164 A170 A171 | P160-D167 HydrophobicContact CB-CB 4.32Å; S162-D167 WeakPolarHBondContact CB-OD2 3.47Å; S162-D167 PolarHBondContact OG-OD2 2.93Å; S164-D167 PolarHBondContact O-N 3.33Å; S164-D167 WeakPolarHBondContact OG-CB 3.41Å; S164-D167 PolarHBondContact OG-N 3.47Å; S164-D167 PolarHBondContact OG-OD2 3.24Å; D167-A170 PolarHBondContact O-N 3.23Å; D167-A171 WeakPolarHBondContact O-CB 3.26Å; D167-A171 PolarHBondContact O-N 3.25Å |
| 168 | I | 96.2 | Very high | 94.9 | Very high | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -63.2 | -44.8 | 175.2 | -67 | 168.6 | 0 | 0 | 0 | 110.4 | I119 L121 A137 A140 I141 P160 S164 P165 A166 A171 A172 | I119-I168 HydrophobicContact CD1-CD1 4.12Å; L121-I168 HydrophobicContact CD2-CG2 3.72Å; A137-I168 HydrophobicContact CB-CG2 3.57Å; A140-I168 HydrophobicContact CB-CD1 4.1Å; A140-I168 HydrophobicContact CB-CG1 3.88Å; I141-I168 HydrophobicContact CD1-CD1 4.32Å; I141-I168 HydrophobicContact CG1-CD1 4.13Å; P160-I168 HydrophobicContact CB-CG1 4.36Å; P160-I168 HydrophobicContact CG-CG1 4.3Å; S164-I168 WeakPolarHBondContact O-CD1 2.95Å; S164-I168 VanDerWaalsContact O-CG1 3.26Å; S164-I168 WeakPolarHBondContact O-CG1 3.32Å; S164-I168 PolarHBondContact O-N 3.39Å; S164-I168 VanDerWaalsContact O-N 3.15Å; P165-I168 PolarHBondContact O-N 3.37Å; A166-I168 VanDerWaalsContact C-N 3.33Å; A166-I168 PolarHBondContact O-N 3.01Å; I168-A171 PolarHBondContact O-N 3.39Å; I168-A172 WeakPolarHBondContact O-CB 3.42Å; I168-A172 PolarHBondContact O-N 2.98Å |
| 169 | Q | 97 | Very high | 94.9 | Very high | 70 Ų | 70 | 53.2 Ų | 53.2 | 33% | 0.327 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.2 | -44.9 | 176.5 | -76.7 | 168.1 | -13.8 | 0 | 0 | 111.8 | I119 W120 P165 A166 A172 A173 | I119-Q169 HydrophobicContact CG2-CG 4.38Å; W120-Q169 WeakPolarHBondContact O-CG 3.14Å; W120-Q169 PolarHBondContact O-NE2 3.49Å; P165-Q169 WeakPolarHBondContact O-CB 3.13Å; P165-Q169 WeakPolarHBondContact O-CG 3.45Å; P165-Q169 PolarHBondContact O-N 3.47Å; A166-Q169 PolarHBondContact O-N 3.19Å; Q169-A172 PolarHBondContact O-N 3.22Å; Q169-A173 WeakPolarHBondContact O-CB 3.25Å; Q169-A173 PolarHBondContact O-N 2.9Å |
| 170 | A | 97.1 | Very high | 94.9 | Very high | 54 Ų | 54 | 46.6 Ų | 46.6 | 45% | 0.446 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62.6 | -44.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112 | A166 D167 A173 K174 | A166-A170 WeakPolarHBondContact O-CB 3.39Å; A166-A170 PolarHBondContact O-N 3.47Å; D167-A170 PolarHBondContact O-N 3.23Å; A170-A173 PolarHBondContact O-N 2.96Å; A170-K174 WeakPolarHBondContact O-CG 3.49Å; A170-K174 PolarHBondContact O-N 3.34Å; A170-K174 VanDerWaalsContact O-N 3.11Å |
| 171 | A | 97.1 | Very high | 94.6 | Very high | 8 Ų | 8 | 50.3 Ų | 50.3 | 7% | 0.066 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -67.1 | -39.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | V136 P158 P160 D167 I168 A173 K174 A175 | V136-A171 HydrophobicContact CG1-CB 3.67Å; P158-A171 WeakPolarHBondContact CG-O 3.22Å; P160-A171 HydrophobicContact CB-CB 3.81Å; P160-A171 HydrophobicContact CG-CB 4.41Å; D167-A171 WeakPolarHBondContact O-CB 3.26Å; D167-A171 PolarHBondContact O-N 3.25Å; I168-A171 PolarHBondContact O-N 3.39Å; A171-A173 PolarHBondContact O-N 3.02Å; A171-K174 PolarHBondContact O-N 3.22Å; A171-A175 PolarHBondContact O-N 3.31Å |
| 172 | A | 96.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63.2 | -40.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L121 A133 I168 Q169 A175 A176 | L121-A172 HydrophobicContact CD2-CB 4.42Å; A133-A172 HydrophobicContact CB-CB 4.01Å; I168-A172 WeakPolarHBondContact O-CB 3.42Å; I168-A172 PolarHBondContact O-N 2.98Å; Q169-A172 PolarHBondContact O-N 3.22Å; A172-A175 PolarHBondContact O-N 3.3Å; A172-A176 WeakPolarHBondContact O-CB 3.43Å; A172-A176 PolarHBondContact O-N 3.29Å |
