| 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 | 40.5 | Very low | 43.7 | Very low | 227 Ų | 227 | 150.4 Ų | 150.4 | 100% | 1.118 | 80% | 0.798 | S | S | * | * | 0 | 93.4 | 0 | -63.3 | 165.9 | -179.2 | 0 | 0 | 105 | |||||
| 2 | Y | 32.9 | Very low | 43.8 | Very low | 214 Ų | 214 | 151.2 Ų | 151.2 | 84% | 0.839 | 80% | 0.803 | S | S | * | * | 57.7 | 116.8 | 76.4 | -68 | -79.2 | 0 | 0 | 0 | 109.8 | |||||
| 3 | N | 37.1 | Very low | 43.5 | Very low | 148 Ų | 148 | 150.4 Ų | 150.4 | 79% | 0.791 | 80% | 0.799 | S | S | * | * | cis | -152.7 | 174.8 | 4.2 | -91.5 | -29.3 | 0 | 0 | 0 | 110.1 | ||||
| 4 | G | 38.7 | Very low | 43.5 | Very low | 61 Ų | 61 | 147.9 Ų | 147.9 | 63% | 0.629 | 80% | 0.8 | S | S | * | * | cis | 126.7 | 70.5 | -8.8 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 5 | T | 50.7 | Low | 43.3 | Very low | 136 Ų | 136 | 146.7 Ų | 146.7 | 83% | 0.834 | 80% | 0.799 | S | S | * | * | trans | -169.1 | 129.7 | 164.2 | 35 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 6 | S | 43.1 | Very low | 43.7 | Very low | 109 Ų | 109 | 146.3 Ų | 146.3 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | cis | 79.5 | 150.6 | 15.2 | -156.6 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 7 | I | 44.4 | Very low | 43.5 | Very low | 136 Ų | 136 | 146.2 Ų | 146.2 | 70% | 0.697 | 80% | 0.795 | S | S | * | * | trans | 78.4 | 129.6 | 176.5 | -63.6 | 171 | 0 | 0 | 0 | 114.2 | ||||
| 8 | R | 44.3 | Very low | 42.9 | Very low | 223 Ų | 223 | 148.7 Ų | 148.7 | 84% | 0.842 | 80% | 0.797 | S | S | * | * | cis | -158.8 | 161.4 | -2.6 | -123.7 | 176.9 | -154.9 | 160.4 | 3.2 | 111.9 | ||||
| 9 | E | 46.2 | Very low | 43.2 | Very low | 161 Ų | 161 | 149.1 Ų | 149.1 | 75% | 0.752 | 79% | 0.794 | S | S | * | * | trans | -81 | 156.9 | 155 | -62.2 | -178.4 | 149.6 | 0 | 0 | 111.6 | ||||
| 10 | P | 56.8 | Low | 43.6 | Very low | 130 Ų | 130 | 146.8 Ų | 146.8 | 84% | 0.844 | 79% | 0.788 | S | S | * | * | trans | -101.9 | 99.7 | 153.2 | 34.3 | -23.1 | 0 | 0 | 0 | 110.4 | ||||
| 11 | T | 46.4 | Very low | 43.1 | Very low | 109 Ų | 109 | 148 Ų | 148 | 67% | 0.669 | 79% | 0.793 | S | S | * | * | trans | -68.4 | 140.9 | 156.2 | 52 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 12 | D | 43.9 | Very low | 43.1 | Very low | 160 Ų | 160 | 145.7 Ų | 145.7 | 86% | 0.856 | 78% | 0.779 | S | S | * | * | trans | -147.8 | 147.8 | 143.9 | -138.9 | -21.4 | 0 | 0 | 0 | 112.5 | ||||
| 13 | N | 40.8 | Very low | 43.3 | Very low | 141 Ų | 141 | 143.4 Ų | 143.4 | 75% | 0.754 | 78% | 0.782 | S | S | * | * | trans | -119.7 | 131.2 | -177.7 | -75.6 | -68.3 | 0 | 0 | 0 | 109.8 | ||||
| 14 | S | 42.9 | Very low | 43.2 | Very low | 116 Ų | 116 | 140 Ų | 140 | 81% | 0.811 | 78% | 0.782 | S | S | * | * | trans | -134.3 | 86.3 | 163.1 | 63.4 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 15 | V | 41.1 | Very low | 42.9 | Very low | 129 Ų | 129 | 141 Ų | 141 | 78% | 0.782 | 79% | 0.791 | S | S | * | * | trans | -73 | 127.8 | 168.8 | 174.1 | 0 | 0 | 0 | 0 | 109.1 | H17 | V15-H17 HydrophobicContact CG1-CB 4.47Š| ||
| 16 | T | 48.8 | Very low | 42.2 | Very low | 140 Ų | 140 | 138.8 Ų | 138.8 | 86% | 0.859 | 79% | 0.787 | S | S | * | * | trans | -125.9 | 106.2 | 165.8 | 54.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 17 | H | 40.9 | Very low | 41.7 | Very low | 145 Ų | 145 | 140.9 Ų | 140.9 | 67% | 0.671 | 79% | 0.789 | S | S | * | * | trans | -129.5 | 112.4 | 177.6 | 168.3 | 17.4 | 0 | 0 | 0 | 109.3 | V15 | V15-H17 HydrophobicContact CG1-CB 4.47Š| ||
| 18 | F | 33.4 | Very low | 41.1 | Very low | 192 Ų | 192 | 141.9 Ų | 141.9 | 84% | 0.842 | 79% | 0.791 | S | S | * | * | trans | -165.7 | 102.4 | 155.8 | -95.3 | -74 | 0 | 0 | 0 | 105.1 | ||||
| 19 | Q | 47.6 | Very low | 40.4 | Very low | 155 Ų | 155 | 136.2 Ų | 136.2 | 72% | 0.724 | 79% | 0.786 | S | S | * | * | 75.1 | 148.4 | 86.3 | -91.9 | -161.1 | -37.9 | 0 | 0 | 115 | |||||
| 20 | P | 50.4 | Low | 39.6 | Very low | 104 Ų | 104 | 131.6 Ų | 131.6 | 68% | 0.675 | 78% | 0.781 | S | S | * | * | trans | -95.4 | 168.4 | -161 | 38.7 | -37.4 | 0 | 0 | 0 | 114 | ||||
| 21 | L | 34.8 | Very low | 38.5 | Very low | 171 Ų | 171 | 130.8 Ų | 130.8 | 90% | 0.895 | 78% | 0.778 | S | S | * | * | trans | -107.3 | 145.7 | 157 | -108.9 | 71.9 | 0 | 0 | 0 | 110.6 | ||||
| 22 | Q | 40.4 | Very low | 37.7 | Very low | 179 Ų | 179 | 133 Ų | 133 | 84% | 0.836 | 78% | 0.781 | S | S | * | * | trans | -122.6 | 139.8 | 166.4 | -68.7 | 175 | -66.5 | 0 | 0 | 108.5 | ||||
| 23 | D | 36.4 | Very low | 37 | Very low | 167 Ų | 167 | 132.6 Ų | 132.6 | 89% | 0.893 | 77% | 0.774 | S | S | * | * | trans | -162.5 | 148.7 | 150.5 | -88 | -41.1 | 0 | 0 | 0 | 104.3 | ||||
| 24 | G | 34.6 | Very low | 36.6 | Very low | 76 Ų | 76 | 132.4 Ų | 132.4 | 78% | 0.784 | 78% | 0.778 | S | S | * | * | cis | 108.3 | 122.6 | 28.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 25 | G | 32.6 | Very low | 36 | Very low | 81 Ų | 81 | 133.2 Ų | 133.2 | 84% | 0.835 | 77% | 0.773 | S | S | * | * | cis | 155.6 | 100.9 | -6.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 26 | A | 35.5 | Very low | 35.6 | Very low | 90 Ų | 90 | 134.4 Ų | 134.4 | 74% | 0.744 | 78% | 0.775 | S | S | * | * | trans | -162.7 | 150.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 27 | L | 33.3 | Very low | 34.8 | Very low | 154 Ų | 154 | 131 Ų | 131 | 81% | 0.806 | 77% | 0.768 | S | S | * | * | cis | 68 | 134.8 | 35.4 | -54.1 | 174.8 | 0 | 0 | 0 | 112.1 | ||||
| 28 | E | 31.4 | Very low | 34.7 | Very low | 156 Ų | 156 | 132.7 Ų | 132.7 | 73% | 0.729 | 78% | 0.776 | S | S | * | * | cis | -160.2 | 170.1 | -2.1 | -141.3 | -165.5 | 93.7 | 0 | 0 | 111 | ||||
| 29 | S | 30.2 | Very low | 34.7 | Very low | 105 Ų | 105 | 129.8 Ų | 129.8 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | trans | 40.2 | 147.4 | 144.2 | -66.1 | 0 | 0 | 0 | 0 | 125 | ||||
| 30 | G | 29.4 | Very low | 34.2 | Very low | 64 Ų | 64 | 126.4 Ų | 126.4 | 66% | 0.66 | 76% | 0.763 | S | S | * | * | trans | 124.6 | 115.1 | 162.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 31 | S | 33.5 | Very low | 33.5 | Very low | 112 Ų | 112 | 129.6 Ų | 129.6 | 78% | 0.783 | 77% | 0.769 | S | S | * | * | 59.1 | 131 | 66.6 | 78.7 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 32 | E | 28.8 | Very low | 33.5 | Very low | 156 Ų | 156 | 126.7 Ų | 126.7 | 73% | 0.729 | 76% | 0.758 | S | S | * | * | cis | 174.5 | 155.5 | -10.6 | -124.4 | -165 | 106 | 0 | 0 | 105 | ||||
| 33 | Q | 31.2 | Very low | 33.2 | Very low | 151 Ų | 151 | 126.5 Ų | 126.5 | 71% | 0.706 | 75% | 0.754 | S | S | * | * | trans | 51.4 | 124 | 156.8 | -57.2 | -178.1 | 36.9 | 0 | 0 | 121.5 | ||||
| 34 | T | 31.9 | Very low | 33.3 | Very low | 138 Ų | 138 | 127.1 Ų | 127.1 | 85% | 0.847 | 75% | 0.752 | S | S | * | * | 156 | 158.2 | 120.7 | 43.1 | 0 | 0 | 0 | 0 | 111 | |||||
| 35 | N | 30.2 | Very low | 33.5 | Very low | 132 Ų | 132 | 129.3 Ų | 129.3 | 71% | 0.706 | 76% | 0.755 | S | S | * | * | cis | -164.5 | 163.8 | -44.7 | -153.1 | -2.9 | 0 | 0 | 0 | 108 | ||||
| 36 | N | 32.2 | Very low | 33.7 | Very low | 154 Ų | 154 | 128.5 Ų | 128.5 | 82% | 0.824 | 75% | 0.746 | S | S | * | * | trans | 68.4 | 147.7 | 176.7 | -41.3 | -37.3 | 0 | 0 | 0 | 114.7 | ||||
| 37 | G | 31.4 | Very low | 33.9 | Very low | 68 Ų | 68 | 133.8 Ų | 133.8 | 70% | 0.701 | 76% | 0.756 | S | S | * | * | cis | 149.8 | 150 | 1.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 38 | Q | 39.1 | Very low | 34.2 | Very low | 181 Ų | 181 | 131 Ų | 131 | 85% | 0.846 | 76% | 0.755 | S | S | * | * | cis | -132.8 | -156.1 | 0.5 | -62.2 | 150.9 | -128.9 | 0 | 0 | 106.9 | ||||
| 39 | D | 33.7 | Very low | 34.5 | Very low | 132 Ų | 132 | 130.5 Ų | 130.5 | 71% | 0.706 | 76% | 0.757 | S | S | * | * | cis | -164.5 | 179.8 | -4.8 | -132.7 | -41.7 | 0 | 0 | 0 | 105.9 | ||||
| 40 | S | 37.1 | Very low | 34.5 | Very low | 83 Ų | 83 | 130.9 Ų | 130.9 | 58% | 0.58 | 76% | 0.755 | S | S | * | * | cis | -161.9 | 179.4 | 0.4 | 58.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 41 | H | 35.4 | Very low | 34.9 | Very low | 172 Ų | 172 | 135.4 Ų | 135.4 | 80% | 0.796 | 76% | 0.763 | S | S | * | * | trans | 66.7 | 142.1 | 160.8 | -87.8 | -89 | 0 | 0 | 0 | 120.6 | ||||
| 42 | V | 34.4 | Very low | 35.1 | Very low | 110 Ų | 110 | 135.8 Ų | 135.8 | 67% | 0.667 | 76% | 0.756 | S | S | * | * | cis | -172.9 | 153.7 | -48.2 | 131.9 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 43 | K | 34.2 | Very low | 35.9 | Very low | 175 Ų | 175 | 138 Ų | 138 | 76% | 0.761 | 76% | 0.758 | S | S | * | * | trans | 82.1 | 120.8 | -178.4 | -67.5 | 159.5 | -175.8 | 178.6 | 0 | 114.7 | ||||
| 44 | Q | 40.2 | Very low | 36.1 | Very low | 180 Ų | 180 | 139 Ų | 139 | 84% | 0.841 | 77% | 0.767 | S | S | * | * | 71.3 | 133.9 | 54 | -65.3 | 174.7 | -16.6 | 0 | 0 | 112.5 | |||||
| 45 | S | 38.2 | Very low | 36.5 | Very low | 121 Ų | 121 | 138.1 Ų | 138.1 | 85% | 0.846 | 77% | 0.767 | S | S | * | * | cis | -164.8 | 165.2 | -2 | 45.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 46 | G | 36.2 | Very low | 36.9 | Very low | 64 Ų | 64 | 143.9 Ų | 143.9 | 66% | 0.66 | 78% | 0.779 | S | S | * | * | cis | 158.6 | 160.3 | -4.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 47 | Q | 40.6 | Very low | 37 | Very low | 202 Ų | 202 | 141.2 Ų | 141.2 | 94% | 0.944 | 78% | 0.778 | S | S | * | * | trans | 65.1 | 155.4 | 172.9 | -61.7 | 180 | -9.5 | 0 | 0 | 116.8 | ||||
| 48 | A | 38.1 | Very low | 37 | Very low | 95 Ų | 95 | 141.3 Ų | 141.3 | 79% | 0.785 | 78% | 0.779 | S | S | * | * | cis | -172.3 | 161.5 | -25.8 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 49 | N | 39.1 | Very low | 36.8 | Very low | 145 Ų | 145 | 138.1 Ų | 138.1 | 78% | 0.775 | 77% | 0.771 | S | S | * | * | cis | 168.2 | 161 | -18.3 | -176.2 | 15.2 | 0 | 0 | 0 | 104.5 | ||||
| 50 | V | 30.3 | Very low | 36.7 | Very low | 114 Ų | 114 | 143.3 Ų | 143.3 | 69% | 0.691 | 78% | 0.781 | S | S | * | * | trans | 75.3 | 144.4 | 167.1 | -163.2 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 51 | L | 36.4 | Very low | 36.4 | Very low | 158 Ų | 158 | 143.9 Ų | 143.9 | 83% | 0.827 | 79% | 0.791 | S | S | * | * | trans | -52.8 | 153.4 | 179.9 | -66.5 | 54.9 | 0 | 0 | 0 | 115.9 | ||||
| 52 | D | 38.2 | Very low | 36.5 | Very low | 121 Ų | 121 | 145.1 Ų | 145.1 | 65% | 0.647 | 79% | 0.794 | S | S | * | * | -160.9 | 164.1 | 115.3 | -143.1 | -15 | 0 | 0 | 0 | 115 | |||||
| 53 | R | 45.3 | Very low | 37 | Very low | 203 Ų | 203 | 146 Ų | 146 | 77% | 0.766 | 80% | 0.802 | S | S | * | * | trans | 62 | 81.5 | 154.3 | -77.2 | 156.7 | -137.6 | -101.5 | -16.6 | 121.7 | ||||
| 54 | L | 36.8 | Very low | 36.9 | Very low | 171 Ų | 171 | 142.2 Ų | 142.2 | 90% | 0.895 | 80% | 0.803 | S | S | * | * | 31.8 | 129.5 | 111.9 | -68.3 | 167.4 | 0 | 0 | 0 | 120.7 | |||||
| 55 | S | 40.5 | Very low | 36.7 | Very low | 120 Ų | 120 | 138.9 Ų | 138.9 | 84% | 0.839 | 80% | 0.8 | S | S | * | * | trans | -72.9 | 156.4 | 171.6 | -37.2 | 0 | 0 | 0 | 0 | 115 | ||||
| 56 | R | 38 | Very low | 36.7 | Very low | 252 Ų | 252 | 139.5 Ų | 139.5 | 95% | 0.951 | 80% | 0.798 | S | S | * | * | trans | -152.2 | 157.7 | 149.7 | -133 | 169.6 | -179.4 | 130.2 | -0 | 112.4 | ||||
| 57 | A | 33.3 | Very low | 36.6 | Very low | 98 Ų | 98 | 141.7 Ų | 141.7 | 81% | 0.81 | 80% | 0.799 | S | S | * | * | trans | -66 | 161.4 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 58 | G | 31.7 | Very low | 36.4 | Very low | 70 Ų | 70 | 137.2 Ų | 137.2 | 72% | 0.722 | 79% | 0.786 | S | S | * | * | cis | 144.4 | -167.7 | 0.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 59 | V | 35.3 | Very low | 36.2 | Very low | 114 Ų | 114 | 142.7 Ų | 142.7 | 69% | 0.691 | 79% | 0.787 | S | S | * | * | trans | 75.8 | 105 | 162.7 | -172.5 | 0 | 0 | 0 | 0 | 119 | ||||
| 60 | R | 31.7 | Very low | 36.1 | Very low | 242 Ų | 242 | 140.1 Ų | 140.1 | 91% | 0.913 | 79% | 0.786 | S | S | * | * | trans | 66.4 | 157 | 151.2 | -60.6 | 169.9 | -175.2 | 166.9 | -0.1 | 116.8 | ||||
| 61 | A | 29.9 | Very low | 36.4 | Very low | 94 Ų | 94 | 140.1 Ų | 140.1 | 78% | 0.777 | 79% | 0.792 | S | S | * | * | cis | -148 | 168.8 | 17.5 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 62 | F | 37.4 | Very low | 36.5 | Very low | 199 Ų | 199 | 136.9 Ų | 136.9 | 87% | 0.873 | 79% | 0.788 | S | S | * | * | trans | -88.1 | 159.2 | 157.3 | -87.1 | -86.3 | 0 | 0 | 0 | 110.4 | ||||
| 63 | P | 45.4 | Very low | 36.3 | Very low | 129 Ų | 129 | 142.5 Ų | 142.5 | 84% | 0.838 | 80% | 0.8 | S | S | * | * | -133.7 | -179.5 | 109.8 | 37.8 | -28.5 | 0 | 0 | 0 | 113.3 | |||||