| 173 | A | 96.4 | Very high | 93.3 | Very high | 53 Ų | 53 | 47.4 Ų | 47.4 | 44% | 0.438 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -63.8 | -42.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q169 A170 A171 A175 A176 A177 | Q169-A173 WeakPolarHBondContact O-CB 3.25Å; Q169-A173 PolarHBondContact O-N 2.9Å; A170-A173 PolarHBondContact O-N 2.96Å; A171-A173 PolarHBondContact O-N 3.02Å; A173-A175 PolarHBondContact O-N 3.08Å; A173-A176 CarbonylContact O-C 3.58Å; A173-A176 PolarHBondContact O-N 3.03Å; A173-A177 PolarHBondContact O-N 3Å |
| 174 | K | 96.3 | Very high | 92.2 | Very high | 144 Ų | 144 | 47.1 Ų | 47.1 | 63% | 0.626 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -60.7 | -42.9 | 174.7 | -73.6 | -179.7 | -179 | 179.8 | 0 | 112.4 | P158 A170 A171 A176 A177 A178 | P158-K174 HydrophobicContact CG-CB 4.18Å; A170-K174 WeakPolarHBondContact O-CG 3.49Å; A170-K174 PolarHBondContact O-N 3.34Å; A170-K174 VanDerWaalsContact O-N 3.11Å; A171-K174 PolarHBondContact O-N 3.22Å; K174-A176 VanDerWaalsContact C-N 3.32Å; K174-A176 PolarHBondContact O-N 2.96Å; K174-A177 PolarHBondContact O-N 3.39Å; K174-A178 PolarHBondContact O-N 3.49Å |
| 175 | A | 95.9 | Very high | 90.6 | Very high | 3 Ų | 3 | 52.2 Ų | 52.2 | 3% | 0.025 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -65.6 | -36.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | V136 L157 P158 A171 A172 A173 A177 A179 | V136-A175 HydrophobicContact CG2-CB 3.37Å; L157-A175 HydrophobicContact CD2-CB 4.02Å; P158-A175 HydrophobicContact CG-CB 3.8Å; A171-A175 PolarHBondContact O-N 3.31Å; A172-A175 PolarHBondContact O-N 3.3Å; A173-A175 PolarHBondContact O-N 3.08Å; A175-A177 VanDerWaalsContact C-N 3.31Å; A175-A179 WeakPolarHBondContact O-CB 3.46Å; A175-A179 PolarHBondContact O-N 3.07Å |
| 176 | A | 95.9 | Very high | 88.9 | Confident | 7 Ų | 7 | 52.9 Ų | 52.9 | 6% | 0.058 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -72.3 | -21.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | F124 M129 A133 A172 A173 K174 A179 A180 | F124-A176 HydrophobicContact CD1-CB 3.67Å; F124-A176 HydrophobicContact CE1-CB 3.2Å; F124-A176 HydrophobicContact CZ-CB 3.9Å; M129-A176 HydrophobicContact CB-CB 4.36Å; A133-A176 HydrophobicContact CB-CB 4.37Å; A172-A176 WeakPolarHBondContact O-CB 3.43Å; A172-A176 PolarHBondContact O-N 3.29Å; A173-A176 CarbonylContact O-C 3.58Å; A173-A176 PolarHBondContact O-N 3.03Å; K174-A176 VanDerWaalsContact C-N 3.32Å; K174-A176 PolarHBondContact O-N 2.96Å; A176-A179 WeakPolarHBondContact O-CB 3.45Å; A176-A180 PolarHBondContact O-N 3.29Å |
| 177 | A | 95 | Very high | 87 | Confident | 52 Ų | 52 | 56.9 Ų | 56.9 | 43% | 0.43 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -76.4 | -52.6 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | A173 K174 A175 A179 A180 D181 | A173-A177 PolarHBondContact O-N 3Å; K174-A177 PolarHBondContact O-N 3.39Å; A175-A177 VanDerWaalsContact C-N 3.31Å; A177-A179 PolarHBondContact O-N 3.25Å; A177-A180 WeakPolarHBondContact O-CA 3.43Å; A177-A180 WeakPolarHBondContact O-CB 3.47Å; A177-A180 PolarHBondContact O-N 3.11Å; A177-D181 PolarHBondContact O-N 2.96Å |
| 178 | A | 93.5 | Very high | 84.7 | Confident | 60 Ų | 60 | 61.3 Ų | 61.3 | 50% | 0.496 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -56.2 | -30.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | K174 A182 | K174-A178 PolarHBondContact O-N 3.49Å; A178-A182 PolarHBondContact O-N 3.46Å |
| 179 | A | 91.9 | Very high | 82.1 | Confident | 1 Ų | 1 | 65.1 Ų | 65.1 | 1% | 0.008 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -59.9 | -47.3 | 171.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | M129 R132 A175 A176 A177 D181 A182 D183 | M129-A179 HydrophobicContact CG-CB 3.9Å; R132-A179 HydrophobicContact CB-CB 4.44Å; R132-A179 PolarHBondContact NH1-O 3.02Å; R132-A179 VanDerWaalsContact NH2-C 3.29Å; R132-A179 VanDerWaalsContact NH2-CA 3.3Å; R132-A179 PolarHBondContact NH2-O 3.49Å; A175-A179 WeakPolarHBondContact O-CB 3.46Å; A175-A179 PolarHBondContact O-N 3.07Å; A176-A179 WeakPolarHBondContact O-CB 3.45Å; A177-A179 PolarHBondContact O-N 3.25Å; A179-D181 VanDerWaalsContact C-N 3.31Å; A179-A182 PolarHBondContact O-N 3.47Å; A179-D183 PolarHBondContact O-N 2.86Å |