| 64 | A | 32.6 | Very low | 35.8 | Very low | 94 Ų | 94 | 145 Ų | 145 | 78% | 0.777 | 81% | 0.809 | S | S | * | * | trans | -137.2 | 153.6 | -172.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 65 | S | 36.3 | Very low | 35.7 | Very low | 110 Ų | 110 | 142.9 Ų | 142.9 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | -173.4 | 125.5 | 160.3 | 35.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 66 | V | 36.9 | Very low | 35.6 | Very low | 134 Ų | 134 | 147.3 Ų | 147.3 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | 70.6 | 120.9 | 96.5 | 172 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 67 | T | 35.6 | Very low | 35.5 | Very low | 111 Ų | 111 | 144 Ų | 144 | 68% | 0.681 | 81% | 0.807 | S | S | * | * | cis | -157.8 | 159.1 | 17.1 | -13.5 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 68 | T | 35.8 | Very low | 35.6 | Very low | 107 Ų | 107 | 146.4 Ų | 146.4 | 66% | 0.656 | 80% | 0.802 | S | S | * | * | trans | 60.3 | 156.4 | 154.6 | 42.8 | 0 | 0 | 0 | 0 | 120 | ||||
| 69 | Y | 33.3 | Very low | 35.8 | Very low | 210 Ų | 210 | 154 Ų | 154 | 82% | 0.824 | 81% | 0.809 | S | S | * | * | cis | -147.8 | 153.4 | 4.9 | -111.9 | -63.3 | 0 | 0 | 0 | 110 | ||||
| 70 | A | 36.6 | Very low | 35.5 | Very low | 91 Ų | 91 | 157.1 Ų | 157.1 | 75% | 0.752 | 82% | 0.816 | S | S | * | * | trans | 61.8 | 151.8 | 158.3 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 71 | S | 38.1 | Very low | 36.2 | Very low | 115 Ų | 115 | 150.3 Ų | 150.3 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | cis | -161.5 | 161.9 | -13.7 | -107.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 72 | A | 37.9 | Very low | 36.2 | Very low | 90 Ų | 90 | 152.1 Ų | 152.1 | 74% | 0.744 | 80% | 0.804 | S | S | * | * | trans | 23.5 | 143.8 | 152.4 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 73 | R | 34.2 | Very low | 35.7 | Very low | 239 Ų | 239 | 149.1 Ų | 149.1 | 90% | 0.902 | 80% | 0.802 | S | S | * | * | cis | -167 | 139.4 | -0.7 | -109.1 | 171.7 | -177.4 | -177.8 | 1.3 | 107.1 | ||||
| 74 | R | 34.8 | Very low | 35.3 | Very low | 254 Ų | 254 | 148.5 Ų | 148.5 | 96% | 0.958 | 80% | 0.799 | S | S | * | * | trans | -142.6 | 129.6 | 155.7 | -83 | -163.6 | 176.4 | -150.3 | -0.3 | 109.7 | ||||
| 75 | S | 34.3 | Very low | 35 | Very low | 128 Ų | 128 | 152 Ų | 152 | 90% | 0.895 | 81% | 0.805 | S | S | * | * | trans | -80.8 | 133.7 | 175 | 36.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 76 | R | 37.8 | Very low | 35.2 | Very low | 213 Ų | 213 | 152.8 Ų | 152.8 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | -132.2 | 119.1 | 170.8 | -174.1 | -172 | -162.4 | 173 | 6.5 | 106.4 | ||||
| 77 | L | 37.3 | Very low | 34.8 | Very low | 181 Ų | 181 | 154.3 Ų | 154.3 | 95% | 0.948 | 81% | 0.809 | S | S | * | * | trans | -113.7 | 137.9 | 167 | -86.1 | 168.9 | 0 | 0 | 0 | 109 | ||||
| 78 | Q | 34.3 | Very low | 34.9 | Very low | 150 Ų | 150 | 156.5 Ų | 156.5 | 70% | 0.701 | 82% | 0.816 | S | S | * | * | trans | -133 | 144.9 | -170.2 | -178.2 | 167.7 | -32.7 | 0 | 0 | 107.6 | ||||
| 79 | R | 36.5 | Very low | 34.5 | Very low | 229 Ų | 229 | 156.5 Ų | 156.5 | 86% | 0.864 | 82% | 0.821 | S | S | * | * | trans | -53.3 | 141 | 179.6 | -65.6 | 173.5 | 170.3 | 176.3 | -5.2 | 111.9 | ||||
| 80 | Q | 29.4 | Very low | 34.5 | Very low | 179 Ų | 179 | 151.4 Ų | 151.4 | 84% | 0.836 | 82% | 0.815 | S | S | * | * | -156.5 | 154.5 | 115 | -83.3 | -56.9 | 16.4 | 0 | 0 | 109.5 | |||||
| 81 | P | 46.8 | Very low | 34.8 | Very low | 99 Ų | 99 | 153 Ų | 153 | 64% | 0.643 | 82% | 0.821 | S | S | * | * | trans | -103.1 | 161.9 | 171.4 | 39.1 | -31.8 | 0 | 0 | 0 | 112.4 | ||||
| 82 | V | 28.4 | Very low | 34.6 | Very low | 132 Ų | 132 | 156.4 Ų | 156.4 | 80% | 0.8 | 82% | 0.824 | S | S | * | * | -176.2 | 138.3 | 122.6 | -94.6 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 83 | V | 28 | Very low | 34.8 | Very low | 137 Ų | 137 | 164.6 Ų | 164.6 | 83% | 0.83 | 84% | 0.836 | S | S | * | * | trans | 66.7 | 152 | 144.6 | 177.8 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 84 | C | 36.9 | Very low | 35 | Very low | 115 Ų | 115 | 156 Ų | 156 | 78% | 0.777 | 82% | 0.822 | S | S | * | * | trans | -96.3 | 161.6 | -166.5 | -45.4 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 85 | D | 26.3 | Very low | 35.7 | Very low | 168 Ų | 168 | 149.3 Ų | 149.3 | 90% | 0.898 | 81% | 0.814 | S | S | * | * | trans | -137.6 | 144.4 | 146.5 | -121.4 | -37.1 | 0 | 0 | 0 | 109.9 | ||||
| 86 | T | 39.4 | Very low | 36.8 | Very low | 126 Ų | 126 | 147.1 Ų | 147.1 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | trans | -99 | 122.7 | -170.7 | -42.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 87 | N | 29 | Very low | 38.4 | Very low | 166 Ų | 166 | 140.2 Ų | 140.2 | 89% | 0.888 | 77% | 0.773 | S | S | * | * | trans | -153.7 | 151.2 | 161.9 | -104.6 | -53.4 | 0 | 0 | 0 | 113.2 | ||||
| 88 | N | 38 | Very low | 39.3 | Very low | 158 Ų | 158 | 136.3 Ų | 136.3 | 85% | 0.845 | 76% | 0.759 | S | S | * | * | trans | -86.5 | 124.2 | -168.4 | 176.6 | 18.8 | 0 | 0 | 0 | 112.2 | ||||
| 89 | S | 28.2 | Very low | 40 | Very low | 107 Ų | 107 | 132.2 Ų | 132.2 | 75% | 0.748 | 75% | 0.75 | S | S | * | * | trans | -145.5 | 137 | 160.6 | 57.2 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 90 | S | 32.3 | Very low | 41.2 | Very low | 102 Ų | 102 | 126.1 Ų | 126.1 | 71% | 0.713 | 73% | 0.733 | S | S | * | * | trans | -28.6 | 124 | 170.6 | 51.4 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 91 | S | 43.2 | Very low | 43.3 | Very low | 124 Ų | 124 | 122.7 Ų | 122.7 | 87% | 0.867 | 71% | 0.712 | S | S | * | * | trans | 36.8 | 84.3 | 132.8 | -57.7 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 92 | E | 33.9 | Very low | 44.2 | Very low | 188 Ų | 188 | 123.1 Ų | 123.1 | 88% | 0.879 | 70% | 0.704 | S | S | * | * | trans | -112.8 | 127.8 | 143.3 | -70.9 | -155.9 | 133.8 | 0 | 0 | 110 | G94 | E92-G94 PolarHBondContact O-N 3.3Š| ||
| 93 | R | 40.8 | Very low | 46.1 | Very low | 262 Ų | 262 | 121.9 Ų | 121.9 | 99% | 0.989 | 69% | 0.692 | S | S | * | * | trans | -78.7 | 61.5 | 172.1 | -76 | -172.7 | 173.9 | -173.8 | -1.2 | 110.6 | S95 | R93-S95 PolarHBondContact O-N 3.23Š| ||
| 94 | G | 39.4 | Very low | 48 | Very low | 59 Ų | 59 | 121.8 Ų | 121.8 | 61% | 0.608 | 68% | 0.678 | S | S | * | * | trans | -61.4 | 120.9 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110 | E92 L96 | E92-G94 PolarHBondContact O-N 3.3Å; G94-L96 PolarHBondContact O-N 3.49Å | ||
| 95 | S | 49.3 | Very low | 49.4 | Very low | 113 Ų | 113 | 118.8 Ų | 118.8 | 79% | 0.79 | 65% | 0.654 | S | S | * | * | trans | -66.7 | 120.8 | 174.3 | 46.8 | 0 | 0 | 0 | 0 | 109.4 | R93 T97 | R93-S95 PolarHBondContact O-N 3.23Å; S95-T97 PolarHBondContact O-N 2.86Å | ||
| 96 | L | 58.6 | Low | 51.3 | Low | 81 Ų | 81 | 117 Ų | 117 | 42% | 0.424 | 64% | 0.638 | S | S | . | * | trans | -61 | 115.4 | -179.5 | -78 | 82.7 | 0 | 0 | 0 | 109.7 | G94 M100 R101 | G94-L96 PolarHBondContact O-N 3.49Å; L96-M100 HydrophobicContact CB-CB 4.28Å; L96-M100 HydrophobicContact CD2-CB 4.43Å; L96-M100 HydrophobicContact CG-CB 4.46Å; L96-R101 HydrophobicContact CB-CG 3.87Å; L96-R101 HydrophobicContact CD2-CG 4.37Å; L96-R101 PolarHBondContact O-NE 2.67Å | ||
| 97 | T | 69.9 | Low | 52.3 | Low | 68 Ų | 68 | 115.2 Ų | 115.2 | 42% | 0.417 | 62% | 0.624 | S | S | . | * | trans | -55.2 | 152.7 | 173 | 67.9 | 0 | 0 | 0 | 0 | 109.9 | S95 A99 M100 R101 | S95-T97 PolarHBondContact O-N 2.86Å; T97-A99 PolarHBondContact O-N 2.91Å; T97-A99 VanDerWaalsContact O-N 3.12Å; T97-M100 HydrophobicContact CG2-SD 4.17Å; T97-M100 PolarHBondContact O-N 3Å; T97-M100 VanDerWaalsContact OG1-CG 3.26Å; T97-M100 WeakPolarHBondContact OG1-CG 3.24Å; T97-M100 PolarHBondContact OG1-N 2.99Å; T97-R101 PolarHBondContact O-N 2.91Å | ||
| 98 | P | 57.2 | Low | 54 | Low | 100 Ų | 100 | 110.5 Ų | 110.5 | 65% | 0.649 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -54.2 | -34.3 | 179.1 | -28.2 | 36.3 | 0 | 0 | 0 | 113.4 | R101 K102 | P98-R101 PolarHBondContact O-N 2.82Å; P98-K102 PolarHBondContact O-N 3.48Å |
| 99 | A | 49.2 | Very low | 54.7 | Low | 63 Ų | 63 | 107.3 Ų | 107.3 | 52% | 0.521 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -65.5 | -45 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | T97 R101 K102 I103 | T97-A99 PolarHBondContact O-N 2.91Å; T97-A99 VanDerWaalsContact O-N 3.12Å; A99-R101 VanDerWaalsContact C-N 3.29Å; A99-R101 PolarHBondContact O-N 2.97Å; A99-K102 PolarHBondContact O-N 3.31Å; A99-I103 WeakPolarHBondContact O-CG1 3.32Å; A99-I103 PolarHBondContact O-N 3.45Å |
| 100 | M | 61.3 | Low | 55.8 | Low | 101 Ų | 101 | 107 Ų | 107 | 50% | 0.498 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.7 | -34.8 | 174.9 | -69.6 | 167.7 | 75.4 | 0 | 0 | 111.9 | L96 T97 I103 Y104 | L96-M100 HydrophobicContact CB-CB 4.28Å; L96-M100 HydrophobicContact CD2-CB 4.43Å; L96-M100 HydrophobicContact CG-CB 4.46Å; T97-M100 HydrophobicContact CG2-SD 4.17Å; T97-M100 PolarHBondContact O-N 3Å; T97-M100 VanDerWaalsContact OG1-CG 3.26Å; T97-M100 WeakPolarHBondContact OG1-CG 3.24Å; T97-M100 PolarHBondContact OG1-N 2.99Å; M100-I103 PolarHBondContact O-N 3.2Å; M100-Y104 VanDerWaalsContact O-CB 3.27Å; M100-Y104 WeakPolarHBondContact O-CB 3.31Å; M100-Y104 PolarHBondContact O-N 3.31Å |
| 101 | R | 73 | Confident | 56.3 | Low | 107 Ų | 107 | 109.3 Ų | 109.3 | 40% | 0.404 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -64.4 | -45.9 | 171.3 | -81.6 | -174.1 | -88.2 | 151.3 | -5.1 | 112.2 | L96 T97 P98 A99 I103 Y104 L105 | L96-R101 HydrophobicContact CB-CG 3.87Å; L96-R101 HydrophobicContact CD2-CG 4.37Å; L96-R101 PolarHBondContact O-NE 2.67Å; T97-R101 PolarHBondContact O-N 2.91Å; P98-R101 PolarHBondContact O-N 2.82Å; A99-R101 VanDerWaalsContact C-N 3.29Å; A99-R101 PolarHBondContact O-N 2.97Å; R101-I103 VanDerWaalsContact C-N 3.3Å; R101-I103 PolarHBondContact O-N 3.47Å; R101-Y104 PolarHBondContact O-N 2.9Å; R101-L105 WeakPolarHBondContact O-CB 3.4Å; R101-L105 WeakPolarHBondContact O-CD1 3.29Å; R101-L105 VanDerWaalsContact O-CG 3.22Å; R101-L105 WeakPolarHBondContact O-CG 3.33Å; R101-L105 PolarHBondContact O-N 3.23Å |
| 102 | K | 65.2 | Low | 56.5 | Low | 109 Ų | 109 | 107.5 Ų | 107.5 | 47% | 0.474 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62.4 | -35 | 176.7 | -171.4 | 163.8 | -172.2 | 169.8 | 0 | 112.4 | P98 A99 K106 T160 D163 | P98-K102 PolarHBondContact O-N 3.48Å; A99-K102 PolarHBondContact O-N 3.31Å; K102-K106 WeakPolarHBondContact O-CB 3.33Å; K102-K106 PolarHBondContact O-N 3.03Å; K102-T160 HydrophobicContact CD-CG2 4.3Å; K102-D163 IonicContact NZ-OD2 2.74Å; K102-D163 PolarHBondContact NZ-OD2 3Å |
| 103 | I | 69.3 | Low | 57.1 | Low | 105 Ų | 105 | 103.7 Ų | 103.7 | 54% | 0.538 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -68.5 | -55.1 | 174.5 | -65 | 163.9 | 0 | 0 | 0 | 110.7 | A99 M100 R101 L105 K106 D107 | A99-I103 WeakPolarHBondContact O-CG1 3.32Å; A99-I103 PolarHBondContact O-N 3.45Å; M100-I103 PolarHBondContact O-N 3.2Å; R101-I103 VanDerWaalsContact C-N 3.3Å; R101-I103 PolarHBondContact O-N 3.47Å; I103-L105 VanDerWaalsContact C-N 3.32Å; I103-L105 PolarHBondContact O-N 3.18Å; I103-K106 WeakPolarHBondContact O-CB 3.35Å; I103-K106 PolarHBondContact O-N 2.64Å; I103-D107 PolarHBondContact O-N 2.91Å |
| 104 | Y | 68.4 | Low | 57.4 | Low | 136 Ų | 136 | 94.8 Ų | 94.8 | 53% | 0.533 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -58.7 | -40.2 | -176.9 | -177.4 | -109.5 | 0 | 0 | 0 | 113.1 | M100 R101 D107 L108 | M100-Y104 VanDerWaalsContact O-CB 3.27Å; M100-Y104 WeakPolarHBondContact O-CB 3.31Å; M100-Y104 PolarHBondContact O-N 3.31Å; R101-Y104 PolarHBondContact O-N 2.9Å; Y104-D107 PolarHBondContact O-N 3.48Å; Y104-L108 HydrophobicContact CD1-CD1 3.94Å; Y104-L108 HydrophobicContact CE1-CD1 3.54Å; Y104-L108 HydrophobicContact CE1-CG 4.32Å; Y104-L108 WeakPolarHBondContact O-CB 3.22Å; Y104-L108 WeakPolarHBondContact O-CG 3.35Å; Y104-L108 PolarHBondContact O-N 3.37Å |
| 105 | L | 65.9 | Low | 57.6 | Low | 51 Ų | 51 | 95.1 Ų | 95.1 | 27% | 0.267 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66.9 | -35.8 | 175.9 | -68.9 | 169.3 | 0 | 0 | 0 | 112.4 | R101 I103 F109 A148 | R101-L105 WeakPolarHBondContact O-CB 3.4Å; R101-L105 WeakPolarHBondContact O-CD1 3.29Å; R101-L105 VanDerWaalsContact O-CG 3.22Å; R101-L105 WeakPolarHBondContact O-CG 3.33Å; R101-L105 PolarHBondContact O-N 3.23Å; I103-L105 VanDerWaalsContact C-N 3.32Å; I103-L105 PolarHBondContact O-N 3.18Å; L105-F109 WeakPolarHBondContact O-CB 3.4Å; L105-F109 PolarHBondContact O-N 2.92Å; L105-A148 HydrophobicContact CD1-CB 3.75Å; L105-A148 HydrophobicContact CD2-CB 3.97Å; L105-A148 HydrophobicContact CG-CB 4.36Å |
| 106 | K | 65 | Low | 57.2 | Low | 131 Ų | 131 | 98.7 Ų | 98.7 | 57% | 0.57 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -70.3 | -40.1 | 176.4 | -176.2 | 163.9 | -175.5 | 158.6 | 0 | 112.4 | K102 I103 F109 L110 | K102-K106 WeakPolarHBondContact O-CB 3.33Å; K102-K106 PolarHBondContact O-N 3.03Å; I103-K106 WeakPolarHBondContact O-CB 3.35Å; I103-K106 PolarHBondContact O-N 2.64Å; K106-F109 PolarHBondContact O-N 2.83Å; K106-L110 HydrophobicContact CG-CD1 4.07Å; K106-L110 WeakPolarHBondContact O-CG 3.4Å; K106-L110 PolarHBondContact O-N 3.26Å; K106-L110 VanDerWaalsContact O-N 3.07Å |
| 107 | D | 60.8 | Low | 56.1 | Low | 89 Ų | 89 | 99.3 Ų | 99.3 | 48% | 0.476 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -67.5 | -38.5 | 177 | -67 | -20.7 | 0 | 0 | 0 | 111.5 | I103 Y104 N111 | I103-D107 PolarHBondContact O-N 2.91Å; Y104-D107 PolarHBondContact O-N 3.48Å; D107-N111 PolarHBondContact O-N 3.3Å |
| 108 | L | 64.6 | Low | 54.6 | Low | 67 Ų | 67 | 101.2 Ų | 101.2 | 35% | 0.351 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -60.6 | -44.3 | 170.6 | -77.3 | 175.4 | 0 | 0 | 0 | 112.1 | Y104 S112 P144 | Y104-L108 HydrophobicContact CD1-CD1 3.94Å; Y104-L108 HydrophobicContact CE1-CD1 3.54Å; Y104-L108 HydrophobicContact CE1-CG 4.32Å; Y104-L108 WeakPolarHBondContact O-CB 3.22Å; Y104-L108 WeakPolarHBondContact O-CG 3.35Å; Y104-L108 PolarHBondContact O-N 3.37Å; L108-S112 VanDerWaalsContact O-CB 3.31Å; L108-S112 WeakPolarHBondContact O-CB 3.48Å; L108-S112 PolarHBondContact O-N 3.42Å; L108-P144 HydrophobicContact CD1-CB 4.4Å |
| 109 | F | 54.3 | Low | 53.8 | Low | 90 Ų | 90 | 103 Ų | 103 | 40% | 0.395 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -63.9 | -46.9 | -178.5 | -172.6 | -115.8 | 0 | 0 | 0 | 112.2 | L105 K106 N111 S112 M145 E167 | L105-F109 WeakPolarHBondContact O-CB 3.4Å; L105-F109 PolarHBondContact O-N 2.92Å; K106-F109 PolarHBondContact O-N 2.83Å; F109-N111 PolarHBondContact O-N 3.16Å; F109-S112 PolarHBondContact O-N 2.72Å; F109-M145 HydrophobicContact CD2-CE 3.4Å; F109-M145 HydrophobicContact CE2-CE 3.43Å; F109-M145 VanDerWaalsContact CE2-CE 3.43Å; F109-M145 HydrophobicContact CG-CE 4.19Å; F109-M145 HydrophobicContact CZ-CE 4.24Å; F109-E167 HydrophobicContact CE1-CB 4.43Å; F109-E167 HydrophobicContact CE1-CG 3.84Å; F109-E167 WeakPolarHBondContact CE1-OE1 3.49Å; F109-E167 HydrophobicContact CZ-CB 4.01Å; F109-E167 HydrophobicContact CZ-CG 3.94Å |
| 110 | L | 50.6 | Low | 53.4 | Low | 101 Ų | 101 | 110.7 Ų | 110.7 | 53% | 0.529 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -64.8 | -41.3 | -178.7 | -68.6 | 168.7 | 0 | 0 | 0 | 112.7 | K106 S112 S113 | K106-L110 HydrophobicContact CG-CD1 4.07Å; K106-L110 WeakPolarHBondContact O-CG 3.4Å; K106-L110 PolarHBondContact O-N 3.26Å; K106-L110 VanDerWaalsContact O-N 3.07Å; L110-S112 VanDerWaalsContact C-N 3.33Å; L110-S112 PolarHBondContact O-N 3.25Å; L110-S113 PolarHBondContact O-OG 3.06Å |
| 111 | N | 43.5 | Very low | 52.4 | Low | 150 Ų | 150 | 111.9 Ų | 111.9 | 80% | 0.802 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -75.7 | -14.5 | 178.8 | -87 | -14 | 0 | 0 | 0 | 114.5 | D107 F109 | D107-N111 PolarHBondContact O-N 3.3Å; F109-N111 PolarHBondContact O-N 3.16Å |
| 112 | S | 46.4 | Very low | 50.6 | Low | 87 Ų | 87 | 112.4 Ų | 112.4 | 61% | 0.608 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.9 | 9.7 | -177.7 | -154.2 | 0 | 0 | 0 | 0 | 114 | L108 F109 L110 G114 | L108-S112 VanDerWaalsContact O-CB 3.31Å; L108-S112 WeakPolarHBondContact O-CB 3.48Å; L108-S112 PolarHBondContact O-N 3.42Å; F109-S112 PolarHBondContact O-N 2.72Å; L110-S112 VanDerWaalsContact C-N 3.33Å; L110-S112 PolarHBondContact O-N 3.25Å; S112-G114 PolarHBondContact O-N 3.24Å |
| 113 | S | 47.4 | Very low | 49.6 | Very low | 108 Ų | 108 | 114.2 Ų | 114.2 | 76% | 0.755 | 66% | 0.662 | S | S | * | * | trans | -65.3 | 10 | 179.4 | 49.4 | 0 | 0 | 0 | 0 | 115.6 | L110 | L110-S113 PolarHBondContact O-OG 3.06Š| ||
| 114 | G | 46.1 | Very low | 47.9 | Very low | 75 Ų | 75 | 112.8 Ų | 112.8 | 77% | 0.773 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -102.8 | 57.2 | -172.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | S112 | S112-G114 PolarHBondContact O-N 3.24Š|
| 115 | G | 44.3 | Very low | 46.4 | Very low | 65 Ų | 65 | 112.7 Ų | 112.7 | 67% | 0.67 | 69% | 0.693 | S | S | * | * | trans | 99.7 | 81.4 | 152.5 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 116 | F | 39.5 | Very low | 44.8 | Very low | 188 Ų | 188 | 114.2 Ų | 114.2 | 83% | 0.825 | 72% | 0.721 | S | S | * | * | trans | -117.6 | 30.4 | 169.4 | -99.1 | -85.1 | 0 | 0 | 0 | 114.6 | S118 | F116-S118 VanDerWaalsContact C-N 3.3Å; F116-S118 PolarHBondContact O-N 2.82Å | ||
| 117 | A | 36 | Very low | 43.5 | Very low | 95 Ų | 95 | 112.9 Ų | 112.9 | 79% | 0.785 | 74% | 0.735 | S | S | * | * | trans | -77.2 | -2.3 | -176 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 118 | S | 39.1 | Very low | 42 | Very low | 108 Ų | 108 | 113.8 Ų | 113.8 | 76% | 0.755 | 75% | 0.748 | S | S | * | * | trans | -141.7 | 67.2 | -169.9 | -73.8 | 0 | 0 | 0 | 0 | 115.1 | F116 | F116-S118 VanDerWaalsContact C-N 3.3Å; F116-S118 PolarHBondContact O-N 2.82Å | ||
| 119 | V | 39.7 | Very low | 40.5 | Very low | 136 Ų | 136 | 115.1 Ų | 115.1 | 82% | 0.824 | 76% | 0.763 | S | S | * | * | trans | -128.2 | 95.1 | 147.3 | -178.7 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 120 | R | 40.5 | Very low | 39.7 | Very low | 226 Ų | 226 | 121.3 Ų | 121.3 | 85% | 0.853 | 78% | 0.784 | S | S | * | * | trans | -105.9 | 144.3 | 174.1 | -66.9 | -179.8 | 68.6 | -173.5 | 1.4 | 109.6 | ||||
| 121 | S | 41.5 | Very low | 39 | Very low | 125 Ų | 125 | 124.2 Ų | 124.2 | 87% | 0.874 | 79% | 0.794 | S | S | * | * | trans | -25.1 | 127.1 | -179.5 | -53 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 122 | S | 35.2 | Very low | 39.1 | Very low | 119 Ų | 119 | 125.8 Ų | 125.8 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | trans | -134.9 | 83.8 | 162.2 | 48.1 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 123 | T | 43.5 | Very low | 38.6 | Very low | 146 Ų | 146 | 124.7 Ų | 124.7 | 90% | 0.896 | 80% | 0.803 | S | S | * | * | trans | -80.3 | 113.6 | 161.3 | 49.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 124 | G | 34.5 | Very low | 38.4 | Very low | 75 Ų | 75 | 128.5 Ų | 128.5 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | trans | -176.7 | 123.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 125 | S | 37.3 | Very low | 38.2 | Very low | 134 Ų | 134 | 133.7 Ų | 133.7 | 94% | 0.937 | 81% | 0.813 | S | S | * | * | trans | -68.5 | 144.5 | 176.4 | -42.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 126 | G | 32.1 | Very low | 38.2 | Very low | 83 Ų | 83 | 135.3 Ų | 135.3 | 86% | 0.856 | 81% | 0.81 | S | S | * | * | trans | -176.8 | 125 | 170 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 127 | A | 36.2 | Very low | 38.4 | Very low | 104 Ų | 104 | 131.4 Ų | 131.4 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | trans | -91.4 | 157.2 | -169.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 128 | S | 30.6 | Very low | 38.7 | Very low | 107 Ų | 107 | 134.5 Ų | 134.5 | 75% | 0.748 | 80% | 0.8 | S | S | * | * | trans | 112.6 | 125 | 138.6 | -157.9 | 0 | 0 | 0 | 0 | 119 | ||||
| 129 | S | 32.9 | Very low | 39.1 | Very low | 95 Ų | 95 | 132.9 Ų | 132.9 | 66% | 0.664 | 80% | 0.799 | S | S | * | * | trans | 70.3 | 113 | 144.9 | -61.8 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 130 | R | 37.8 | Very low | 39.8 | Very low | 221 Ų | 221 | 136.6 Ų | 136.6 | 83% | 0.834 | 80% | 0.799 | S | S | * | * | 69.7 | 135.9 | 127.9 | -85.2 | -176.2 | 145.6 | 106 | -3.2 | 118.5 | |||||
| 131 | E | 34.8 | Very low | 40.8 | Very low | 161 Ų | 161 | 129.7 Ų | 129.7 | 75% | 0.752 | 79% | 0.79 | S | S | * | * | cis | -131.1 | -174.1 | 7.6 | -63.6 | -154.3 | 132.6 | 0 | 0 | 112.8 | G133 | E131-G133 PolarHBondContact O-N 3.18Š| ||
| 132 | I | 46.6 | Very low | 41.8 | Very low | 183 Ų | 183 | 125.5 Ų | 125.5 | 94% | 0.938 | 76% | 0.758 | S | S | * | * | trans | -72 | 109.9 | -175.1 | -60.1 | 167.1 | 0 | 0 | 0 | 109.8 | ||||
| 133 | G | 34.6 | Very low | 43.6 | Very low | 64 Ų | 64 | 123.5 Ų | 123.5 | 66% | 0.66 | 74% | 0.743 | S | S | * | * | trans | -121.1 | 154.4 | 165.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | E131 E135 | E131-G133 PolarHBondContact O-N 3.18Å; G133-E135 PolarHBondContact O-N 3.17Å | ||
| 134 | E | 43.8 | Very low | 45.2 | Very low | 188 Ų | 188 | 120.3 Ų | 120.3 | 88% | 0.879 | 73% | 0.725 | S | S | * | * | trans | -35.5 | 127.7 | -172.4 | -63.5 | 171.8 | 142.9 | 0 | 0 | 114.7 | V136 | E134-V136 PolarHBondContact O-N 3.36Š| ||
| 135 | E | 42.7 | Very low | 47.4 | Very low | 184 Ų | 184 | 118.6 Ų | 118.6 | 86% | 0.86 | 70% | 0.697 | S | S | * | * | trans | -69.6 | 94.8 | 176.7 | -174.1 | 174.3 | -165.8 | 0 | 0 | 109.8 | G133 V137 | G133-E135 PolarHBondContact O-N 3.17Å; E135-V137 WeakPolarHBondContact O-CG2 3.42Å; E135-V137 PolarHBondContact O-N 3.06Å | ||
| 136 | V | 43.5 | Very low | 49.4 | Very low | 100 Ų | 100 | 114.4 Ų | 114.4 | 61% | 0.606 | 66% | 0.662 | S | S | * | * | trans | -63.6 | 99.9 | -178.6 | 171.3 | 0 | 0 | 0 | 0 | 110.5 | E134 E138 | E134-V136 PolarHBondContact O-N 3.36Å; V136-E138 HydrophobicContact CG1-CB 3.62Å; V136-E138 HydrophobicContact CG1-CG 3.6Å; V136-E138 VanDerWaalsContact CG1-OE2 3.24Å; V136-E138 WeakPolarHBondContact CG1-OE2 3.46Å; V136-E138 PolarHBondContact O-N 2.88Å | ||
| 137 | V | 44.2 | Very low | 51.9 | Low | 105 Ų | 105 | 115.3 Ų | 115.3 | 64% | 0.636 | 64% | 0.644 | S | S | * | * | G | 310 helix | trans | -78.1 | 28.9 | 176.4 | -156.7 | 0 | 0 | 0 | 0 | 112.2 | E135 G139 W140 | E135-V137 WeakPolarHBondContact O-CG2 3.42Å; E135-V137 PolarHBondContact O-N 3.06Å; V137-G139 PolarHBondContact O-N 3.4Å; V137-W140 HydrophobicContact CG1-CG 4.41Å |
| 138 | E | 43.1 | Very low | 54.3 | Low | 161 Ų | 161 | 110.6 Ų | 110.6 | 75% | 0.752 | 61% | 0.605 | S | S | * | * | G | 310 helix | trans | -81.1 | -2.2 | 175.1 | -63.2 | 179.3 | 140.8 | 0 | 0 | 112.6 | V136 W140 | V136-E138 HydrophobicContact CG1-CB 3.62Å; V136-E138 HydrophobicContact CG1-CG 3.6Å; V136-E138 VanDerWaalsContact CG1-OE2 3.24Å; V136-E138 WeakPolarHBondContact CG1-OE2 3.46Å; V136-E138 PolarHBondContact O-N 2.88Å; E138-W140 PolarHBondContact O-N 3.39Å |
| 139 | G | 46.9 | Very low | 57.1 | Low | 73 Ų | 73 | 105.5 Ų | 105.5 | 75% | 0.753 | 57% | 0.57 | S | S | * | * | G | 310 helix | trans | -75.8 | -0.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 116 | V137 | V137-G139 PolarHBondContact O-N 3.4Š|
| 140 | W | 54.2 | Low | 59.7 | Low | 215 Ų | 215 | 102.1 Ų | 102.1 | 81% | 0.814 | 54% | 0.544 | S | S | * | . | S | Bend | trans | -118.8 | -14.6 | -170.3 | -68.2 | 65.5 | 0 | 0 | 0 | 114.3 | V137 E138 | V137-W140 HydrophobicContact CG1-CG 4.41Å; E138-W140 PolarHBondContact O-N 3.39Å |
| 141 | A | 60.6 | Low | 62.1 | Low | 81 Ų | 81 | 94.2 Ų | 94.2 | 67% | 0.669 | 52% | 0.518 | S | S | * | . | S | Bend | trans | -87.9 | 121.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 142 | L | 62.7 | Low | 64.7 | Low | 37 Ų | 37 | 87 Ų | 87 | 19% | 0.194 | 49% | 0.485 | C | S | . | . | P | Polyproline II helix | trans | -56.6 | 143.2 | 162.4 | -85.5 | -178.8 | 0 | 0 | 0 | 109.6 | E146 H147 F177 | L142-E146 HydrophobicContact CB-CB 4.49Å; L142-E146 HydrophobicContact CD1-CB 4.43Å; L142-E146 HydrophobicContact CD2-CB 3.98Å; L142-H147 HydrophobicContact CB-CB 4.04Å; L142-H147 HydrophobicContact CD1-CB 4.01Å; L142-F177 HydrophobicContact CD1-CD1 3.94Å; L142-F177 HydrophobicContact CD1-CE1 3.51Å; L142-F177 HydrophobicContact CD1-CZ 4.37Å; L142-F177 HydrophobicContact CD2-CD1 3.48Å; L142-F177 VanDerWaalsContact CD2-CD1 3.48Å; L142-F177 HydrophobicContact CD2-CE1 3.77Å; L142-F177 HydrophobicContact CD2-CG 4.02Å; L142-F177 HydrophobicContact CD2-CZ 4.49Å; L142-F177 HydrophobicContact CG-CD1 3.74Å; L142-F177 HydrophobicContact CG-CE1 3.43Å; L142-F177 VanDerWaalsContact CG-CE1 3.43Å; L142-F177 HydrophobicContact CG-CZ 3.98Å |
| 143 | C | 72.5 | Confident | 66.7 | Low | 76 Ų | 76 | 78.3 Ų | 78.3 | 51% | 0.514 | 44% | 0.44 | S | S | . | . | P | Polyproline II helix | trans | -52 | 133.5 | 162.9 | -62.7 | 0 | 0 | 0 | 0 | 108.7 | M145 E146 H147 | C143-M145 PolarHBondContact O-N 2.95Å; C143-E146 HydrophobicContact CB-CG 4.3Å; C143-E146 PolarHBondContact O-N 3.29Å; C143-H147 PolarHBondContact O-N 3.48Å |
| 144 | P | 78.5 | Confident | 69.3 | Low | 80 Ų | 80 | 78.5 Ų | 78.5 | 52% | 0.519 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -53.5 | -33.1 | -171.2 | -31.3 | 36.2 | 0 | 0 | 0 | 114.6 | L108 A148 | L108-P144 HydrophobicContact CD1-CB 4.4Å; P144-A148 WeakPolarHBondContact O-CB 3.24Å; P144-A148 PolarHBondContact O-N 2.85Å |
| 145 | M | 79.5 | Confident | 71.4 | Confident | 39 Ų | 39 | 75.2 Ų | 75.2 | 19% | 0.192 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -60.2 | -48.1 | 172 | 174.4 | 50.6 | 73.5 | 0 | 0 | 113 | F109 C143 H147 A148 W149 F164 | F109-M145 HydrophobicContact CD2-CE 3.4Å; F109-M145 HydrophobicContact CE2-CE 3.43Å; F109-M145 VanDerWaalsContact CE2-CE 3.43Å; F109-M145 HydrophobicContact CG-CE 4.19Å; F109-M145 HydrophobicContact CZ-CE 4.24Å; C143-M145 PolarHBondContact O-N 2.95Å; M145-H147 VanDerWaalsContact C-N 3.3Å; M145-H147 PolarHBondContact O-N 3.23Å; M145-A148 WeakPolarHBondContact O-CB 3.38Å; M145-A148 PolarHBondContact O-N 3Å; M145-W149 WeakPolarHBondContact O-CB 3.48Å; M145-W149 PolarHBondContact O-N 3.04Å; M145-F164 HydrophobicContact CE-CD1 3.73Å; M145-F164 HydrophobicContact CE-CE1 3.71Å; M145-F164 HydrophobicContact SD-CD1 3.48Å; M145-F164 WeakPolarHBondContact SD-CD1 3.07Å; M145-F164 HydrophobicContact SD-CE1 3.6Å; M145-F164 VanDerWaalsContact SD-CE1 3.6Å; M145-F164 HydrophobicContact SD-CG 4.34Å |