| 180 | A | 90.4 | Very high | 79.7 | Confident | 31 Ų | 31 | 69.6 Ų | 69.6 | 26% | 0.256 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -66.5 | -37.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | M129 A176 A177 A182 D183 V184 | M129-A180 HydrophobicContact CE-CB 3.68Å; M129-A180 HydrophobicContact SD-CB 4.14Å; A176-A180 PolarHBondContact O-N 3.29Å; A177-A180 WeakPolarHBondContact O-CA 3.43Å; A177-A180 WeakPolarHBondContact O-CB 3.47Å; A177-A180 PolarHBondContact O-N 3.11Å; A180-A182 VanDerWaalsContact C-N 3.34Å; A180-A182 PolarHBondContact O-N 3.42Å; A180-D183 PolarHBondContact O-N 2.82Å; A180-V184 WeakPolarHBondContact O-CG2 3.24Å; A180-V184 PolarHBondContact O-N 3.39Å |
| 181 | D | 88.3 | Confident | 77.3 | Confident | 108 Ų | 108 | 71.9 Ų | 71.9 | 58% | 0.578 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -62.8 | -41.6 | 177.1 | -57.4 | -43.7 | 0 | 0 | 0 | 111.4 | A177 A179 D183 V184 E185 | A177-D181 PolarHBondContact O-N 2.96Å; A179-D181 VanDerWaalsContact C-N 3.31Å; D181-D183 VanDerWaalsContact C-N 3.34Å; D181-D183 PolarHBondContact O-N 2.75Å; D181-V184 PolarHBondContact O-N 3.32Å; D181-E185 PolarHBondContact O-N 2.87Å |
| 182 | A | 82.5 | Confident | 74.9 | Confident | 36 Ų | 36 | 75.8 Ų | 75.8 | 30% | 0.298 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -65.8 | -33.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | A178 A179 A180 V184 E185 V186 | A178-A182 PolarHBondContact O-N 3.46Å; A179-A182 PolarHBondContact O-N 3.47Å; A180-A182 VanDerWaalsContact C-N 3.34Å; A180-A182 PolarHBondContact O-N 3.42Å; A182-V184 VanDerWaalsContact C-N 3.29Å; A182-V184 PolarHBondContact O-N 3.42Å; A182-E185 PolarHBondContact O-N 3.29Å; A182-V186 WeakPolarHBondContact O-CG2 3.38Å; A182-V186 PolarHBondContact O-N 3.49Å |
| 183 | D | 73.6 | Confident | 72.4 | Confident | 54 Ų | 54 | 84.5 Ų | 84.5 | 29% | 0.289 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -69.5 | -29.9 | 178 | -62.6 | -33.8 | 0 | 0 | 0 | 110.9 | R132 A179 A180 D181 V186 E187 | R132-D183 IonicContact NH2-OD1 3.29Å; R132-D183 PolarHBondContact NH2-OD1 3.5Å; R132-D183 IonicContact NH2-OD2 3.46Å; R132-D183 PolarHBondContact NH2-OD2 3.34Å; R132-D183 VanDerWaalsContact NH2-OD2 3.09Å; A179-D183 PolarHBondContact O-N 2.86Å; A180-D183 PolarHBondContact O-N 2.82Å; D181-D183 VanDerWaalsContact C-N 3.34Å; D181-D183 PolarHBondContact O-N 2.75Å; D183-V186 PolarHBondContact O-N 3.15Å; D183-E187 PolarHBondContact O-N 3.47Å |
| 184 | V | 69.4 | Low | 70.1 | Confident | 84 Ų | 84 | 85.8 Ų | 85.8 | 51% | 0.509 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -70.1 | -36.6 | 175.4 | 177.2 | 0 | 0 | 0 | 0 | 111.9 | A180 D181 A182 V186 Q188 | A180-V184 WeakPolarHBondContact O-CG2 3.24Å; A180-V184 PolarHBondContact O-N 3.39Å; D181-V184 PolarHBondContact O-N 3.32Å; A182-V184 VanDerWaalsContact C-N 3.29Å; A182-V184 PolarHBondContact O-N 3.42Å; V184-V186 VanDerWaalsContact C-N 3.33Å; V184-V186 PolarHBondContact O-N 2.87Å; V184-Q188 PolarHBondContact O-N 2.97Å |
| 185 | E | 62 | Low | 68.3 | Low | 143 Ų | 143 | 86 Ų | 86 | 67% | 0.668 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -67.1 | -34 | 176 | -68.4 | -164.7 | 132.7 | 0 | 0 | 112.2 | D181 A182 Q188 C189 | D181-E185 PolarHBondContact O-N 2.87Å; A182-E185 PolarHBondContact O-N 3.29Å; E185-Q188 PolarHBondContact O-N 3.29Å; E185-C189 PolarHBondContact O-N 2.94Å; E185-C189 PolarHBondContact O-SG 3.24Å |
| 186 | V | 58.7 | Low | 65.9 | Low | 82 Ų | 82 | 94.7 Ų | 94.7 | 50% | 0.497 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -70.6 | -39.9 | 178.3 | 178.4 | 0 | 0 | 0 | 0 | 111.7 | A182 D183 V184 Q188 C189 E190 | A182-V186 WeakPolarHBondContact O-CG2 3.38Å; A182-V186 PolarHBondContact O-N 3.49Å; D183-V186 PolarHBondContact O-N 3.15Å; V184-V186 VanDerWaalsContact C-N 3.33Å; V184-V186 PolarHBondContact O-N 2.87Å; V186-Q188 VanDerWaalsContact C-N 3.29Å; V186-Q188 PolarHBondContact O-N 2.91Å; V186-C189 PolarHBondContact O-N 3.43Å; V186-C189 PolarHBondContact O-SG 3.02Å; V186-E190 PolarHBondContact O-N 3.33Å |
| 187 | E | 56.6 | Low | 63.8 | Low | 145 Ų | 145 | 101.2 Ų | 101.2 | 68% | 0.678 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -66 | -30.9 | 174.4 | -72.2 | -82.2 | 145.6 | 0 | 0 | 112.4 | D183 S191 | D183-E187 PolarHBondContact O-N 3.47Å; E187-S191 PolarHBondContact O-N 2.72Å |
| 188 | Q | 48.1 | Very low | 61.4 | Low | 152 Ų | 152 | 104.6 Ų | 104.6 | 71% | 0.71 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -73.6 | -22.4 | 176.3 | -81.8 | -177 | 0.2 | 0 | 0 | 114 | V184 E185 V186 | V184-Q188 PolarHBondContact O-N 2.97Å; E185-Q188 PolarHBondContact O-N 3.29Å; V186-Q188 VanDerWaalsContact C-N 3.29Å; V186-Q188 PolarHBondContact O-N 2.91Å |
| 189 | C | 41.4 | Very low | 59.1 | Low | 80 Ų | 80 | 106.9 Ų | 106.9 | 54% | 0.541 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -97 | -24.7 | 175.4 | 50.3 | 0 | 0 | 0 | 0 | 113.8 | E185 V186 S192 | E185-C189 PolarHBondContact O-N 2.94Å; E185-C189 PolarHBondContact O-SG 3.24Å; V186-C189 PolarHBondContact O-N 3.43Å; V186-C189 PolarHBondContact O-SG 3.02Å; C189-S192 PolarHBondContact O-OG 3.43Å |
| 190 | E | 47.7 | Very low | 56.8 | Low | 164 Ų | 164 | 111.6 Ų | 111.6 | 77% | 0.766 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -78.5 | -16.6 | 177 | -159.9 | 156.1 | 109.4 | 0 | 0 | 113.8 | V186 | V186-E190 PolarHBondContact O-N 3.33Å |
| 191 | S | 45.2 | Very low | 54.8 | Low | 102 Ų | 102 | 115.3 Ų | 115.3 | 71% | 0.713 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | -10.7 | 174 | -173.4 | 0 | 0 | 0 | 0 | 114.3 | E187 H193 | E187-S191 PolarHBondContact O-N 2.72Å; S191-H193 VanDerWaalsContact C-N 3.3Å; S191-H193 PolarHBondContact O-N 3.2Å |
| 192 | S | 47.3 | Very low | 52.8 | Low | 91 Ų | 91 | 114.9 Ų | 114.9 | 64% | 0.636 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -83.4 | 11.3 | -169.4 | 63.6 | 0 | 0 | 0 | 0 | 116.2 | C189 | C189-S192 PolarHBondContact O-OG 3.43Š|
| 193 | H | 43.9 | Very low | 51.1 | Low | 182 Ų | 182 | 118 Ų | 118 | 84% | 0.843 | 71% | 0.706 | S | S | * | * | trans | -123.5 | 52.5 | -174.2 | -120.1 | -68.5 | 0 | 0 | 0 | 113.8 | S191 | S191-H193 VanDerWaalsContact C-N 3.3Å; S191-H193 PolarHBondContact O-N 3.2Å | ||
| 194 | A | 49.1 | Very low | 49.7 | Very low | 81 Ų | 81 | 121.1 Ų | 121.1 | 67% | 0.669 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -155 | 119.3 | 162 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 195 | V | 57.1 | Low | 48.6 | Very low | 149 Ų | 149 | 122.3 Ų | 122.3 | 90% | 0.903 | 75% | 0.745 | S | S | * | * | trans | 77.4 | 121 | 152.1 | -56.6 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 196 | E | 47.4 | Very low | 48.3 | Very low | 184 Ų | 184 | 125 Ų | 125 | 86% | 0.86 | 76% | 0.757 | S | S | * | * | trans | -68 | 139.3 | 173.1 | -50.7 | -178.8 | 118.9 | 0 | 0 | 112.8 | ||||
| 197 | T | 50.5 | Low | 47.5 | Very low | 144 Ų | 144 | 129.3 Ų | 129.3 | 88% | 0.883 | 77% | 0.772 | S | S | * | * | trans | -174.3 | 127.7 | 135 | 8.1 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 198 | P | 44.6 | Very low | 47.3 | Very low | 124 Ų | 124 | 129.5 Ų | 129.5 | 81% | 0.805 | 78% | 0.783 | S | S | * | * | trans | -105.9 | 136.6 | 174.8 | 35.9 | -25.9 | 0 | 0 | 0 | 112.1 | ||||
| 199 | S | 44.7 | Very low | 46.6 | Very low | 108 Ų | 108 | 126.2 Ų | 126.2 | 76% | 0.755 | 78% | 0.781 | S | S | * | * | trans | -175.9 | 129.4 | 150 | -161.9 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 200 | S | 45.3 | Very low | 46.2 | Very low | 100 Ų | 100 | 127.2 Ų | 127.2 | 70% | 0.699 | 80% | 0.796 | S | S | * | * | trans | 42.7 | 137.7 | 140.8 | 68 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 201 | S | 48 | Very low | 45.9 | Very low | 108 Ų | 108 | 124.2 Ų | 124.2 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | cis | 178.3 | 139.7 | 18.4 | 35.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 202 | A | 46.2 | Very low | 45.6 | Very low | 99 Ų | 99 | 124.6 Ų | 124.6 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | trans | 57.2 | 124.6 | 135 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 203 | A | 46 | Very low | 45.3 | Very low | 101 Ų | 101 | 127.6 Ų | 127.6 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | trans | 82.3 | 111 | 137.4 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 204 | S | 44.5 | Very low | 45.2 | Very low | 120 Ų | 120 | 122.7 Ų | 122.7 | 84% | 0.839 | 80% | 0.801 | S | S | * | * | -168.3 | 141.1 | 91.6 | -146 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 205 | S | 46.3 | Very low | 45.1 | Very low | 109 Ų | 109 | 126 Ų | 126 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | trans | -94.2 | 142.9 | -176.8 | -50.5 | 0 | 0 | 0 | 0 | 111 | ||||