| 146 | E | 80.9 | Confident | 73.5 | Confident | 45 Ų | 45 | 67.1 Ų | 67.1 | 21% | 0.21 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -65.7 | -36.1 | -179.1 | -66.1 | 177.1 | -144.6 | 0 | 0 | 111.9 | L142 C143 M150 R174 | L142-E146 HydrophobicContact CB-CB 4.49Å; L142-E146 HydrophobicContact CD1-CB 4.43Å; L142-E146 HydrophobicContact CD2-CB 3.98Å; C143-E146 HydrophobicContact CB-CG 4.3Å; C143-E146 PolarHBondContact O-N 3.29Å; E146-M150 WeakPolarHBondContact O-CB 3.46Å; E146-M150 VanDerWaalsContact O-CG 3.27Å; E146-M150 WeakPolarHBondContact O-CG 3.46Å; E146-M150 PolarHBondContact O-N 3.29Å; E146-R174 IonicContact OE1-CZ 3.71Å; E146-R174 IonicContact OE1-NH1 2.67Å; E146-R174 PolarHBondContact OE1-NH1 2.71Å; E146-R174 IonicContact OE1-NH2 3.01Å; E146-R174 IonicContact OE2-NH1 3.48Å; E146-R174 PolarHBondContact OE2-NH1 2.87Å |
| 147 | H | 83.4 | Confident | 75.8 | Confident | 102 Ų | 102 | 66.1 Ų | 66.1 | 47% | 0.472 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -66.3 | -43.5 | 173.5 | -168.6 | 70.7 | 0 | 0 | 0 | 111.5 | L142 C143 M145 L151 | L142-H147 HydrophobicContact CB-CB 4.04Å; L142-H147 HydrophobicContact CD1-CB 4.01Å; C143-H147 PolarHBondContact O-N 3.48Å; M145-H147 VanDerWaalsContact C-N 3.3Å; M145-H147 PolarHBondContact O-N 3.23Å; H147-L151 WeakPolarHBondContact O-CB 3.33Å; H147-L151 VanDerWaalsContact O-CG 3.29Å; H147-L151 WeakPolarHBondContact O-CG 3.34Å; H147-L151 PolarHBondContact O-N 3.25Å |
| 148 | A | 87.4 | Confident | 78 | Confident | 5 Ų | 5 | 63.3 Ų | 63.3 | 4% | 0.041 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -62.8 | -47.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | L105 P144 M145 L151 S152 F164 | L105-A148 HydrophobicContact CD1-CB 3.75Å; L105-A148 HydrophobicContact CD2-CB 3.97Å; L105-A148 HydrophobicContact CG-CB 4.36Å; P144-A148 WeakPolarHBondContact O-CB 3.24Å; P144-A148 PolarHBondContact O-N 2.85Å; M145-A148 WeakPolarHBondContact O-CB 3.38Å; M145-A148 PolarHBondContact O-N 3Å; A148-L151 PolarHBondContact O-N 3.34Å; A148-S152 PolarHBondContact O-N 2.84Å; A148-F164 HydrophobicContact CB-CE1 4.38Å; A148-F164 HydrophobicContact CB-CE2 4.31Å; A148-F164 HydrophobicContact CB-CZ 3.69Å |
| 149 | W | 88.3 | Confident | 80.3 | Confident | 1 Ų | 1 | 61.6 Ų | 61.6 | 0% | 0.004 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -56.7 | -54.2 | 175.4 | 167.3 | -111.1 | 0 | 0 | 0 | 111.5 | M145 L151 S152 V153 I161 F164 L165 L171 V183 | M145-W149 WeakPolarHBondContact O-CB 3.48Å; M145-W149 PolarHBondContact O-N 3.04Å; W149-L151 VanDerWaalsContact C-N 3.28Å; W149-L151 PolarHBondContact O-N 3.3Å; W149-S152 PolarHBondContact O-N 3.04Å; W149-S152 VanDerWaalsContact O-N 3.13Å; W149-S152 PolarHBondContact O-OG 3.07Å; W149-V153 HydrophobicContact CD2-CG2 4.16Å; W149-V153 HydrophobicContact CE3-CG2 4.4Å; W149-V153 HydrophobicContact CH2-CG2 4.33Å; W149-V153 HydrophobicContact CZ2-CG2 4.08Å; W149-V153 HydrophobicContact CZ3-CG2 4.49Å; W149-V153 WeakPolarHBondContact O-CG2 3.38Å; W149-V153 PolarHBondContact O-N 2.97Å; W149-I161 HydrophobicContact CH2-CG2 3.68Å; W149-I161 HydrophobicContact CZ3-CB 4.34Å; W149-I161 HydrophobicContact CZ3-CG2 3.63Å; W149-F164 HydrophobicContact CE3-CB 3.62Å; W149-F164 AromaticContact CE3-CD2 3.97Å; W149-F164 HydrophobicContact CE3-CD2 3.97Å; W149-F164 HydrophobicContact CE3-CG 4.14Å; W149-F164 HydrophobicContact CZ3-CB 3.92Å; W149-L165 HydrophobicContact CH2-CD1 4.16Å; W149-L165 HydrophobicContact CH2-CD2 3.67Å; W149-L165 HydrophobicContact CH2-CG 3.81Å; W149-L165 HydrophobicContact CZ2-CD2 4.46Å; W149-L165 HydrophobicContact CZ3-CD2 4.05Å; W149-L165 HydrophobicContact CZ3-CG 3.92Å; W149-L171 HydrophobicContact CD2-CB 4.03Å; W149-L171 HydrophobicContact CD2-CD1 4.01Å; W149-L171 HydrophobicContact CD2-CG 4.44Å; W149-L171 HydrophobicContact CE3-CB 4.36Å; W149-L171 HydrophobicContact CE3-CD1 3.96Å; W149-L171 HydrophobicContact CG-CD1 4.29Å; W149-L171 HydrophobicContact CG-CD2 4.26Å; W149-L171 HydrophobicContact CH2-CB 4.13Å; W149-L171 HydrophobicContact CZ2-CB 3.77Å; W149-L171 HydrophobicContact CZ3-CB 4.4Å; W149-L171 HydrophobicContact CZ3-CD1 4.45Å; W149-V183 HydrophobicContact CZ2-CB 3.89Å; W149-V183 HydrophobicContact CZ2-CG1 4.14Å; W149-V183 HydrophobicContact CZ2-CG2 4.22Å |
| 150 | M | 87.7 | Confident | 82.4 | Confident | 23 Ų | 23 | 58.9 Ų | 58.9 | 11% | 0.113 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -64.1 | -32.6 | -179.2 | -68.7 | -65.7 | 174.5 | 0 | 0 | 112.3 | E146 V154 D176 | E146-M150 WeakPolarHBondContact O-CB 3.46Å; E146-M150 VanDerWaalsContact O-CG 3.27Å; E146-M150 WeakPolarHBondContact O-CG 3.46Å; E146-M150 PolarHBondContact O-N 3.29Å; M150-V154 WeakPolarHBondContact O-CB 3.18Å; M150-V154 VanDerWaalsContact O-CG2 3.29Å; M150-V154 WeakPolarHBondContact O-CG2 3.41Å; M150-V154 PolarHBondContact O-N 2.79Å; M150-D176 HydrophobicContact CE-CB 3.9Å; M150-D176 HydrophobicContact SD-CB 4.16Å |
| 151 | L | 87.8 | Confident | 84.2 | Confident | 56 Ų | 56 | 48.8 Ų | 48.8 | 29% | 0.293 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -65.6 | -47.7 | 170.6 | -75.4 | 175.8 | 0 | 0 | 0 | 112.4 | H147 A148 W149 V153 V154 D155 | H147-L151 WeakPolarHBondContact O-CB 3.33Å; H147-L151 VanDerWaalsContact O-CG 3.29Å; H147-L151 WeakPolarHBondContact O-CG 3.34Å; H147-L151 PolarHBondContact O-N 3.25Å; A148-L151 PolarHBondContact O-N 3.34Å; W149-L151 VanDerWaalsContact C-N 3.28Å; W149-L151 PolarHBondContact O-N 3.3Å; L151-V153 VanDerWaalsContact C-N 3.25Å; L151-V153 PolarHBondContact O-N 3.37Å; L151-V154 PolarHBondContact O-N 3.11Å; L151-V154 VanDerWaalsContact O-N 3.14Å; L151-D155 WeakPolarHBondContact O-CB 3.49Å; L151-D155 PolarHBondContact O-N 3.08Å |
| 152 | S | 89.6 | Confident | 85.6 | Confident | 9 Ų | 9 | 46.2 Ų | 46.2 | 6% | 0.063 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -61.7 | -33.7 | 178.6 | 62.9 | 0 | 0 | 0 | 0 | 113.4 | A148 W149 G156 N157 | A148-S152 PolarHBondContact O-N 2.84Å; W149-S152 PolarHBondContact O-N 3.04Å; W149-S152 VanDerWaalsContact O-N 3.13Å; W149-S152 PolarHBondContact O-OG 3.07Å; S152-G156 PolarHBondContact O-N 3.32Å; S152-N157 PolarHBondContact O-N 3.08Å |
| 153 | V | 90 | Very high | 87 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -70 | -38.7 | 175 | 165.5 | 0 | 0 | 0 | 0 | 111.9 | W149 L151 I161 V183 W186 L187 | W149-V153 HydrophobicContact CD2-CG2 4.16Å; W149-V153 HydrophobicContact CE3-CG2 4.4Å; W149-V153 HydrophobicContact CH2-CG2 4.33Å; W149-V153 HydrophobicContact CZ2-CG2 4.08Å; W149-V153 HydrophobicContact CZ3-CG2 4.49Å; W149-V153 WeakPolarHBondContact O-CG2 3.38Å; W149-V153 PolarHBondContact O-N 2.97Å; L151-V153 VanDerWaalsContact C-N 3.25Å; L151-V153 PolarHBondContact O-N 3.37Å; V153-I161 HydrophobicContact CG2-CD1 4.19Å; V153-I161 HydrophobicContact CG2-CG1 4.13Å; V153-V183 HydrophobicContact CB-CG2 4.39Å; V153-V183 HydrophobicContact CG1-CB 4.3Å; V153-V183 HydrophobicContact CG1-CG2 3.82Å; V153-V183 HydrophobicContact CG2-CB 4.2Å; V153-V183 HydrophobicContact CG2-CG2 3.63Å; V153-W186 HydrophobicContact CG1-CB 3.51Å; V153-W186 HydrophobicContact CG1-CG 4.21Å; V153-L187 HydrophobicContact CG1-CD2 4.48Å |
| 154 | V | 88.2 | Confident | 87.8 | Confident | 69 Ų | 69 | 45.6 Ų | 45.6 | 42% | 0.418 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -71.9 | -43.2 | 176 | 167.7 | 0 | 0 | 0 | 0 | 111.5 | M150 L151 G156 W186 Q192 | M150-V154 WeakPolarHBondContact O-CB 3.18Å; M150-V154 VanDerWaalsContact O-CG2 3.29Å; M150-V154 WeakPolarHBondContact O-CG2 3.41Å; M150-V154 PolarHBondContact O-N 2.79Å; L151-V154 PolarHBondContact O-N 3.11Å; L151-V154 VanDerWaalsContact O-N 3.14Å; V154-G156 PolarHBondContact O-N 3.2Å; V154-W186 HydrophobicContact CG2-CD2 4.17Å; V154-W186 HydrophobicContact CG2-CE3 3.78Å; V154-W186 HydrophobicContact CG2-CZ3 4.06Å; V154-Q192 PolarHBondContact O-NE2 3.22Å |
| 155 | D | 88.3 | Confident | 88.3 | Confident | 119 Ų | 119 | 42.1 Ų | 42.1 | 64% | 0.636 | 22% | 0.219 | S | C | * | . | H | α-helix | trans | -65.6 | -25.8 | 174.8 | -75.7 | -11.5 | 0 | 0 | 0 | 112 | L151 | L151-D155 WeakPolarHBondContact O-CB 3.49Å; L151-D155 PolarHBondContact O-N 3.08Å |
| 156 | G | 87.3 | Confident | 88.7 | Confident | 14 Ų | 14 | 45 Ų | 45 | 14% | 0.144 | 24% | 0.242 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 79.5 | 24.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | S152 V154 Y158 Q192 T195 | S152-G156 PolarHBondContact O-N 3.32Å; V154-G156 PolarHBondContact O-N 3.2Å; G156-Y158 PolarHBondContact O-N 2.98Å; G156-Q192 VanDerWaalsContact CA-CD 3.44Å; G156-Q192 VanDerWaalsContact CA-NE2 3.32Å; G156-T195 WeakPolarHBondContact O-CG2 3.49Å |
| 157 | N | 90.1 | Very high | 89.1 | Confident | 78 Ų | 78 | 47 Ų | 47 | 42% | 0.417 | 25% | 0.252 | S | S | . | . | trans | -87.8 | 91.8 | -177.2 | -179.7 | -0.4 | 0 | 0 | 0 | 110.5 | S152 E159 T160 I161 | S152-N157 PolarHBondContact O-N 3.08Å; N157-E159 VanDerWaalsContact C-N 3.27Å; N157-E159 PolarHBondContact O-N 3.46Å; N157-E159 PolarHBondContact OD1-N 3.35Å; N157-T160 VanDerWaalsContact CB-OG1 3.23Å; N157-T160 WeakPolarHBondContact CB-OG1 3.37Å; N157-T160 PolarHBondContact ND2-OG1 3.33Å; N157-T160 PolarHBondContact O-N 2.81Å; N157-T160 PolarHBondContact O-OG1 2.88Å; N157-I161 WeakPolarHBondContact O-CG1 3.42Å; N157-I161 PolarHBondContact O-N 3.15Å; N157-I161 VanDerWaalsContact O-N 3.08Å | ||
| 158 | Y | 91.3 | Very high | 89.2 | Confident | 46 Ų | 46 | 45.4 Ų | 45.4 | 18% | 0.18 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -47 | -45.4 | -178.4 | 170.7 | -102.4 | 0 | 0 | 0 | 113.5 | G156 T160 I161 V162 Q198 | G156-Y158 PolarHBondContact O-N 2.98Å; Y158-T160 VanDerWaalsContact C-N 3.32Å; Y158-T160 PolarHBondContact O-N 2.86Å; Y158-I161 WeakPolarHBondContact O-CB 3.43Å; Y158-I161 PolarHBondContact O-N 3.2Å; Y158-V162 HydrophobicContact CD1-CG2 4.45Å; Y158-V162 HydrophobicContact CD2-CG2 4.07Å; Y158-V162 HydrophobicContact CE1-CG2 3.92Å; Y158-V162 HydrophobicContact CE2-CG2 3.47Å; Y158-V162 VanDerWaalsContact CE2-CG2 3.47Å; Y158-V162 PolarHBondContact O-N 2.9Å; Y158-Q198 HydrophobicContact CD2-CB 3.6Å; Y158-Q198 HydrophobicContact CE1-CB 4.4Å; Y158-Q198 HydrophobicContact CE2-CB 3.38Å; Y158-Q198 HydrophobicContact CG-CB 4.21Å |
| 159 | E | 91.2 | Very high | 89.2 | Confident | 125 Ų | 125 | 48.1 Ų | 48.1 | 58% | 0.584 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -56.7 | -45.7 | 179.5 | -53.7 | -60.8 | 145.1 | 0 | 0 | 111.4 | N157 I161 V162 D163 | N157-E159 VanDerWaalsContact C-N 3.27Å; N157-E159 PolarHBondContact O-N 3.46Å; N157-E159 PolarHBondContact OD1-N 3.35Å; E159-I161 VanDerWaalsContact C-N 3.34Å; E159-I161 PolarHBondContact O-N 3.33Å; E159-V162 PolarHBondContact O-N 3.48Å; E159-D163 PolarHBondContact O-N 3.03Å |
| 160 | T | 91.4 | Very high | 89.1 | Confident | 17 Ų | 17 | 50.5 Ų | 50.5 | 10% | 0.104 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -73 | -23.7 | 176.8 | 45.3 | 0 | 0 | 0 | 0 | 114 | K102 N157 Y158 F164 | K102-T160 HydrophobicContact CD-CG2 4.3Å; N157-T160 VanDerWaalsContact CB-OG1 3.23Å; N157-T160 WeakPolarHBondContact CB-OG1 3.37Å; N157-T160 PolarHBondContact ND2-OG1 3.33Å; N157-T160 PolarHBondContact O-N 2.81Å; N157-T160 PolarHBondContact O-OG1 2.88Å; Y158-T160 VanDerWaalsContact C-N 3.32Å; Y158-T160 PolarHBondContact O-N 2.86Å; T160-F164 WeakPolarHBondContact O-CD2 3.2Å; T160-F164 PolarHBondContact O-N 3.37Å |
| 161 | I | 91.1 | Very high | 89.1 | Confident | 2 Ų | 2 | 49.4 Ų | 49.4 | 1% | 0.01 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -72.6 | -39.6 | 173.1 | -62.7 | 167.8 | 0 | 0 | 0 | 108.9 | W149 V153 N157 Y158 E159 L165 L199 | W149-I161 HydrophobicContact CH2-CG2 3.68Å; W149-I161 HydrophobicContact CZ3-CB 4.34Å; W149-I161 HydrophobicContact CZ3-CG2 3.63Å; V153-I161 HydrophobicContact CG2-CD1 4.19Å; V153-I161 HydrophobicContact CG2-CG1 4.13Å; N157-I161 WeakPolarHBondContact O-CG1 3.42Å; N157-I161 PolarHBondContact O-N 3.15Å; N157-I161 VanDerWaalsContact O-N 3.08Å; Y158-I161 WeakPolarHBondContact O-CB 3.43Å; Y158-I161 PolarHBondContact O-N 3.2Å; E159-I161 VanDerWaalsContact C-N 3.34Å; E159-I161 PolarHBondContact O-N 3.33Å; I161-L165 HydrophobicContact CG2-CD1 4.38Å; I161-L165 WeakPolarHBondContact O-CG 3.29Å; I161-L165 PolarHBondContact O-N 3.48Å; I161-L165 VanDerWaalsContact O-N 3.12Å; I161-L199 HydrophobicContact CG2-CD1 3.54Å; I161-L199 HydrophobicContact CG2-CD2 4.4Å |
| 162 | V | 90.8 | Very high | 89.1 | Confident | 28 Ų | 28 | 47 Ų | 47 | 17% | 0.17 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -68.8 | -41.7 | 173.6 | 171.9 | 0 | 0 | 0 | 0 | 112.2 | Y158 E159 F164 L165 S166 H202 | Y158-V162 HydrophobicContact CD1-CG2 4.45Å; Y158-V162 HydrophobicContact CD2-CG2 4.07Å; Y158-V162 HydrophobicContact CE1-CG2 3.92Å; Y158-V162 HydrophobicContact CE2-CG2 3.47Å; Y158-V162 VanDerWaalsContact CE2-CG2 3.47Å; Y158-V162 PolarHBondContact O-N 2.9Å; E159-V162 PolarHBondContact O-N 3.48Å; V162-F164 VanDerWaalsContact C-N 3.31Å; V162-F164 PolarHBondContact O-N 3.28Å; V162-L165 PolarHBondContact O-N 3.46Å; V162-L165 VanDerWaalsContact O-N 3.07Å; V162-S166 PolarHBondContact O-N 3.34Å; V162-H202 WeakPolarHBondContact CG1-NE2 3.47Å |
| 163 | D | 91 | Very high | 89 | Confident | 68 Ų | 68 | 50.4 Ų | 50.4 | 36% | 0.364 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -45.3 | -57.9 | 171.5 | -77.4 | -25.4 | 0 | 0 | 0 | 109.3 | K102 E159 L165 S166 E167 | K102-D163 IonicContact NZ-OD2 2.74Å; K102-D163 PolarHBondContact NZ-OD2 3Å; E159-D163 PolarHBondContact O-N 3.03Å; D163-L165 PolarHBondContact O-N 3.41Å; D163-S166 PolarHBondContact O-N 3.03Å; D163-S166 PolarHBondContact O-OG 2.79Å; D163-E167 PolarHBondContact O-N 3.14Å |
| 164 | F | 90.3 | Very high | 88.9 | Confident | 31 Ų | 31 | 54 Ų | 54 | 14% | 0.136 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -66.4 | -28.4 | -179.4 | -70.8 | -51.7 | 0 | 0 | 0 | 114.9 | M145 A148 W149 T160 V162 E167 D168 L171 | M145-F164 HydrophobicContact CE-CD1 3.73Å; M145-F164 HydrophobicContact CE-CE1 3.71Å; M145-F164 HydrophobicContact SD-CD1 3.48Å; M145-F164 WeakPolarHBondContact SD-CD1 3.07Å; M145-F164 HydrophobicContact SD-CE1 3.6Å; M145-F164 VanDerWaalsContact SD-CE1 3.6Å; M145-F164 HydrophobicContact SD-CG 4.34Å; A148-F164 HydrophobicContact CB-CE1 4.38Å; A148-F164 HydrophobicContact CB-CE2 4.31Å; A148-F164 HydrophobicContact CB-CZ 3.69Å; W149-F164 HydrophobicContact CE3-CB 3.62Å; W149-F164 AromaticContact CE3-CD2 3.97Å; W149-F164 HydrophobicContact CE3-CD2 3.97Å; W149-F164 HydrophobicContact CE3-CG 4.14Å; W149-F164 HydrophobicContact CZ3-CB 3.92Å; T160-F164 WeakPolarHBondContact O-CD2 3.2Å; T160-F164 PolarHBondContact O-N 3.37Å; V162-F164 VanDerWaalsContact C-N 3.31Å; V162-F164 PolarHBondContact O-N 3.28Å; F164-E167 WeakPolarHBondContact CD1-OE2 3.38Å; F164-E167 PolarHBondContact O-N 2.9Å; F164-D168 PolarHBondContact O-N 3.44Å; F164-L171 HydrophobicContact CB-CD1 4.07Å |
| 165 | L | 89.1 | Confident | 88.9 | Confident | 8 Ų | 8 | 55.5 Ų | 55.5 | 4% | 0.042 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -79.2 | -24.3 | 176.9 | -71.7 | 179.5 | 0 | 0 | 0 | 113.7 | W149 I161 V162 D163 E167 S169 L171 L172 L199 | W149-L165 HydrophobicContact CH2-CD1 4.16Å; W149-L165 HydrophobicContact CH2-CD2 3.67Å; W149-L165 HydrophobicContact CH2-CG 3.81Å; W149-L165 HydrophobicContact CZ2-CD2 4.46Å; W149-L165 HydrophobicContact CZ3-CD2 4.05Å; W149-L165 HydrophobicContact CZ3-CG 3.92Å; I161-L165 HydrophobicContact CG2-CD1 4.38Å; I161-L165 WeakPolarHBondContact O-CG 3.29Å; I161-L165 PolarHBondContact O-N 3.48Å; I161-L165 VanDerWaalsContact O-N 3.12Å; V162-L165 PolarHBondContact O-N 3.46Å; V162-L165 VanDerWaalsContact O-N 3.07Å; D163-L165 PolarHBondContact O-N 3.41Å; L165-E167 VanDerWaalsContact C-N 3.26Å; L165-S169 PolarHBondContact O-N 3.22Å; L165-L171 HydrophobicContact CD2-CB 3.99Å; L165-L172 HydrophobicContact CD1-CD1 4.25Å; L165-L172 HydrophobicContact CD1-CD2 3.58Å; L165-L172 HydrophobicContact CD1-CG 3.9Å; L165-L172 HydrophobicContact CD2-CD2 4.03Å; L165-L172 HydrophobicContact CD2-CG 3.69Å; L165-L172 HydrophobicContact CG-CD2 4.45Å; L165-L172 HydrophobicContact CG-CG 4.48Å; L165-L199 HydrophobicContact CD1-CD1 3.47Å; L165-L199 VanDerWaalsContact CD1-CD1 3.47Å |
| 166 | S | 88.6 | Confident | 88.9 | Confident | 98 Ų | 98 | 50.5 Ų | 50.5 | 69% | 0.685 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -70 | -27.3 | 168.6 | 79 | 0 | 0 | 0 | 0 | 112 | V162 D163 | V162-S166 PolarHBondContact O-N 3.34Å; D163-S166 PolarHBondContact O-N 3.03Å; D163-S166 PolarHBondContact O-OG 2.79Å |
| 167 | E | 88.3 | Confident | 88.7 | Confident | 89 Ų | 89 | 56 Ų | 56 | 42% | 0.416 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -80.9 | -47.6 | 173.7 | -66 | 172.9 | 167.3 | 0 | 0 | 111.2 | F109 D163 F164 L165 | F109-E167 HydrophobicContact CE1-CB 4.43Å; F109-E167 HydrophobicContact CE1-CG 3.84Å; F109-E167 WeakPolarHBondContact CE1-OE1 3.49Å; F109-E167 HydrophobicContact CZ-CB 4.01Å; F109-E167 HydrophobicContact CZ-CG 3.94Å; D163-E167 PolarHBondContact O-N 3.14Å; F164-E167 WeakPolarHBondContact CD1-OE2 3.38Å; F164-E167 PolarHBondContact O-N 2.9Å; L165-E167 VanDerWaalsContact C-N 3.26Å |
| 168 | D | 86.7 | Confident | 88.4 | Confident | 67 Ų | 67 | 57.5 Ų | 57.5 | 36% | 0.358 | 31% | 0.305 | S | S | . | . | trans | -148 | 81.7 | -169.1 | -147.5 | -18.7 | 0 | 0 | 0 | 112.2 | F164 S170 L171 | F164-D168 PolarHBondContact O-N 3.44Å; D168-S170 PolarHBondContact O-N 3.34Å; D168-S170 PolarHBondContact OD1-OG 3.17Å; D168-L171 HydrophobicContact CB-CD1 3.92Å; D168-L171 HydrophobicContact CB-CG 4.07Å; D168-L171 WeakPolarHBondContact O-CB 3.36Å; D168-L171 VanDerWaalsContact O-CG 3.24Å; D168-L171 WeakPolarHBondContact O-CG 3.24Å; D168-L171 PolarHBondContact O-N 2.84Å | ||
| 169 | S | 87.2 | Confident | 88.1 | Confident | 63 Ų | 63 | 56.5 Ų | 56.5 | 44% | 0.441 | 30% | 0.304 | S | S | . | . | G | 310 helix | trans | -58 | -18 | -178.3 | 63.1 | 0 | 0 | 0 | 0 | 114.6 | L165 L171 | L165-S169 PolarHBondContact O-N 3.22Å; S169-L171 PolarHBondContact O-N 2.88Å |
| 170 | S | 86.3 | Confident | 88 | Confident | 50 Ų | 50 | 51.4 Ų | 51.4 | 35% | 0.35 | 29% | 0.285 | S | S | . | . | G | 310 helix | trans | -59.2 | -27 | 174.4 | 74.2 | 0 | 0 | 0 | 0 | 113.3 | D168 L172 T173 | D168-S170 PolarHBondContact O-N 3.34Å; D168-S170 PolarHBondContact OD1-OG 3.17Å; S170-L172 VanDerWaalsContact C-N 3.26Å; S170-L172 PolarHBondContact O-N 3.19Å; S170-T173 PolarHBondContact O-N 3.26Å; S170-T173 PolarHBondContact O-OG1 3.38Å |
| 171 | L | 87.5 | Confident | 88 | Confident | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 29% | 0.285 | C | S | . | . | G | 310 helix | trans | -60.6 | -26.9 | -173 | -69.1 | 171.7 | 0 | 0 | 0 | 114.3 | W149 F164 L165 D168 S169 T173 R174 | W149-L171 HydrophobicContact CD2-CB 4.03Å; W149-L171 HydrophobicContact CD2-CD1 4.01Å; W149-L171 HydrophobicContact CD2-CG 4.44Å; W149-L171 HydrophobicContact CE3-CB 4.36Å; W149-L171 HydrophobicContact CE3-CD1 3.96Å; W149-L171 HydrophobicContact CG-CD1 4.29Å; W149-L171 HydrophobicContact CG-CD2 4.26Å; W149-L171 HydrophobicContact CH2-CB 4.13Å; W149-L171 HydrophobicContact CZ2-CB 3.77Å; W149-L171 HydrophobicContact CZ3-CB 4.4Å; W149-L171 HydrophobicContact CZ3-CD1 4.45Å; F164-L171 HydrophobicContact CB-CD1 4.07Å; L165-L171 HydrophobicContact CD2-CB 3.99Å; D168-L171 HydrophobicContact CB-CD1 3.92Å; D168-L171 HydrophobicContact CB-CG 4.07Å; D168-L171 WeakPolarHBondContact O-CB 3.36Å; D168-L171 VanDerWaalsContact O-CG 3.24Å; D168-L171 WeakPolarHBondContact O-CG 3.24Å; D168-L171 PolarHBondContact O-N 2.84Å; S169-L171 PolarHBondContact O-N 2.88Å; L171-T173 PolarHBondContact O-N 3.12Å; L171-R174 WeakPolarHBondContact O-CB 3.45Å; L171-R174 PolarHBondContact O-N 3.07Å |
| 172 | L | 86.8 | Confident | 88.1 | Confident | 5 Ų | 5 | 51.6 Ų | 51.6 | 3% | 0.026 | 28% | 0.284 | C | S | . | . | G | 310 helix | trans | -58.3 | -33.4 | 174.4 | -71.7 | -179.2 | 0 | 0 | 0 | 113.2 | L165 S170 V183 L199 A203 I208 V210 | L165-L172 HydrophobicContact CD1-CD1 4.25Å; L165-L172 HydrophobicContact CD1-CD2 3.58Å; L165-L172 HydrophobicContact CD1-CG 3.9Å; L165-L172 HydrophobicContact CD2-CD2 4.03Å; L165-L172 HydrophobicContact CD2-CG 3.69Å; L165-L172 HydrophobicContact CG-CD2 4.45Å; L165-L172 HydrophobicContact CG-CG 4.48Å; S170-L172 VanDerWaalsContact C-N 3.26Å; S170-L172 PolarHBondContact O-N 3.19Å; L172-V183 HydrophobicContact CD2-CG1 3.81Å; L172-L199 HydrophobicContact CD2-CD1 3.95Å; L172-L199 HydrophobicContact CD2-CD2 4.06Å; L172-L199 HydrophobicContact CD2-CG 4.07Å; L172-A203 HydrophobicContact CD1-CB 3.66Å; L172-I208 HydrophobicContact CD1-CG2 3.92Å; L172-V210 HydrophobicContact CD1-CG2 3.57Å |
| 173 | T | 87.8 | Confident | 88.2 | Confident | 81 Ų | 81 | 50.2 Ų | 50.2 | 50% | 0.497 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.7 | -12.8 | -178.9 | 67.4 | 0 | 0 | 0 | 0 | 113.2 | S170 L171 | S170-T173 PolarHBondContact O-N 3.26Å; S170-T173 PolarHBondContact O-OG1 3.38Å; L171-T173 PolarHBondContact O-N 3.12Å |
| 174 | R | 87.5 | Confident | 88.3 | Confident | 76 Ų | 76 | 47 Ų | 47 | 29% | 0.287 | 26% | 0.259 | S | S | . | . | trans | -63 | 142.2 | -179.1 | -152.7 | 85.4 | 93.4 | 89.4 | 1.6 | 110.5 | E146 L171 T182 | E146-R174 IonicContact OE1-CZ 3.71Å; E146-R174 IonicContact OE1-NH1 2.67Å; E146-R174 PolarHBondContact OE1-NH1 2.71Å; E146-R174 IonicContact OE1-NH2 3.01Å; E146-R174 IonicContact OE2-NH1 3.48Å; E146-R174 PolarHBondContact OE2-NH1 2.87Å; L171-R174 WeakPolarHBondContact O-CB 3.45Å; L171-R174 PolarHBondContact O-N 3.07Å; R174-T182 WeakPolarHBondContact O-CA 3.41Å; R174-T182 WeakPolarHBondContact O-CG2 3.08Å | ||
| 175 | K | 88.6 | Confident | 88.5 | Confident | 100 Ų | 100 | 45.6 Ų | 45.6 | 44% | 0.435 | 25% | 0.253 | S | S | . | . | trans | -107.3 | 136.5 | 175.7 | -65.1 | -178.1 | -172.1 | -169.2 | 0 | 109.9 | G180 T182 K215 | K175-G180 WeakPolarHBondContact CD-O 3.49Å; K175-G180 WeakPolarHBondContact CG-O 3.38Å; K175-T182 HydrophobicContact CG-CG2 3.85Å; K175-K215 WeakPolarHBondContact CE-O 3.36Å; K175-K215 PolarHBondContact NZ-O 3.02Å | ||
| 176 | D | 87.6 | Confident | 88.8 | Confident | 14 Ų | 14 | 47.3 Ų | 47.3 | 8% | 0.075 | 26% | 0.259 | C | S | . | . | trans | -56.5 | 133.9 | 165.1 | 163.9 | 36.7 | 0 | 0 | 0 | 110.8 | M150 V178 S179 G180 F181 | M150-D176 HydrophobicContact CE-CB 3.9Å; M150-D176 HydrophobicContact SD-CB 4.16Å; D176-V178 VanDerWaalsContact C-N 3.34Å; D176-V178 PolarHBondContact O-N 2.69Å; D176-V178 PolarHBondContact OD1-N 2.79Å; D176-S179 WeakPolarHBondContact OD2-CA 3.41Å; D176-S179 WeakPolarHBondContact OD2-CB 3.42Å; D176-S179 PolarHBondContact OD2-N 2.95Å; D176-S179 PolarHBondContact OD2-OG 3.02Å; D176-G180 WeakPolarHBondContact O-CA 3.1Å; D176-G180 PolarHBondContact O-N 2.76Å; D176-F181 WeakPolarHBondContact CB-O 2.97Å; D176-F181 PolarHBondContact N-O 3.33Å | ||
| 177 | F | 83.5 | Confident | 89 | Confident | 131 Ų | 131 | 42.7 Ų | 42.7 | 58% | 0.575 | 23% | 0.226 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -30.6 | 177 | 77.3 | -61.2 | 0 | 0 | 0 | 113.8 | L142 | L142-F177 HydrophobicContact CD1-CD1 3.94Å; L142-F177 HydrophobicContact CD1-CE1 3.51Å; L142-F177 HydrophobicContact CD1-CZ 4.37Å; L142-F177 HydrophobicContact CD2-CD1 3.48Å; L142-F177 VanDerWaalsContact CD2-CD1 3.48Å; L142-F177 HydrophobicContact CD2-CE1 3.77Å; L142-F177 HydrophobicContact CD2-CG 4.02Å; L142-F177 HydrophobicContact CD2-CZ 4.49Å; L142-F177 HydrophobicContact CG-CD1 3.74Å; L142-F177 HydrophobicContact CG-CE1 3.43Å; L142-F177 VanDerWaalsContact CG-CE1 3.43Å; L142-F177 HydrophobicContact CG-CZ 3.98Å |
| 178 | V | 83.8 | Confident | 89.4 | Confident | 109 Ų | 109 | 38.4 Ų | 38.4 | 66% | 0.661 | 21% | 0.206 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -78.7 | -50.3 | -179.2 | -169.5 | 0 | 0 | 0 | 0 | 111.5 | D176 | D176-V178 VanDerWaalsContact C-N 3.34Å; D176-V178 PolarHBondContact O-N 2.69Å; D176-V178 PolarHBondContact OD1-N 2.79Å |
| 179 | S | 85.1 | Confident | 89.7 | Confident | 25 Ų | 25 | 38.2 Ų | 38.2 | 18% | 0.175 | 20% | 0.202 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -105.2 | -6.3 | -169.3 | -36.6 | 0 | 0 | 0 | 0 | 113.3 | D176 F181 S217 | D176-S179 WeakPolarHBondContact OD2-CA 3.41Å; D176-S179 WeakPolarHBondContact OD2-CB 3.42Å; D176-S179 PolarHBondContact OD2-N 2.95Å; D176-S179 PolarHBondContact OD2-OG 3.02Å; S179-F181 WeakPolarHBondContact O-CD1 3.49Å; S179-F181 WeakPolarHBondContact O-CE1 3.05Å; S179-F181 PolarHBondContact O-N 3.02Å; S179-S217 WeakPolarHBondContact O-CB 3.34Å; S179-S217 PolarHBondContact O-N 3.21Å |
| 180 | G | 89.3 | Confident | 90 | Very high | 18 Ų | 18 | 37.1 Ų | 37.1 | 19% | 0.186 | 20% | 0.195 | C | C | . | . | trans | 62.6 | 14.8 | -168.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | K175 D176 G216 | K175-G180 WeakPolarHBondContact CD-O 3.49Å; K175-G180 WeakPolarHBondContact CG-O 3.38Å; D176-G180 WeakPolarHBondContact O-CA 3.1Å; D176-G180 PolarHBondContact O-N 2.76Å; G180-G216 WeakPolarHBondContact O-CA 3.42Å | ||
| 181 | F | 92.2 | Very high | 90.3 | Very high | 22 Ų | 22 | 35.7 Ų | 35.7 | 10% | 0.096 | 19% | 0.188 | C | C | . | . | trans | -93.5 | 135 | -166.5 | -80.3 | 1.9 | 0 | 0 | 0 | 112.6 | D176 S179 H185 K189 L220 V225 | D176-F181 WeakPolarHBondContact CB-O 2.97Å; D176-F181 PolarHBondContact N-O 3.33Å; S179-F181 WeakPolarHBondContact O-CD1 3.49Å; S179-F181 WeakPolarHBondContact O-CE1 3.05Å; S179-F181 PolarHBondContact O-N 3.02Å; F181-H185 HydrophobicContact CB-CB 3.72Å; F181-H185 HydrophobicContact CD1-CB 4.14Å; F181-H185 AromaticContact CD1-CD2 3.88Å; F181-H185 HydrophobicContact CD2-CB 3.95Å; F181-H185 HydrophobicContact CG-CB 3.68Å; F181-K189 HydrophobicContact CE2-CD 4.4Å; F181-L220 HydrophobicContact CE1-CD1 4.45Å; F181-L220 HydrophobicContact CZ-CD1 4.42Å; F181-V225 HydrophobicContact CE1-CG2 4.31Å; F181-V225 HydrophobicContact CE2-CG1 4.48Å; F181-V225 HydrophobicContact CE2-CG2 4.24Å; F181-V225 HydrophobicContact CZ-CG2 3.84Å | ||