| 206 | E | 54.8 | Low | 44.7 | Very low | 200 Ų | 200 | 128.1 Ų | 128.1 | 94% | 0.935 | 80% | 0.803 | S | S | * | * | trans | -161.3 | 139.8 | 136.1 | 34.4 | -161.5 | 115 | 0 | 0 | 111.9 | ||||
| 207 | E | 42 | Very low | 44.9 | Very low | 172 Ų | 172 | 127.1 Ų | 127.1 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | trans | -110.6 | 135.1 | -164.3 | -173.9 | -152.6 | 149.6 | 0 | 0 | 108.2 | ||||
| 208 | V | 52.5 | Low | 45 | Very low | 149 Ų | 149 | 123.7 Ų | 123.7 | 90% | 0.903 | 78% | 0.782 | S | S | * | * | trans | -147.4 | 127.5 | 147.6 | -75.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 209 | A | 34.3 | Very low | 45.4 | Very low | 83 Ų | 83 | 123.7 Ų | 123.7 | 69% | 0.686 | 78% | 0.78 | S | S | * | * | trans | -91.1 | 153.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 210 | A | 33.4 | Very low | 45.7 | Very low | 102 Ų | 102 | 125.7 Ų | 125.7 | 84% | 0.843 | 78% | 0.781 | S | S | * | * | trans | 60.7 | 103.7 | 145.6 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 211 | A | 41.7 | Very low | 46.1 | Very low | 101 Ų | 101 | 130 Ų | 130 | 84% | 0.835 | 79% | 0.788 | S | S | * | * | trans | -160.9 | 124.4 | 135.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 212 | S | 38.3 | Very low | 46.3 | Very low | 110 Ų | 110 | 131.6 Ų | 131.6 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | trans | -56.3 | 131 | 163.3 | 46.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 213 | N | 41.2 | Very low | 46.7 | Very low | 153 Ų | 153 | 133.7 Ų | 133.7 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | -172.6 | 120.1 | 153.1 | -93 | -22.1 | 0 | 0 | 0 | 104.3 | ||||
| 214 | A | 40.8 | Very low | 47 | Very low | 79 Ų | 79 | 133.8 Ų | 133.8 | 65% | 0.653 | 78% | 0.776 | S | S | * | * | 38.4 | 135.9 | 84.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 215 | E | 48.2 | Very low | 47.5 | Very low | 150 Ų | 150 | 135.8 Ų | 135.8 | 70% | 0.701 | 78% | 0.778 | S | S | * | * | trans | 94.4 | 38.9 | 179.3 | -41.5 | -66.4 | 118.7 | 0 | 0 | 117.8 | M217 S218 | E215-M217 PolarHBondContact O-N 3.25Å; E215-S218 PolarHBondContact O-OG 2.51Å | ||
| 216 | E | 48.7 | Very low | 47.8 | Very low | 194 Ų | 194 | 137.8 Ų | 137.8 | 91% | 0.907 | 78% | 0.779 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.3 | 61.7 | 152.9 | -98.3 | -162.6 | 157.2 | 0 | 0 | 110.5 | ||
| 217 | M | 51.7 | Low | 47.7 | Very low | 164 Ų | 164 | 135.5 Ų | 135.5 | 81% | 0.808 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -142.2 | 20.4 | 161.3 | -163.6 | -176.5 | -83.7 | 0 | 0 | 110.5 | E215 | E215-M217 PolarHBondContact O-N 3.25Š|
| 218 | S | 50.8 | Low | 48.3 | Very low | 71 Ų | 71 | 134.5 Ų | 134.5 | 50% | 0.497 | 77% | 0.77 | S | S | . | * | S | Bend | trans | -113.7 | -17.7 | -176.8 | 56.6 | 0 | 0 | 0 | 0 | 113.6 | E215 L220 F221 | E215-S218 PolarHBondContact O-OG 2.51Å; S218-L220 PolarHBondContact O-N 3.01Å; S218-F221 PolarHBondContact O-N 3.3Å |
| 219 | V | 54.3 | Low | 48.4 | Very low | 124 Ų | 124 | 135.2 Ų | 135.2 | 75% | 0.752 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -2.8 | 174.9 | -152.7 | 0 | 0 | 0 | 0 | 112.8 | ||
| 220 | L | 50.6 | Low | 49.4 | Very low | 151 Ų | 151 | 139.5 Ų | 139.5 | 79% | 0.791 | 78% | 0.779 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.8 | -6.9 | 173.6 | -170.8 | 57.1 | 0 | 0 | 0 | 112.8 | S218 | S218-L220 PolarHBondContact O-N 3.01Š|