| 182 | T | 92.3 | Very high | 90.6 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 20% | 0.196 | C | C | . | . | trans | -83.1 | 170.3 | 170.1 | 71.2 | 0 | 0 | 0 | 0 | 111.2 | R174 K175 L184 H185 W186 L214 | R174-T182 WeakPolarHBondContact O-CA 3.41Å; R174-T182 WeakPolarHBondContact O-CG2 3.08Å; K175-T182 HydrophobicContact CG-CG2 3.85Å; T182-L184 PolarHBondContact O-N 2.84Å; T182-H185 PolarHBondContact N-ND1 3.01Å; T182-H185 WeakPolarHBondContact O-CB 3.39Å; T182-H185 PolarHBondContact O-N 3.39Å; T182-H185 PolarHBondContact OG1-ND1 2.97Å; T182-W186 PolarHBondContact O-N 3.13Å; T182-L214 HydrophobicContact CG2-CD1 4.28Å | ||
| 183 | V | 92.9 | Very high | 91 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -47 | -45.1 | 174.9 | 54.7 | 0 | 0 | 0 | 0 | 113 | W149 V153 L172 H185 W186 L187 L199 | W149-V183 HydrophobicContact CZ2-CB 3.89Å; W149-V183 HydrophobicContact CZ2-CG1 4.14Å; W149-V183 HydrophobicContact CZ2-CG2 4.22Å; V153-V183 HydrophobicContact CB-CG2 4.39Å; V153-V183 HydrophobicContact CG1-CB 4.3Å; V153-V183 HydrophobicContact CG1-CG2 3.82Å; V153-V183 HydrophobicContact CG2-CB 4.2Å; V153-V183 HydrophobicContact CG2-CG2 3.63Å; L172-V183 HydrophobicContact CD2-CG1 3.81Å; V183-H185 VanDerWaalsContact C-N 3.26Å; V183-H185 PolarHBondContact O-N 3.18Å; V183-W186 PolarHBondContact O-N 3.31Å; V183-L187 HydrophobicContact CG2-CD1 4.05Å; V183-L187 HydrophobicContact CG2-CG 4.18Å; V183-L187 WeakPolarHBondContact O-CG 3.35Å; V183-L187 PolarHBondContact O-N 3.49Å; V183-L199 HydrophobicContact CG1-CD2 4.21Å; V183-L199 HydrophobicContact CG2-CD2 3.51Å |
| 184 | L | 93.9 | Very high | 91.3 | Very high | 1 Ų | 1 | 41 Ų | 41 | 1% | 0.005 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.8 | -31.5 | -180 | -53.7 | -177.3 | 0 | 0 | 0 | 113.2 | T182 A188 L196 L199 L200 V210 V212 P222 | T182-L184 PolarHBondContact O-N 2.84Å; L184-A188 WeakPolarHBondContact O-CB 3.44Å; L184-A188 PolarHBondContact O-N 3.33Å; L184-L196 HydrophobicContact CD2-CD1 3.68Å; L184-L199 HydrophobicContact CD2-CD2 4.41Å; L184-L200 HydrophobicContact CD1-CD2 4.37Å; L184-L200 HydrophobicContact CD2-CD2 3.88Å; L184-L200 HydrophobicContact CD2-CG 4.24Å; L184-V210 HydrophobicContact CD1-CG1 3.83Å; L184-V212 HydrophobicContact CD1-CG1 4.28Å; L184-P222 HydrophobicContact CB-CB 4.22Å; L184-P222 HydrophobicContact CB-CG 3.71Å |
| 185 | H | 94.8 | Very high | 91.6 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -72.4 | -37.4 | 175.5 | -64 | 76.2 | 0 | 0 | 0 | 111.4 | F181 T182 V183 A188 K189 L214 G216 L220 | F181-H185 HydrophobicContact CB-CB 3.72Å; F181-H185 HydrophobicContact CD1-CB 4.14Å; F181-H185 AromaticContact CD1-CD2 3.88Å; F181-H185 HydrophobicContact CD2-CB 3.95Å; F181-H185 HydrophobicContact CG-CB 3.68Å; T182-H185 PolarHBondContact N-ND1 3.01Å; T182-H185 WeakPolarHBondContact O-CB 3.39Å; T182-H185 PolarHBondContact O-N 3.39Å; T182-H185 PolarHBondContact OG1-ND1 2.97Å; V183-H185 VanDerWaalsContact C-N 3.26Å; V183-H185 PolarHBondContact O-N 3.18Å; H185-A188 PolarHBondContact O-N 2.98Å; H185-K189 VanDerWaalsContact O-CB 3.32Å; H185-K189 WeakPolarHBondContact O-CB 3.33Å; H185-K189 PolarHBondContact O-N 3.31Å; H185-L214 PolarHBondContact CE1-O 2.87Å; H185-L214 PolarHBondContact NE2-O 2.88Å; H185-G216 PolarHBondContact NE2-N 3.49Å; H185-L220 PolarHBondContact NE2-O 3.05Å; H185-L220 VanDerWaalsContact NE2-O 3.14Å |
| 186 | W | 93.9 | Very high | 91.9 | Very high | 45 Ų | 45 | 33.4 Ų | 33.4 | 17% | 0.17 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -69.2 | -43.9 | 176.9 | -76.7 | 109.4 | 0 | 0 | 0 | 112 | V153 V154 T182 V183 A188 K189 S190 | V153-W186 HydrophobicContact CG1-CB 3.51Å; V153-W186 HydrophobicContact CG1-CG 4.21Å; V154-W186 HydrophobicContact CG2-CD2 4.17Å; V154-W186 HydrophobicContact CG2-CE3 3.78Å; V154-W186 HydrophobicContact CG2-CZ3 4.06Å; T182-W186 PolarHBondContact O-N 3.13Å; V183-W186 PolarHBondContact O-N 3.31Å; W186-A188 VanDerWaalsContact C-N 3.3Å; W186-A188 PolarHBondContact O-N 2.95Å; W186-K189 HydrophobicContact CE3-CD 3.87Å; W186-K189 HydrophobicContact CZ3-CD 3.85Å; W186-K189 WeakPolarHBondContact O-CB 3.29Å; W186-K189 PolarHBondContact O-N 3.31Å; W186-K189 VanDerWaalsContact O-N 3.07Å; W186-S190 PolarHBondContact O-N 2.98Å; W186-S190 PolarHBondContact O-OG 3.29Å; W186-S190 VanDerWaalsContact O-OG 3.1Å |
| 187 | L | 94.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.6 | -38.4 | 172.7 | -60 | -176.8 | 0 | 0 | 0 | 111.9 | V153 V183 K189 S190 G191 Q192 L196 L199 | V153-L187 HydrophobicContact CG1-CD2 4.48Å; V183-L187 HydrophobicContact CG2-CD1 4.05Å; V183-L187 HydrophobicContact CG2-CG 4.18Å; V183-L187 WeakPolarHBondContact O-CG 3.35Å; V183-L187 PolarHBondContact O-N 3.49Å; L187-K189 VanDerWaalsContact C-N 3.3Å; L187-K189 PolarHBondContact O-N 2.96Å; L187-S190 WeakPolarHBondContact CA-OG 3.27Å; L187-S190 PolarHBondContact O-OG 3.4Å; L187-G191 WeakPolarHBondContact O-CA 3.4Å; L187-G191 PolarHBondContact O-N 2.68Å; L187-Q192 HydrophobicContact CD2-CB 4.48Å; L187-Q192 PolarHBondContact O-N 2.92Å; L187-L196 HydrophobicContact CB-CB 4.36Å; L187-L196 HydrophobicContact CB-CD1 4.29Å; L187-L196 HydrophobicContact CD1-CB 4.11Å; L187-L196 HydrophobicContact CD1-CD1 4.02Å; L187-L199 HydrophobicContact CD1-CD2 3.69Å |
| 188 | A | 95.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -68.6 | -22.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | L184 H185 W186 P222 V225 A226 R231 V234 | L184-A188 WeakPolarHBondContact O-CB 3.44Å; L184-A188 PolarHBondContact O-N 3.33Å; H185-A188 PolarHBondContact O-N 2.98Å; W186-A188 VanDerWaalsContact C-N 3.3Å; W186-A188 PolarHBondContact O-N 2.95Å; A188-P222 HydrophobicContact CB-CB 4.2Å; A188-P222 WeakPolarHBondContact CB-O 3.32Å; A188-V225 HydrophobicContact CB-CB 4.41Å; A188-V225 HydrophobicContact CB-CG1 4.47Å; A188-A226 HydrophobicContact CB-CB 4.1Å; A188-R231 VanDerWaalsContact O-CG 3.23Å; A188-R231 WeakPolarHBondContact O-CG 3.05Å; A188-V234 HydrophobicContact CB-CG1 4.1Å |
| 189 | K | 94.4 | Very high | 93.1 | Very high | 63 Ų | 63 | 26.9 Ų | 26.9 | 27% | 0.274 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -84.8 | -48.6 | 176.9 | 179.3 | 173.3 | 175.5 | -174.3 | 0 | 111.7 | F181 H185 W186 L187 G191 V225 R231 | F181-K189 HydrophobicContact CE2-CD 4.4Å; H185-K189 VanDerWaalsContact O-CB 3.32Å; H185-K189 WeakPolarHBondContact O-CB 3.33Å; H185-K189 PolarHBondContact O-N 3.31Å; W186-K189 HydrophobicContact CE3-CD 3.87Å; W186-K189 HydrophobicContact CZ3-CD 3.85Å; W186-K189 WeakPolarHBondContact O-CB 3.29Å; W186-K189 PolarHBondContact O-N 3.31Å; W186-K189 VanDerWaalsContact O-N 3.07Å; L187-K189 VanDerWaalsContact C-N 3.3Å; L187-K189 PolarHBondContact O-N 2.96Å; K189-G191 VanDerWaalsContact C-N 3.27Å; K189-G191 PolarHBondContact O-N 2.91Å; K189-V225 HydrophobicContact CB-CG1 3.71Å; K189-V225 HydrophobicContact CG-CG1 4.46Å; K189-R231 PolarHBondContact O-NE 3.26Å; K189-R231 PolarHBondContact O-NH2 3.3Å |
| 190 | S | 92.7 | Very high | 93.4 | Very high | 40 Ų | 40 | 26 Ų | 26 | 28% | 0.28 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -64.7 | -33.7 | 174.6 | 59.9 | 0 | 0 | 0 | 0 | 111.5 | W186 L187 Q192 R231 | W186-S190 PolarHBondContact O-N 2.98Å; W186-S190 PolarHBondContact O-OG 3.29Å; W186-S190 VanDerWaalsContact O-OG 3.1Å; L187-S190 WeakPolarHBondContact CA-OG 3.27Å; L187-S190 PolarHBondContact O-OG 3.4Å; S190-Q192 WeakPolarHBondContact OG-CG 3.47Å; S190-Q192 PolarHBondContact OG-NE2 3.42Å; S190-R231 PolarHBondContact O-NE 3.29Å; S190-R231 PolarHBondContact O-NH1 3.19Å; S190-R231 PolarHBondContact O-NH2 3.37Å |
| 191 | G | 93.3 | Very high | 93.5 | Very high | 20 Ų | 20 | 27.7 Ų | 27.7 | 21% | 0.206 | 14% | 0.137 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 78.4 | 43.1 | -177 | 0 | 0 | 0 | 0 | 0 | 111.8 | L187 K189 | L187-G191 WeakPolarHBondContact O-CA 3.4Å; L187-G191 PolarHBondContact O-N 2.68Å; K189-G191 VanDerWaalsContact C-N 3.27Å; K189-G191 PolarHBondContact O-N 2.91Å |
| 192 | Q | 93.7 | Very high | 93.4 | Very high | 36 Ų | 36 | 28.5 Ų | 28.5 | 17% | 0.168 | 14% | 0.141 | C | C | . | . | trans | -96.6 | 91.8 | 173.9 | -61.5 | 162.5 | 16.4 | 0 | 0 | 108.3 | V154 G156 L187 S190 T195 L196 | V154-Q192 PolarHBondContact O-NE2 3.22Å; G156-Q192 VanDerWaalsContact CA-CD 3.44Å; G156-Q192 VanDerWaalsContact CA-NE2 3.32Å; L187-Q192 HydrophobicContact CD2-CB 4.48Å; L187-Q192 PolarHBondContact O-N 2.92Å; S190-Q192 WeakPolarHBondContact OG-CG 3.47Å; S190-Q192 PolarHBondContact OG-NE2 3.42Å; Q192-T195 HydrophobicContact CB-CG2 4.43Å; Q192-T195 WeakPolarHBondContact CB-OG1 3.42Å; Q192-T195 PolarHBondContact O-OG1 3.23Å; Q192-T195 PolarHBondContact OE1-OG1 2.81Å; Q192-T195 VanDerWaalsContact OE1-OG1 3.1Å; Q192-L196 WeakPolarHBondContact O-CB 3.22Å; Q192-L196 PolarHBondContact O-N 3.35Å | ||
| 193 | D | 94.4 | Very high | 93.3 | Very high | 35 Ų | 35 | 28.5 Ų | 28.5 | 19% | 0.187 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -76 | -35.3 | -178.1 | 22.3 | -71.9 | 0 | 0 | 0 | 113.6 | L196 I197 M233 V234 I237 | D193-L196 PolarHBondContact O-N 3.01Å; D193-I197 WeakPolarHBondContact O-CG1 3.35Å; D193-I197 PolarHBondContact O-N 3.03Å; D193-M233 HydrophobicContact CB-CB 4.32Å; D193-M233 HydrophobicContact CB-CG 4.1Å; D193-M233 WeakPolarHBondContact OD2-CG 3.49Å; D193-V234 HydrophobicContact CB-CG2 3.94Å; D193-I237 HydrophobicContact CB-CD1 3.3Å |
| 194 | E | 93.9 | Very high | 93.2 | Very high | 125 Ų | 125 | 34.4 Ų | 34.4 | 58% | 0.584 | 17% | 0.168 | S | C | * | . | H | α-helix | trans | -65.9 | -46.5 | 179.9 | -58.2 | 89.9 | 158.6 | 0 | 0 | 111.7 | L196 I197 Q198 | E194-L196 VanDerWaalsContact C-N 3.31Å; E194-L196 PolarHBondContact O-N 2.77Å; E194-I197 PolarHBondContact O-N 3.3Å; E194-Q198 VanDerWaalsContact O-CG 3.31Å; E194-Q198 WeakPolarHBondContact O-CG 3.37Å; E194-Q198 PolarHBondContact O-N 2.85Å |
| 195 | T | 94.3 | Very high | 93 | Very high | 17 Ų | 17 | 39.8 Ų | 39.8 | 10% | 0.104 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -67.3 | -34.2 | 179.3 | 66.5 | 0 | 0 | 0 | 0 | 111.3 | G156 Q192 Q198 L199 | G156-T195 WeakPolarHBondContact O-CG2 3.49Å; Q192-T195 HydrophobicContact CB-CG2 4.43Å; Q192-T195 WeakPolarHBondContact CB-OG1 3.42Å; Q192-T195 PolarHBondContact O-OG1 3.23Å; Q192-T195 PolarHBondContact OE1-OG1 2.81Å; Q192-T195 VanDerWaalsContact OE1-OG1 3.1Å; T195-Q198 PolarHBondContact O-N 3.07Å; T195-L199 WeakPolarHBondContact O-CB 3.48Å; T195-L199 PolarHBondContact O-N 3.36Å |
| 196 | L | 94.3 | Very high | 92.6 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.5 | -44.1 | 172.7 | 178.9 | 66.4 | 0 | 0 | 0 | 112.1 | L184 L187 Q192 D193 E194 L200 V234 L238 | L184-L196 HydrophobicContact CD2-CD1 3.68Å; L187-L196 HydrophobicContact CB-CB 4.36Å; L187-L196 HydrophobicContact CB-CD1 4.29Å; L187-L196 HydrophobicContact CD1-CB 4.11Å; L187-L196 HydrophobicContact CD1-CD1 4.02Å; Q192-L196 WeakPolarHBondContact O-CB 3.22Å; Q192-L196 PolarHBondContact O-N 3.35Å; D193-L196 PolarHBondContact O-N 3.01Å; E194-L196 VanDerWaalsContact C-N 3.31Å; E194-L196 PolarHBondContact O-N 2.77Å; L196-L200 HydrophobicContact CD1-CD1 3.8Å; L196-L200 HydrophobicContact CD1-CG 4.34Å; L196-L200 HydrophobicContact CG-CD1 4.07Å; L196-L200 WeakPolarHBondContact O-CB 3.39Å; L196-L200 WeakPolarHBondContact O-CG 3.27Å; L196-L200 PolarHBondContact O-N 3.16Å; L196-L200 VanDerWaalsContact O-N 3.12Å; L196-V234 HydrophobicContact CD2-CB 4.43Å; L196-V234 HydrophobicContact CD2-CG1 3.63Å; L196-V234 HydrophobicContact CD2-CG2 4.3Å; L196-L238 HydrophobicContact CD2-CD2 4.2Å; L196-L238 HydrophobicContact CD2-CG 4.29Å |
| 197 | I | 93.9 | Very high | 92.3 | Very high | 34 Ų | 34 | 46.8 Ų | 46.8 | 17% | 0.174 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -61.7 | -52.3 | 174.2 | -69.7 | 168.9 | 0 | 0 | 0 | 110 | D193 E194 L199 L200 R201 I237 V334 | D193-I197 WeakPolarHBondContact O-CG1 3.35Å; D193-I197 PolarHBondContact O-N 3.03Å; E194-I197 PolarHBondContact O-N 3.3Å; I197-L199 VanDerWaalsContact C-N 3.34Å; I197-L199 PolarHBondContact O-N 3.33Å; I197-L200 PolarHBondContact O-N 3.22Å; I197-R201 HydrophobicContact CG2-CG 4.35Å; I197-R201 WeakPolarHBondContact O-CG 3.28Å; I197-R201 PolarHBondContact O-N 3.24Å; I197-I237 HydrophobicContact CD1-CD1 3.68Å; I197-I237 HydrophobicContact CD1-CG1 4.1Å; I197-I237 HydrophobicContact CG1-CD1 4.04Å; I197-I237 HydrophobicContact CG1-CG1 4.35Å; I197-I237 HydrophobicContact CG1-CG2 3.84Å; I197-V334 HydrophobicContact CG2-CG2 3.95Å |
| 198 | Q | 93.5 | Very high | 91.9 | Very high | 82 Ų | 82 | 48.4 Ų | 48.4 | 38% | 0.383 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.5 | -44.2 | -176.7 | -68.7 | 173.1 | -51.5 | 0 | 0 | 111.5 | Y158 E194 T195 R201 H202 | Y158-Q198 HydrophobicContact CD2-CB 3.6Å; Y158-Q198 HydrophobicContact CE1-CB 4.4Å; Y158-Q198 HydrophobicContact CE2-CB 3.38Å; Y158-Q198 HydrophobicContact CG-CB 4.21Å; E194-Q198 VanDerWaalsContact O-CG 3.31Å; E194-Q198 WeakPolarHBondContact O-CG 3.37Å; E194-Q198 PolarHBondContact O-N 2.85Å; T195-Q198 PolarHBondContact O-N 3.07Å; Q198-R201 PolarHBondContact O-N 3.45Å; Q198-H202 WeakPolarHBondContact O-CB 3.35Å; Q198-H202 PolarHBondContact O-N 3.34Å |