| 221 | F | 54.2 | Low | 50.5 | Low | 190 Ų | 190 | 138.7 Ų | 138.7 | 83% | 0.833 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -109.7 | 8.8 | -170.7 | -118.1 | -91.6 | 0 | 0 | 0 | 115.6 | S218 | S218-F221 PolarHBondContact O-N 3.3Š|
| 222 | D | 52.4 | Low | 50.8 | Low | 141 Ų | 141 | 141.3 Ų | 141.3 | 75% | 0.754 | 77% | 0.767 | S | S | * | * | trans | -115.5 | 28.1 | -173.9 | -145.8 | 19.8 | 0 | 0 | 0 | 113.9 | P224 | D222-P224 WeakPolarHBondContact O-CD 3.38Š| ||
| 223 | L | 54.3 | Low | 51.3 | Low | 143 Ų | 143 | 138.8 Ų | 138.8 | 75% | 0.749 | 76% | 0.759 | S | S | * | * | trans | -108.4 | 99.1 | 172.2 | -116.4 | 85.9 | 0 | 0 | 0 | 111.2 | ||||
| 224 | P | 51.1 | Low | 52.1 | Low | 103 Ų | 103 | 139 Ų | 139 | 67% | 0.669 | 76% | 0.759 | S | S | * | * | trans | -76.9 | 152.2 | 161.9 | 32.5 | -28.8 | 0 | 0 | 0 | 109.7 | D222 | D222-P224 WeakPolarHBondContact O-CD 3.38Š| ||
| 225 | D | 55.9 | Low | 52.9 | Low | 162 Ų | 162 | 147.7 Ų | 147.7 | 87% | 0.866 | 78% | 0.775 | S | S | * | * | S | Bend | trans | 86.2 | 6 | 160.9 | -77 | -4.8 | 0 | 0 | 0 | 122.8 | ||
| 226 | L | 52.5 | Low | 53.4 | Low | 152 Ų | 152 | 145.9 Ų | 145.9 | 80% | 0.796 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -117.7 | 6.1 | 176.2 | -85.4 | 160.1 | 0 | 0 | 0 | 116.7 | ||
| 227 | L | 52 | Low | 53.7 | Low | 151 Ų | 151 | 141.1 Ų | 141.1 | 79% | 0.791 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -99.9 | 0.4 | -175.6 | -170.2 | 54.2 | 0 | 0 | 0 | 115.2 | ||
| 228 | M | 55.5 | Low | 54.4 | Low | 152 Ų | 152 | 141.8 Ų | 141.8 | 75% | 0.749 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -91.2 | -1.9 | -173.8 | -64.5 | -89.5 | 68.8 | 0 | 0 | 115.5 | ||
| 229 | D | 54.6 | Low | 55 | Low | 164 Ų | 164 | 149 Ų | 149 | 88% | 0.877 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -108.8 | 9.5 | -173.6 | -95 | -6 | 0 | 0 | 0 | 115.3 | ||
| 230 | L | 55.4 | Low | 54.8 | Low | 172 Ų | 172 | 147.1 Ų | 147.1 | 90% | 0.901 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -121.7 | 33.3 | 178.5 | -144.6 | 74.5 | 0 | 0 | 0 | 112.8 | ||
| 231 | S | 55.5 | Low | 54.8 | Low | 85 Ų | 85 | 144.7 Ų | 144.7 | 59% | 0.594 | 79% | 0.786 | S | S | * | * | trans | -98.8 | -6.3 | 176.8 | 56.9 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 232 | D | 49.9 | Very low | 54.8 | Low | 156 Ų | 156 | 140.4 Ų | 140.4 | 83% | 0.834 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -114.8 | 86 | -171 | -64.9 | -16.6 | 0 | 0 | 0 | 112 | ||
| 233 | G | 48.5 | Very low | 54.7 | Low | 58 Ų | 58 | 139.9 Ų | 139.9 | 60% | 0.598 | 79% | 0.79 | S | S | * | * | trans | 117.7 | 125.9 | 141.3 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 234 | L | 56.4 | Low | 54 | Low | 158 Ų | 158 | 138 Ų | 138 | 83% | 0.827 | 80% | 0.795 | S | S | * | * | trans | 75.4 | 79.4 | 149.7 | -66.1 | 78.9 | 0 | 0 | 0 | 116.8 | ||||
| 235 | W | 58.3 | Low | 53.8 | Low | 260 Ų | 260 | 137.8 Ų | 137.8 | 99% | 0.985 | 80% | 0.802 | S | S | * | * | -166.2 | 94.2 | 122.5 | -101.1 | -54.8 | 0 | 0 | 0 | 111.1 | |||||
| 236 | S | 57.9 | Low | 53.5 | Low | 113 Ų | 113 | 136.4 Ų | 136.4 | 79% | 0.79 | 80% | 0.799 | S | S | * | * | trans | -79.5 | 128.9 | 165.3 | -54.6 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 237 | P | 55.8 | Low | 53.5 | Low | 94 Ų | 94 | 138.1 Ų | 138.1 | 61% | 0.61 | 80% | 0.803 | S | S | * | * | trans | -91.8 | 124.6 | 165.4 | 36.9 | -30.8 | 0 | 0 | 0 | 109.5 | W239 | P237-W239 PolarHBondContact O-N 3.01Š| ||
| 238 | I | 66 | Low | 53.2 | Low | 178 Ų | 178 | 138.2 Ų | 138.2 | 91% | 0.913 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | 5.5 | -171.3 | -96.2 | 165.3 | 0 | 0 | 0 | 116.1 | A240 | I238-A240 PolarHBondContact O-N 3.23Š|
| 239 | W | 63.1 | Low | 53.1 | Low | 221 Ų | 221 | 140.8 Ų | 140.8 | 84% | 0.837 | 80% | 0.802 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.6 | 1.1 | -167.4 | 76 | -79.1 | 0 | 0 | 0 | 115.8 | P237 | P237-W239 PolarHBondContact O-N 3.01Š|
| 240 | A | 50.6 | Low | 52.7 | Low | 86 Ų | 86 | 140.4 Ų | 140.4 | 71% | 0.711 | 80% | 0.8 | S | S | * | * | trans | -112.3 | 84.3 | -174.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | I238 | I238-A240 PolarHBondContact O-N 3.23Š| ||