| 199 | L | 92.6 | Very high | 91.4 | Very high | 2 Ų | 2 | 54.1 Ų | 54.1 | 1% | 0.01 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.6 | -44.7 | 178.3 | -175.6 | 65.3 | 0 | 0 | 0 | 112.8 | I161 L165 L172 V183 L184 L187 T195 I197 H202 A203 | I161-L199 HydrophobicContact CG2-CD1 3.54Å; I161-L199 HydrophobicContact CG2-CD2 4.4Å; L165-L199 HydrophobicContact CD1-CD1 3.47Å; L165-L199 VanDerWaalsContact CD1-CD1 3.47Å; L172-L199 HydrophobicContact CD2-CD1 3.95Å; L172-L199 HydrophobicContact CD2-CD2 4.06Å; L172-L199 HydrophobicContact CD2-CG 4.07Å; V183-L199 HydrophobicContact CG1-CD2 4.21Å; V183-L199 HydrophobicContact CG2-CD2 3.51Å; L184-L199 HydrophobicContact CD2-CD2 4.41Å; L187-L199 HydrophobicContact CD1-CD2 3.69Å; T195-L199 WeakPolarHBondContact O-CB 3.48Å; T195-L199 PolarHBondContact O-N 3.36Å; I197-L199 VanDerWaalsContact C-N 3.34Å; I197-L199 PolarHBondContact O-N 3.33Å; L199-H202 PolarHBondContact O-N 3.08Å; L199-A203 WeakPolarHBondContact O-CB 3.31Å; L199-A203 PolarHBondContact O-N 2.89Å |
| 200 | L | 91.6 | Very high | 91.1 | Very high | 5 Ų | 5 | 53.2 Ų | 53.2 | 3% | 0.026 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -70.1 | -41 | 179.7 | -72.2 | 170.6 | 0 | 0 | 0 | 111.4 | L184 L196 I197 H202 A203 E204 V210 V212 F242 | L184-L200 HydrophobicContact CD1-CD2 4.37Å; L184-L200 HydrophobicContact CD2-CD2 3.88Å; L184-L200 HydrophobicContact CD2-CG 4.24Å; L196-L200 HydrophobicContact CD1-CD1 3.8Å; L196-L200 HydrophobicContact CD1-CG 4.34Å; L196-L200 HydrophobicContact CG-CD1 4.07Å; L196-L200 WeakPolarHBondContact O-CB 3.39Å; L196-L200 WeakPolarHBondContact O-CG 3.27Å; L196-L200 PolarHBondContact O-N 3.16Å; L196-L200 VanDerWaalsContact O-N 3.12Å; I197-L200 PolarHBondContact O-N 3.22Å; L200-H202 PolarHBondContact O-N 2.95Å; L200-A203 PolarHBondContact O-N 3.12Å; L200-E204 WeakPolarHBondContact O-CG 3.46Å; L200-E204 PolarHBondContact O-N 2.88Å; L200-V210 HydrophobicContact CD2-CB 4.21Å; L200-V210 HydrophobicContact CD2-CG1 3.61Å; L200-V212 HydrophobicContact CD1-CG1 4.28Å; L200-V212 HydrophobicContact CD2-CG1 4.17Å; L200-F242 HydrophobicContact CB-CD1 4.2Å; L200-F242 HydrophobicContact CB-CE1 3.53Å; L200-F242 HydrophobicContact CB-CE2 4.1Å; L200-F242 HydrophobicContact CB-CZ 3.47Å; L200-F242 VanDerWaalsContact CB-CZ 3.47Å; L200-F242 HydrophobicContact CD1-CD1 4.06Å; L200-F242 HydrophobicContact CD1-CD2 3.51Å; L200-F242 HydrophobicContact CD1-CE1 4.05Å; L200-F242 HydrophobicContact CD1-CE2 3.48Å; L200-F242 VanDerWaalsContact CD1-CE2 3.48Å; L200-F242 HydrophobicContact CD1-CG 3.81Å; L200-F242 HydrophobicContact CD1-CZ 3.76Å; L200-F242 HydrophobicContact CG-CE1 4.38Å; L200-F242 HydrophobicContact CG-CE2 4.42Å; L200-F242 HydrophobicContact CG-CZ 4.25Å |
| 201 | R | 90.6 | Very high | 91 | Very high | 55 Ų | 55 | 55.1 Ų | 55.1 | 21% | 0.208 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -60.2 | -43.2 | 171.7 | -72 | -170.5 | 76.6 | -130.1 | -1.9 | 112.6 | I197 Q198 A203 E204 N205 V334 N337 | I197-R201 HydrophobicContact CG2-CG 4.35Å; I197-R201 WeakPolarHBondContact O-CG 3.28Å; I197-R201 PolarHBondContact O-N 3.24Å; Q198-R201 PolarHBondContact O-N 3.45Å; R201-A203 VanDerWaalsContact C-N 3.32Å; R201-A203 PolarHBondContact O-N 3.34Å; R201-E204 PolarHBondContact O-N 3.45Å; R201-N205 WeakPolarHBondContact O-CB 3.43Å; R201-N205 PolarHBondContact O-N 2.72Å; R201-V334 HydrophobicContact CG-CG1 4.42Å; R201-V334 PolarHBondContact NE-O 2.94Å; R201-V334 PolarHBondContact NH2-O 3.06Å; R201-N337 PolarHBondContact NH1-O 3.14Å; R201-N337 PolarHBondContact NH2-O 3.18Å |
| 202 | H | 91.1 | Very high | 90.9 | Very high | 39 Ų | 39 | 54.9 Ų | 54.9 | 18% | 0.181 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60.2 | -45.3 | 177 | -174.5 | -68.5 | 0 | 0 | 0 | 110.8 | V162 Q198 L199 L200 N205 E206 | V162-H202 WeakPolarHBondContact CG1-NE2 3.47Å; Q198-H202 WeakPolarHBondContact O-CB 3.35Å; Q198-H202 PolarHBondContact O-N 3.34Å; L199-H202 PolarHBondContact O-N 3.08Å; L200-H202 PolarHBondContact O-N 2.95Å; H202-N205 PolarHBondContact O-N 2.95Å; H202-E206 WeakPolarHBondContact O-CG 3.43Å; H202-E206 PolarHBondContact O-N 3.08Å |
| 203 | A | 90.4 | Very high | 90.9 | Very high | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -66.5 | -37.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113 | L172 L199 L200 R201 G207 I208 V210 | L172-A203 HydrophobicContact CD1-CB 3.66Å; L199-A203 WeakPolarHBondContact O-CB 3.31Å; L199-A203 PolarHBondContact O-N 2.89Å; L200-A203 PolarHBondContact O-N 3.12Å; R201-A203 VanDerWaalsContact C-N 3.32Å; R201-A203 PolarHBondContact O-N 3.34Å; A203-G207 PolarHBondContact O-N 3.43Å; A203-G207 VanDerWaalsContact O-N 3.16Å; A203-I208 HydrophobicContact CB-CB 4.23Å; A203-I208 PolarHBondContact O-N 3.46Å; A203-V210 HydrophobicContact CB-CG2 3.39Å |
| 204 | E | 89.7 | Confident | 90.8 | Very high | 123 Ų | 123 | 55.8 Ų | 55.8 | 58% | 0.575 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -63.2 | -43.4 | 172.7 | -74.8 | 173 | 179.3 | 0 | 0 | 112 | L200 R201 G207 F242 | L200-E204 WeakPolarHBondContact O-CG 3.46Å; L200-E204 PolarHBondContact O-N 2.88Å; R201-E204 PolarHBondContact O-N 3.45Å; E204-G207 PolarHBondContact O-N 2.95Å; E204-F242 WeakPolarHBondContact OE1-CE1 3.26Å |
| 205 | N | 89.5 | Confident | 90.7 | Very high | 114 Ų | 114 | 53.5 Ų | 53.5 | 61% | 0.61 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -63.7 | -44 | 177.7 | -72.7 | -11.7 | 0 | 0 | 0 | 112.4 | R201 H202 G207 | R201-N205 WeakPolarHBondContact O-CB 3.43Å; R201-N205 PolarHBondContact O-N 2.72Å; H202-N205 PolarHBondContact O-N 2.95Å; N205-G207 PolarHBondContact O-N 2.99Å |
| 206 | E | 87.9 | Confident | 90.5 | Very high | 131 Ų | 131 | 52.8 Ų | 52.8 | 61% | 0.612 | 29% | 0.285 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.5 | 2.1 | 176.7 | -64.8 | -58.6 | 122.3 | 0 | 0 | 113.3 | H202 I208 | H202-E206 WeakPolarHBondContact O-CG 3.43Å; H202-E206 PolarHBondContact O-N 3.08Å; E206-I208 HydrophobicContact CB-CD1 3.8Å; E206-I208 HydrophobicContact CB-CG1 3.87Å; E206-I208 PolarHBondContact O-N 2.94Å |
| 207 | G | 86.1 | Confident | 90.3 | Very high | 61 Ų | 61 | 56.2 Ų | 56.2 | 63% | 0.629 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.3 | 16.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | A203 E204 N205 | A203-G207 PolarHBondContact O-N 3.43Å; A203-G207 VanDerWaalsContact O-N 3.16Å; E204-G207 PolarHBondContact O-N 2.95Å; N205-G207 PolarHBondContact O-N 2.99Å |
| 208 | I | 87.6 | Confident | 90.1 | Very high | 35 Ų | 35 | 55.9 Ų | 55.9 | 18% | 0.179 | 31% | 0.314 | C | S | . | . | trans | -76 | 122 | -178.3 | -55.3 | 166.4 | 0 | 0 | 0 | 109 | L172 A203 E206 V210 | L172-I208 HydrophobicContact CD1-CG2 3.92Å; A203-I208 HydrophobicContact CB-CB 4.23Å; A203-I208 PolarHBondContact O-N 3.46Å; E206-I208 HydrophobicContact CB-CD1 3.8Å; E206-I208 HydrophobicContact CB-CG1 3.87Å; E206-I208 PolarHBondContact O-N 2.94Å; I208-V210 PolarHBondContact O-N 3.23Å | ||
| 209 | P | 84 | Confident | 90.1 | Very high | 119 Ų | 119 | 52 Ų | 52 | 77% | 0.773 | 30% | 0.296 | S | S | * | . | trans | -75.4 | 90.9 | -173.3 | 29.5 | -35.5 | 0 | 0 | 0 | 112.4 | ||||
| 210 | V | 88.3 | Confident | 90.2 | Very high | 45 Ų | 45 | 52.9 Ų | 52.9 | 27% | 0.273 | 30% | 0.3 | S | S | . | . | trans | -88.1 | 128.6 | 177.3 | -172.5 | 0 | 0 | 0 | 0 | 111.9 | L172 L184 L200 A203 I208 | L172-V210 HydrophobicContact CD1-CG2 3.57Å; L184-V210 HydrophobicContact CD1-CG1 3.83Å; L200-V210 HydrophobicContact CD2-CB 4.21Å; L200-V210 HydrophobicContact CD2-CG1 3.61Å; A203-V210 HydrophobicContact CB-CG2 3.39Å; I208-V210 PolarHBondContact O-N 3.23Å | ||
| 211 | N | 90.3 | Very high | 90.5 | Very high | 80 Ų | 80 | 52.7 Ų | 52.7 | 43% | 0.428 | 30% | 0.299 | S | S | . | . | trans | -106.1 | 103.2 | 173.8 | 179.8 | -3 | 0 | 0 | 0 | 110.5 | N213 L214 | N211-N213 PolarHBondContact O-N 2.96Å; N211-N213 VanDerWaalsContact O-N 3.11Å; N211-N213 WeakPolarHBondContact OD1-CA 3.4Å; N211-N213 WeakPolarHBondContact OD1-CB 3.37Å; N211-N213 PolarHBondContact OD1-N 3.04Å; N211-L214 HydrophobicContact CB-CD1 4.39Å; N211-L214 HydrophobicContact CB-CG 3.98Å; N211-L214 WeakPolarHBondContact O-CD1 3.44Å; N211-L214 WeakPolarHBondContact O-CG 3.4Å; N211-L214 PolarHBondContact O-N 3.05Å | ||
| 212 | V | 91.9 | Very high | 90.7 | Very high | 14 Ų | 14 | 50 Ų | 50 | 9% | 0.085 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.9 | -11.2 | 177.6 | -62.6 | 0 | 0 | 0 | 0 | 114.2 | L184 L200 P222 F242 A244 | L184-V212 HydrophobicContact CD1-CG1 4.28Å; L200-V212 HydrophobicContact CD1-CG1 4.28Å; L200-V212 HydrophobicContact CD2-CG1 4.17Å; V212-P222 WeakPolarHBondContact O-CD 3.18Å; V212-F242 HydrophobicContact CG1-CB 4.04Å; V212-A244 HydrophobicContact CG2-CB 4.16Å |
| 213 | N | 92.7 | Very high | 91 | Very high | 52 Ų | 52 | 48.2 Ų | 48.2 | 28% | 0.278 | 28% | 0.281 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.9 | 12.8 | 179.1 | -56.5 | -62.6 | 0 | 0 | 0 | 113.3 | N211 K215 N245 | N211-N213 PolarHBondContact O-N 2.96Å; N211-N213 VanDerWaalsContact O-N 3.11Å; N211-N213 WeakPolarHBondContact OD1-CA 3.4Å; N211-N213 WeakPolarHBondContact OD1-CB 3.37Å; N211-N213 PolarHBondContact OD1-N 3.04Å; N213-K215 PolarHBondContact O-N 3.34Å; N213-N245 WeakPolarHBondContact OD1-CB 3.18Å; N213-N245 PolarHBondContact OD1-N 3.19Å |
| 214 | L | 92.1 | Very high | 91.2 | Very high | 39 Ų | 39 | 48.3 Ų | 48.3 | 20% | 0.204 | 28% | 0.281 | C | S | . | . | trans | -53.5 | 132 | 172.5 | -78.7 | 165.8 | 0 | 0 | 0 | 110.6 | T182 H185 N211 P222 | T182-L214 HydrophobicContact CG2-CD1 4.28Å; H185-L214 PolarHBondContact CE1-O 2.87Å; H185-L214 PolarHBondContact NE2-O 2.88Å; N211-L214 HydrophobicContact CB-CD1 4.39Å; N211-L214 HydrophobicContact CB-CG 3.98Å; N211-L214 WeakPolarHBondContact O-CD1 3.44Å; N211-L214 WeakPolarHBondContact O-CG 3.4Å; N211-L214 PolarHBondContact O-N 3.05Å; L214-P222 WeakPolarHBondContact O-CD 3.43Å | ||
| 215 | K | 92.8 | Very high | 91.5 | Very high | 76 Ų | 76 | 42.5 Ų | 42.5 | 33% | 0.33 | 25% | 0.254 | S | S | . | . | trans | -90.9 | 124.2 | 176.5 | -67.6 | -169.1 | 174.7 | -164.1 | 0 | 111.2 | K175 N213 G219 L220 T221 M249 Y251 | K175-K215 WeakPolarHBondContact CE-O 3.36Å; K175-K215 PolarHBondContact NZ-O 3.02Å; N213-K215 PolarHBondContact O-N 3.34Å; K215-G219 VanDerWaalsContact CD-O 3.29Å; K215-G219 WeakPolarHBondContact CD-O 3.33Å; K215-G219 WeakPolarHBondContact CG-O 3.33Å; K215-L220 CarbonylContact C-O 3.4Å; K215-L220 WeakPolarHBondContact CA-O 3.39Å; K215-T221 HydrophobicContact CG-CG2 4.02Å; K215-M249 WeakPolarHBondContact CE-O 3.33Å; K215-M249 PolarHBondContact NZ-O 3.08Å; K215-Y251 HydrophobicContact CD-CE1 4.31Å | ||
| 216 | G | 89.8 | Confident | 91.8 | Very high | 3 Ų | 3 | 37 Ų | 37 | 3% | 0.031 | 23% | 0.225 | C | C | . | . | trans | -80.5 | -153.5 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | G180 H185 G219 L220 | G180-G216 WeakPolarHBondContact O-CA 3.42Å; H185-G216 PolarHBondContact NE2-N 3.49Å; G216-G219 PolarHBondContact O-N 3.34Å; G216-L220 PolarHBondContact N-O 2.85Å | ||
| 217 | S | 90.6 | Very high | 92.2 | Very high | 71 Ų | 71 | 30.8 Ų | 30.8 | 50% | 0.497 | 20% | 0.196 | S | C | . | . | G | 310 helix | trans | -64.9 | 153.9 | 169.1 | -168.3 | 0 | 0 | 0 | 0 | 111.3 | S179 G219 L220 | S179-S217 WeakPolarHBondContact O-CB 3.34Å; S179-S217 PolarHBondContact O-N 3.21Å; S217-G219 PolarHBondContact O-N 2.75Å; S217-L220 PolarHBondContact O-N 3.02Å |
| 218 | G | 89.4 | Confident | 92.6 | Very high | 27 Ų | 27 | 31.1 Ų | 31.1 | 28% | 0.278 | 18% | 0.182 | S | C | . | . | G | 310 helix | trans | 63.6 | 3.3 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | L220 Y251 | G218-L220 PolarHBondContact O-N 3.14Å; G218-Y251 WeakPolarHBondContact O-CB 3.48Å; G218-Y251 PolarHBondContact O-N 3.32Å |
| 219 | G | 93.5 | Very high | 92.9 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 19% | 0.19 | C | C | . | . | G | 310 helix | trans | 78.6 | 3 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | K215 G216 S217 Y251 | K215-G219 VanDerWaalsContact CD-O 3.29Å; K215-G219 WeakPolarHBondContact CD-O 3.33Å; K215-G219 WeakPolarHBondContact CG-O 3.33Å; G216-G219 PolarHBondContact O-N 3.34Å; S217-G219 PolarHBondContact O-N 2.75Å; G219-Y251 VanDerWaalsContact CA-CE1 3.45Å; G219-Y251 VanDerWaalsContact N-CD2 3.32Å; G219-Y251 VanDerWaalsContact N-CE2 3.3Å |
| 220 | L | 95.5 | Very high | 93.5 | Very high | 21 Ų | 21 | 28.3 Ų | 28.3 | 11% | 0.11 | 16% | 0.16 | C | C | . | . | trans | -60.4 | 140.8 | 178 | -60.5 | 169.9 | 0 | 0 | 0 | 110.2 | F181 H185 K215 G216 S217 G218 H224 V225 M228 D250 Y259 | F181-L220 HydrophobicContact CE1-CD1 4.45Å; F181-L220 HydrophobicContact CZ-CD1 4.42Å; H185-L220 PolarHBondContact NE2-O 3.05Å; H185-L220 VanDerWaalsContact NE2-O 3.14Å; K215-L220 CarbonylContact C-O 3.4Å; K215-L220 WeakPolarHBondContact CA-O 3.39Å; G216-L220 PolarHBondContact N-O 2.85Å; S217-L220 PolarHBondContact O-N 3.02Å; G218-L220 PolarHBondContact O-N 3.14Å; L220-H224 HydrophobicContact CB-CB 4.19Å; L220-H224 HydrophobicContact CD2-CB 3.82Å; L220-V225 HydrophobicContact CB-CG2 4.42Å; L220-M228 HydrophobicContact CD1-SD 4.08Å; L220-M228 HydrophobicContact CD2-SD 4.27Å; L220-D250 HydrophobicContact CD2-CB 4Å; L220-Y259 HydrophobicContact CD2-CE2 4.36Å | ||