| 241 | A | 51.3 | Low | 52.1 | Low | 100 Ų | 100 | 135.7 Ų | 135.7 | 83% | 0.826 | 79% | 0.794 | S | S | * | * | trans | -164.7 | 100.3 | 158.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 242 | A | 54.6 | Low | 51.7 | Low | 100 Ų | 100 | 135.2 Ų | 135.2 | 83% | 0.826 | 80% | 0.802 | S | S | * | * | trans | -166.8 | 142.1 | 134.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 243 | P | 48.9 | Very low | 51.4 | Low | 129 Ų | 129 | 135.2 Ų | 135.2 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | trans | -101.7 | 169.1 | -159.2 | 39.5 | -34.6 | 0 | 0 | 0 | 115.5 | ||||
| 244 | A | 39.6 | Very low | 51.4 | Low | 104 Ų | 104 | 137 Ų | 137 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -49.8 | 135.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 245 | A | 48.1 | Very low | 51.1 | Low | 99 Ų | 99 | 138.2 Ų | 138.2 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | trans | -147.3 | 127.3 | 152.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 246 | V | 48.9 | Very low | 50.9 | Low | 132 Ų | 132 | 130.9 Ų | 130.9 | 80% | 0.8 | 80% | 0.8 | S | S | * | * | trans | -49.4 | 145.4 | 166.4 | -70.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 247 | E | 52.3 | Low | 51 | Low | 188 Ų | 188 | 133.9 Ų | 133.9 | 88% | 0.879 | 80% | 0.802 | S | S | * | * | trans | 165.7 | 139.9 | 135.2 | -87.3 | -84.4 | 134.4 | 0 | 0 | 110.7 | ||||
| 248 | E | 46 | Very low | 51.1 | Low | 153 Ų | 153 | 134.7 Ų | 134.7 | 72% | 0.715 | 81% | 0.807 | S | S | * | * | trans | -84.2 | 136.4 | -178.3 | -177.5 | -174.2 | 158.1 | 0 | 0 | 109.3 | ||||
| 249 | Y | 54.4 | Low | 50.1 | Low | 207 Ų | 207 | 134.3 Ų | 134.3 | 81% | 0.812 | 81% | 0.805 | S | S | * | * | trans | 152.2 | 120.8 | 143.1 | -102.7 | -104.1 | 0 | 0 | 0 | 113.6 | ||||
| 250 | D | 45.1 | Very low | 49.5 | Very low | 155 Ų | 155 | 130.4 Ų | 130.4 | 83% | 0.829 | 80% | 0.801 | S | S | * | * | trans | 30.8 | 122.1 | 134.9 | -141.2 | 64.5 | 0 | 0 | 0 | 121.3 | ||||
| 251 | G | 43.4 | Very low | 49.8 | Very low | 74 Ų | 74 | 139.2 Ų | 139.2 | 76% | 0.763 | 82% | 0.816 | S | S | * | * | trans | 92.9 | 122.2 | 136.6 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 252 | G | 45.7 | Very low | 49.7 | Very low | 74 Ų | 74 | 138.9 Ų | 138.9 | 76% | 0.763 | 81% | 0.813 | S | S | * | * | trans | 106.5 | 97.9 | 143.7 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 253 | D | 44.1 | Very low | 49.4 | Very low | 156 Ų | 156 | 142.2 Ų | 142.2 | 83% | 0.834 | 81% | 0.811 | S | S | * | * | 51 | 142.1 | 123.3 | -148.8 | 79.5 | 0 | 0 | 0 | 121.6 | |||||
| 254 | S | 49.3 | Very low | 49.5 | Very low | 97 Ų | 97 | 143 Ų | 143 | 68% | 0.678 | 80% | 0.803 | S | S | * | * | trans | 80.9 | 80.3 | 166.9 | -77 | 0 | 0 | 0 | 0 | 118.4 | S256 | S254-S256 PolarHBondContact O-N 2.94Š| ||
| 255 | L | 49.9 | Very low | 50.2 | Low | 183 Ų | 183 | 146 Ų | 146 | 96% | 0.958 | 80% | 0.799 | S | S | * | * | trans | -83.9 | 99.6 | 148.8 | -72.2 | 178.4 | 0 | 0 | 0 | 109.3 | ||||
| 256 | S | 54.6 | Low | 50.4 | Low | 106 Ų | 106 | 146 Ų | 146 | 74% | 0.741 | 79% | 0.792 | S | S | * | * | trans | -71 | 127.8 | 160.9 | 42.9 | 0 | 0 | 0 | 0 | 109.3 | S254 P258 | S254-S256 PolarHBondContact O-N 2.94Å; S256-P258 WeakPolarHBondContact O-CD 3.48Å | ||
| 257 | E | 60.1 | Low | 50.9 | Low | 176 Ų | 176 | 151.6 Ų | 151.6 | 82% | 0.822 | 80% | 0.799 | S | S | * | * | trans | -59.3 | 128.3 | 171.7 | -79.3 | -172.5 | 129.2 | 0 | 0 | 111.1 | L259 | E257-L259 PolarHBondContact O-N 3.35Š| ||
| 258 | P | 57.2 | Low | 51.2 | Low | 110 Ų | 110 | 148.9 Ų | 148.9 | 71% | 0.714 | 79% | 0.79 | S | S | * | * | trans | -80.5 | 102.8 | 159.6 | 29.2 | -26.6 | 0 | 0 | 0 | 109.4 | S256 L260 | S256-P258 WeakPolarHBondContact O-CD 3.48Å; P258-L260 PolarHBondContact O-N 3.42Å; P258-L260 VanDerWaalsContact O-N 3.14Å | ||
| 259 | L | 45.9 | Very low | 51.3 | Low | 170 Ų | 170 | 149.5 Ų | 149.5 | 89% | 0.89 | 80% | 0.798 | S | S | * | * | trans | -49 | 111.2 | 159.5 | -101.6 | 102.7 | 0 | 0 | 0 | 109.8 | E257 | E257-L259 PolarHBondContact O-N 3.35Š| ||
| 260 | L | 48.7 | Very low | 51.6 | Low | 140 Ų | 140 | 143.9 Ų | 143.9 | 73% | 0.733 | 79% | 0.794 | S | S | * | * | trans | -140.9 | 48.2 | -177.9 | -138.1 | 146.2 | 0 | 0 | 0 | 112.3 | P258 | P258-L260 PolarHBondContact O-N 3.42Å; P258-L260 VanDerWaalsContact O-N 3.14Å | ||
| 261 | W | 57.8 | Low | 52.4 | Low | 271 Ų | 271 | 140.9 Ų | 140.9 | 100% | 1.027 | 79% | 0.791 | S | S | * | * | trans | -134.5 | 35.8 | 166.7 | -61.4 | -34.7 | 0 | 0 | 0 | 113.3 | ||||
| 262 | A | 49.7 | Very low | 53.6 | Low | 93 Ų | 93 | 141.6 Ų | 141.6 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | trans | -92.3 | 134.8 | 164.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 263 | H | 48 | Very low | 55 | Low | 170 Ų | 170 | 143.3 Ų | 143.3 | 79% | 0.787 | 79% | 0.788 | S | S | * | * | trans | 72 | 117.1 | 176.5 | -107.3 | -118 | 0 | 0 | 0 | 112.3 | ||||
| 264 | E | 51.7 | Low | 56.6 | Low | 145 Ų | 145 | 142.3 Ų | 142.3 | 68% | 0.678 | 79% | 0.787 | S | S | * | * | -168.6 | 172.7 | 55.4 | -62.1 | -150.6 | 124.7 | 0 | 0 | 111.3 | |||||
| 265 | H | 53.9 | Low | 57.6 | Low | 168 Ų | 168 | 145.6 Ų | 145.6 | 78% | 0.778 | 79% | 0.791 | S | S | * | * | trans | 85.9 | 87.9 | 168.6 | -58.5 | -83 | 0 | 0 | 0 | 116.8 | ||||
| 266 | C | 52.6 | Low | 58.9 | Low | 98 Ų | 98 | 142.5 Ų | 142.5 | 66% | 0.662 | 78% | 0.782 | S | S | * | * | 62.6 | 106.6 | 74 | -160.9 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 267 | W | 58.1 | Low | 59.7 | Low | 250 Ų | 250 | 149 Ų | 149 | 95% | 0.947 | 81% | 0.808 | S | S | * | * | trans | -154.8 | 100.4 | 138.3 | -113.7 | 84.1 | 0 | 0 | 0 | 110.1 | ||||
| 268 | L | 58.1 | Low | 59.7 | Low | 131 Ų | 131 | 147.6 Ų | 147.6 | 69% | 0.686 | 81% | 0.808 | S | S | * | * | trans | 13.4 | 115.7 | 152.7 | -95 | 61.2 | 0 | 0 | 0 | 119 | A270 | L268-A270 PolarHBondContact O-N 3.14Š| ||
| 269 | D | 49.4 | Very low | 59.8 | Low | 165 Ų | 165 | 149.6 Ų | 149.6 | 88% | 0.882 | 81% | 0.813 | S | S | * | * | trans | -58.9 | 101.4 | 143.4 | -155.1 | -17.6 | 0 | 0 | 0 | 108.8 | A271 | D269-A271 PolarHBondContact O-N 3.29Š| ||
| 270 | A | 60.1 | Low | 60.6 | Low | 89 Ų | 89 | 148.4 Ų | 148.4 | 74% | 0.736 | 81% | 0.808 | S | S | * | * | trans | -88.4 | 102.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | L268 | L268-A270 PolarHBondContact O-N 3.14Š| ||
| 271 | A | 62.1 | Low | 61.3 | Low | 93 Ų | 93 | 148.9 Ų | 148.9 | 77% | 0.769 | 81% | 0.813 | S | S | * | * | trans | -48.2 | 132.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | D269 | D269-A271 PolarHBondContact O-N 3.29Š| ||
| 272 | A | 69.6 | Low | 61.5 | Low | 88 Ų | 88 | 141.3 Ų | 141.3 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | trans | -75.3 | 132.6 | 163.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | V274 | A272-V274 PolarHBondContact O-N 3.49Š| ||
| 273 | P | 73.3 | Confident | 62.3 | Low | 111 Ų | 111 | 144.5 Ų | 144.5 | 72% | 0.721 | 80% | 0.801 | S | S | * | * | trans | -76.9 | 110.9 | 168.5 | 28.8 | -30.4 | 0 | 0 | 0 | 110.1 | Q275 | P273-Q275 PolarHBondContact O-N 3.44Š| ||
| 274 | V | 78.7 | Confident | 63.3 | Low | 134 Ų | 134 | 142.7 Ų | 142.7 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -70 | 119.9 | 160.6 | 169.6 | 0 | 0 | 0 | 0 | 107.7 | A272 | A272-V274 PolarHBondContact O-N 3.49Š|
| 275 | Q | 70.6 | Confident | 64.2 | Low | 166 Ų | 166 | 142.5 Ų | 142.5 | 78% | 0.776 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 130.5 | 169.5 | -64 | -77.8 | -58.6 | 0 | 0 | 109 | P273 | P273-Q275 PolarHBondContact O-N 3.44Š|
| 276 | P | 77.1 | Confident | 65 | Low | 118 Ų | 118 | 140.4 Ų | 140.4 | 77% | 0.766 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -86.7 | 132.4 | 163.1 | 32.1 | -28.4 | 0 | 0 | 0 | 110.6 | ||
| 277 | D | 70.9 | Confident | 66.2 | Low | 242 Ų | 242 | 144.3 Ų | 144.3 | 100% | 1.294 | 83% | 0.829 | S | S | * | * | trans | -76.4 | 0 | 152.2 | -96.5 | -51.9 | 0 | 0 | 0 | 109.9 |
Retrieved 277 of 277 residues in 99.6 ms
(Link to these results)