| 221 | T | 95.9 | Very high | 93.8 | Very high | 1 Ų | 1 | 30.6 Ų | 30.6 | 1% | 0.006 | 16% | 0.164 | C | C | . | . | trans | -100.2 | 168.5 | 168.5 | 67.3 | 0 | 0 | 0 | 0 | 110.2 | K215 L223 H224 V225 A248 | K215-T221 HydrophobicContact CG-CG2 4.02Å; T221-L223 PolarHBondContact O-N 3.01Å; T221-L223 VanDerWaalsContact O-N 3.08Å; T221-H224 PolarHBondContact N-ND1 3.3Å; T221-H224 WeakPolarHBondContact O-CB 3.1Å; T221-H224 PolarHBondContact O-N 2.94Å; T221-H224 PolarHBondContact OG1-ND1 3.34Å; T221-V225 PolarHBondContact O-N 2.94Å; T221-A248 HydrophobicContact CG2-CB 4.18Å | ||
| 222 | P | 95.9 | Very high | 94.1 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -52.4 | -32.9 | 173.5 | -28.3 | 36.7 | 0 | 0 | 0 | 113.2 | L184 A188 V212 L214 V225 A226 L238 | L184-P222 HydrophobicContact CB-CB 4.22Å; L184-P222 HydrophobicContact CB-CG 3.71Å; A188-P222 HydrophobicContact CB-CB 4.2Å; A188-P222 WeakPolarHBondContact CB-O 3.32Å; V212-P222 WeakPolarHBondContact O-CD 3.18Å; L214-P222 WeakPolarHBondContact O-CD 3.43Å; P222-V225 PolarHBondContact O-N 3.4Å; P222-A226 WeakPolarHBondContact O-CB 3.36Å; P222-A226 PolarHBondContact O-N 3.24Å; P222-L238 HydrophobicContact CB-CD1 4.04Å |
| 223 | L | 96.4 | Very high | 94.2 | Very high | 1 Ų | 1 | 33 Ų | 33 | 1% | 0.005 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -63.7 | -39.6 | 176.2 | -168.9 | 63.8 | 0 | 0 | 0 | 112.9 | T221 A227 I235 L238 V239 A244 A256 L272 | T221-L223 PolarHBondContact O-N 3.01Å; T221-L223 VanDerWaalsContact O-N 3.08Å; L223-A227 PolarHBondContact O-N 3.49Å; L223-A227 VanDerWaalsContact O-N 3.1Å; L223-I235 HydrophobicContact CD1-CG2 3.81Å; L223-L238 HydrophobicContact CD1-CB 4.26Å; L223-L238 HydrophobicContact CD1-CD1 4.42Å; L223-V239 HydrophobicContact CD1-CG2 3.57Å; L223-V239 HydrophobicContact CD2-CG2 4.2Å; L223-A244 HydrophobicContact CD2-CB 4.42Å; L223-A256 HydrophobicContact CB-CB 4.45Å; L223-A256 HydrophobicContact CD2-CB 4.15Å; L223-A256 HydrophobicContact CG-CB 3.86Å; L223-L272 HydrophobicContact CD1-CD2 4.05Å; L223-L272 HydrophobicContact CD2-CD2 4.12Å; L223-L272 HydrophobicContact CG-CD2 4.26Å |
| 224 | H | 95.9 | Very high | 94.4 | Very high | 1 Ų | 1 | 30.6 Ų | 30.6 | 1% | 0.005 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -66.2 | -46.2 | 174.6 | -66.6 | 72.7 | 0 | 0 | 0 | 110.7 | L220 T221 A226 A227 M228 A248 R254 A256 | L220-H224 HydrophobicContact CB-CB 4.19Å; L220-H224 HydrophobicContact CD2-CB 3.82Å; T221-H224 PolarHBondContact N-ND1 3.3Å; T221-H224 WeakPolarHBondContact O-CB 3.1Å; T221-H224 PolarHBondContact O-N 2.94Å; T221-H224 PolarHBondContact OG1-ND1 3.34Å; H224-A226 VanDerWaalsContact C-N 3.32Å; H224-A226 PolarHBondContact O-N 2.74Å; H224-A227 WeakPolarHBondContact O-CB 3.46Å; H224-A227 PolarHBondContact O-N 3.23Å; H224-A227 VanDerWaalsContact O-N 3.14Å; H224-M228 VanDerWaalsContact O-CG 3.26Å; H224-M228 WeakPolarHBondContact O-CG 3.43Å; H224-M228 PolarHBondContact O-N 2.94Å; H224-A248 PolarHBondContact CE1-O 2.85Å; H224-A248 PolarHBondContact NE2-O 2.96Å; H224-R254 PolarHBondContact NE2-O 2.9Å; H224-A256 PolarHBondContact NE2-N 2.95Å |
| 225 | V | 95.8 | Very high | 94.5 | Very high | 1 Ų | 1 | 28.7 Ų | 28.7 | 1% | 0.006 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -62.7 | -40.7 | -179.9 | -178.9 | 0 | 0 | 0 | 0 | 111 | F181 A188 K189 L220 T221 P222 A227 M228 H229 | F181-V225 HydrophobicContact CE1-CG2 4.31Å; F181-V225 HydrophobicContact CE2-CG1 4.48Å; F181-V225 HydrophobicContact CE2-CG2 4.24Å; F181-V225 HydrophobicContact CZ-CG2 3.84Å; A188-V225 HydrophobicContact CB-CB 4.41Å; A188-V225 HydrophobicContact CB-CG1 4.47Å; K189-V225 HydrophobicContact CB-CG1 3.71Å; K189-V225 HydrophobicContact CG-CG1 4.46Å; L220-V225 HydrophobicContact CB-CG2 4.42Å; T221-V225 PolarHBondContact O-N 2.94Å; P222-V225 PolarHBondContact O-N 3.4Å; V225-A227 PolarHBondContact O-N 2.99Å; V225-M228 PolarHBondContact O-N 3.09Å; V225-H229 PolarHBondContact O-CD2 2.84Å; V225-H229 PolarHBondContact O-N 3.25Å |
| 226 | A | 96 | Very high | 94.6 | Very high | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61.9 | -41.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A188 P222 H224 S230 R231 V234 I235 | A188-A226 HydrophobicContact CB-CB 4.1Å; P222-A226 WeakPolarHBondContact O-CB 3.36Å; P222-A226 PolarHBondContact O-N 3.24Å; H224-A226 VanDerWaalsContact C-N 3.32Å; H224-A226 PolarHBondContact O-N 2.74Å; A226-S230 WeakPolarHBondContact O-CA 3.42Å; A226-S230 PolarHBondContact O-N 3.37Å; A226-R231 HydrophobicContact CB-CB 4.35Å; A226-R231 PolarHBondContact O-N 3.04Å; A226-V234 HydrophobicContact CB-CB 4.41Å; A226-V234 HydrophobicContact CB-CG1 3.92Å; A226-I235 HydrophobicContact CB-CD1 4.3Å; A226-I235 HydrophobicContact CB-CG1 3.54Å |
| 227 | A | 95.3 | Very high | 94.9 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -64.6 | -49.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L223 H224 V225 H229 S230 I235 A256 Y259 L260 L272 | L223-A227 PolarHBondContact O-N 3.49Å; L223-A227 VanDerWaalsContact O-N 3.1Å; H224-A227 WeakPolarHBondContact O-CB 3.46Å; H224-A227 PolarHBondContact O-N 3.23Å; H224-A227 VanDerWaalsContact O-N 3.14Å; V225-A227 PolarHBondContact O-N 2.99Å; A227-H229 VanDerWaalsContact C-N 3.3Å; A227-H229 PolarHBondContact O-N 3.42Å; A227-S230 PolarHBondContact O-N 3.38Å; A227-I235 HydrophobicContact CB-CD1 4.33Å; A227-A256 WeakPolarHBondContact CB-O 3.33Å; A227-Y259 CarbonylContact C-O 3.52Å; A227-L260 HydrophobicContact CB-CD2 3.94Å; A227-L260 HydrophobicContact CB-CG 4.44Å; A227-L272 HydrophobicContact CB-CD1 4.47Å |
| 228 | M | 94.8 | Very high | 95 | Very high | 67 Ų | 67 | 24.7 Ų | 24.7 | 33% | 0.33 | 12% | 0.12 | S | C | . | . | H | α-helix | trans | -52 | -47.3 | 175.6 | -70 | 170 | 74.1 | 0 | 0 | 112.1 | L220 H224 V225 S230 Y259 | L220-M228 HydrophobicContact CD1-SD 4.08Å; L220-M228 HydrophobicContact CD2-SD 4.27Å; H224-M228 VanDerWaalsContact O-CG 3.26Å; H224-M228 WeakPolarHBondContact O-CG 3.43Å; H224-M228 PolarHBondContact O-N 2.94Å; V225-M228 PolarHBondContact O-N 3.09Å; M228-S230 VanDerWaalsContact C-N 3.31Å; M228-Y259 HydrophobicContact CG-CD1 3.39Å; M228-Y259 HydrophobicContact CG-CE1 4.17Å; M228-Y259 HydrophobicContact CG-CG 3.64Å; M228-Y259 HydrophobicContact SD-CD1 4.12Å; M228-Y259 HydrophobicContact SD-CE1 4.33Å |
| 229 | H | 94.8 | Very high | 95.2 | Very high | 75 Ų | 75 | 24.3 Ų | 24.3 | 35% | 0.347 | 11% | 0.112 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.4 | 1.8 | -179.9 | -71.3 | -78.9 | 0 | 0 | 0 | 113.8 | V225 A227 R231 | V225-H229 PolarHBondContact O-CD2 2.84Å; V225-H229 PolarHBondContact O-N 3.25Å; A227-H229 VanDerWaalsContact C-N 3.3Å; A227-H229 PolarHBondContact O-N 3.42Å; H229-R231 VanDerWaalsContact C-N 3.3Å; H229-R231 HydrophobicContact CB-CG 3.92Å; H229-R231 PolarHBondContact O-N 3.19Å |
| 230 | S | 95.3 | Very high | 95.1 | Very high | 21 Ų | 21 | 25.1 Ų | 25.1 | 15% | 0.147 | 12% | 0.121 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 59.6 | 34.9 | 178 | -42.6 | 0 | 0 | 0 | 0 | 113.8 | A226 A227 M228 Y232 K261 | A226-S230 WeakPolarHBondContact O-CA 3.42Å; A226-S230 PolarHBondContact O-N 3.37Å; A227-S230 PolarHBondContact O-N 3.38Å; M228-S230 VanDerWaalsContact C-N 3.31Å; S230-Y232 VanDerWaalsContact C-N 3.29Å; S230-Y232 PolarHBondContact O-N 3.11Å; S230-K261 VanDerWaalsContact OG-CD 3.31Å; S230-K261 WeakPolarHBondContact OG-CD 3.29Å; S230-K261 VanDerWaalsContact OG-CE 3.23Å; S230-K261 WeakPolarHBondContact OG-CE 3.43Å; S230-K261 PolarHBondContact OG-NZ 3.43Å |
| 231 | R | 96.3 | Very high | 94.8 | Very high | 93 Ų | 93 | 26.2 Ų | 26.2 | 35% | 0.351 | 13% | 0.133 | S | C | . | . | trans | -83.3 | 70.3 | -178.5 | -54.5 | -48.5 | -168.6 | 166 | 2.7 | 111 | A188 K189 S190 A226 H229 M233 V234 I235 | A188-R231 VanDerWaalsContact O-CG 3.23Å; A188-R231 WeakPolarHBondContact O-CG 3.05Å; K189-R231 PolarHBondContact O-NE 3.26Å; K189-R231 PolarHBondContact O-NH2 3.3Å; S190-R231 PolarHBondContact O-NE 3.29Å; S190-R231 PolarHBondContact O-NH1 3.19Å; S190-R231 PolarHBondContact O-NH2 3.37Å; A226-R231 HydrophobicContact CB-CB 4.35Å; A226-R231 PolarHBondContact O-N 3.04Å; H229-R231 VanDerWaalsContact C-N 3.3Å; H229-R231 HydrophobicContact CB-CG 3.92Å; H229-R231 PolarHBondContact O-N 3.19Å; R231-M233 VanDerWaalsContact C-N 3.28Å; R231-M233 PolarHBondContact O-N 3.41Å; R231-V234 HydrophobicContact CB-CB 4.09Å; R231-V234 HydrophobicContact CB-CG2 4.28Å; R231-V234 PolarHBondContact O-N 3.41Å; R231-I235 WeakPolarHBondContact O-CG1 3.23Å; R231-I235 PolarHBondContact O-N 3.28Å; R231-I235 VanDerWaalsContact O-N 3.1Å | ||
| 232 | Y | 94.9 | Very high | 94.4 | Very high | 72 Ų | 72 | 27.7 Ų | 27.7 | 28% | 0.282 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -56.3 | -35.4 | -169.8 | -55.7 | -41.4 | 0 | 0 | 0 | 114.5 | S230 I235 K236 A264 P265 M268 | S230-Y232 VanDerWaalsContact C-N 3.29Å; S230-Y232 PolarHBondContact O-N 3.11Å; Y232-I235 HydrophobicContact CD1-CD1 4.45Å; Y232-I235 PolarHBondContact O-N 3.02Å; Y232-K236 WeakPolarHBondContact O-CG 3.48Å; Y232-K236 PolarHBondContact O-N 3.02Å; Y232-K236 VanDerWaalsContact O-N 3.1Å; Y232-A264 HydrophobicContact CE1-CB 4.18Å; Y232-A264 WeakPolarHBondContact OH-CA 3.48Å; Y232-P265 HydrophobicContact CD2-CG 4.18Å; Y232-P265 HydrophobicContact CE1-CG 4.47Å; Y232-P265 HydrophobicContact CE2-CG 4.13Å; Y232-P265 HydrophobicContact CG-CG 4.39Å; Y232-P265 VanDerWaalsContact CZ-CD 3.41Å; Y232-M268 HydrophobicContact CD1-CB 4.46Å; Y232-M268 HydrophobicContact CD1-CE 4.12Å; Y232-M268 HydrophobicContact CD1-CG 3.91Å; Y232-M268 HydrophobicContact CD1-SD 4.48Å; Y232-M268 HydrophobicContact CE1-CG 4.3Å; Y232-M268 HydrophobicContact CG-CE 4.35Å; Y232-M268 WeakPolarHBondContact O-CE 3.43Å |
| 233 | M | 95.3 | Very high | 94.1 | Very high | 73 Ų | 73 | 30 Ų | 30 | 36% | 0.36 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -70.2 | -46.2 | 178.4 | -163.2 | 64.2 | 84.7 | 0 | 0 | 111.8 | D193 R231 I235 K236 I237 F330 | D193-M233 HydrophobicContact CB-CB 4.32Å; D193-M233 HydrophobicContact CB-CG 4.1Å; D193-M233 WeakPolarHBondContact OD2-CG 3.49Å; R231-M233 VanDerWaalsContact C-N 3.28Å; R231-M233 PolarHBondContact O-N 3.41Å; M233-I235 PolarHBondContact O-N 3.22Å; M233-K236 WeakPolarHBondContact O-CB 3.26Å; M233-K236 PolarHBondContact O-N 3.18Å; M233-I237 HydrophobicContact CG-CD1 3.96Å; M233-I237 WeakPolarHBondContact O-CD1 3.44Å; M233-I237 WeakPolarHBondContact O-CG1 3.27Å; M233-I237 PolarHBondContact O-N 3.12Å; M233-F330 HydrophobicContact CE-CZ 4.29Å |
| 234 | V | 96 | Very high | 93.9 | Very high | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -53.6 | -40.4 | 171.4 | 171.8 | 0 | 0 | 0 | 0 | 111.7 | A188 D193 L196 A226 R231 I237 L238 | A188-V234 HydrophobicContact CB-CG1 4.1Å; D193-V234 HydrophobicContact CB-CG2 3.94Å; L196-V234 HydrophobicContact CD2-CB 4.43Å; L196-V234 HydrophobicContact CD2-CG1 3.63Å; L196-V234 HydrophobicContact CD2-CG2 4.3Å; A226-V234 HydrophobicContact CB-CB 4.41Å; A226-V234 HydrophobicContact CB-CG1 3.92Å; R231-V234 HydrophobicContact CB-CB 4.09Å; R231-V234 HydrophobicContact CB-CG2 4.28Å; R231-V234 PolarHBondContact O-N 3.41Å; V234-I237 PolarHBondContact O-N 3.12Å; V234-L238 HydrophobicContact CG1-CD1 3.68Å; V234-L238 HydrophobicContact CG1-CG 4.03Å; V234-L238 WeakPolarHBondContact O-CB 3.37Å; V234-L238 WeakPolarHBondContact O-CG 3.44Å; V234-L238 PolarHBondContact O-N 3.31Å |
| 235 | I | 95.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -65.1 | -45.4 | 176.8 | -58.3 | 165.6 | 0 | 0 | 0 | 111.3 | L223 A226 A227 R231 Y232 M233 I237 L238 V239 L260 M268 L271 L272 | L223-I235 HydrophobicContact CD1-CG2 3.81Å; A226-I235 HydrophobicContact CB-CD1 4.3Å; A226-I235 HydrophobicContact CB-CG1 3.54Å; A227-I235 HydrophobicContact CB-CD1 4.33Å; R231-I235 WeakPolarHBondContact O-CG1 3.23Å; R231-I235 PolarHBondContact O-N 3.28Å; R231-I235 VanDerWaalsContact O-N 3.1Å; Y232-I235 HydrophobicContact CD1-CD1 4.45Å; Y232-I235 PolarHBondContact O-N 3.02Å; M233-I235 PolarHBondContact O-N 3.22Å; I235-I237 PolarHBondContact O-N 3.29Å; I235-L238 PolarHBondContact O-N 3.27Å; I235-V239 HydrophobicContact CG2-CG2 4.2Å; I235-V239 WeakPolarHBondContact O-CG2 3.44Å; I235-V239 PolarHBondContact O-N 3.16Å; I235-L260 HydrophobicContact CD1-CD2 4.38Å; I235-M268 HydrophobicContact CB-CE 4.05Å; I235-M268 HydrophobicContact CB-SD 3.6Å; I235-M268 HydrophobicContact CD1-CE 4.39Å; I235-M268 HydrophobicContact CD1-CG 4.17Å; I235-M268 HydrophobicContact CD1-SD 3.49Å; I235-M268 WeakPolarHBondContact CD1-SD 3.4Å; I235-M268 HydrophobicContact CG1-SD 4.13Å; I235-M268 HydrophobicContact CG2-CE 4.2Å; I235-M268 HydrophobicContact CG2-SD 3.29Å; I235-M268 WeakPolarHBondContact CG2-SD 3.41Å; I235-L271 HydrophobicContact CG2-CD2 4.19Å; I235-L272 HydrophobicContact CG2-CD1 4.25Å; I235-L272 HydrophobicContact CG2-CD2 3.86Å; I235-L272 HydrophobicContact CG2-CG 4.23Å |
| 236 | K | 94.6 | Very high | 93.6 | Very high | 51 Ų | 51 | 35.9 Ų | 35.9 | 22% | 0.222 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.3 | -36.6 | 175.7 | -71.5 | -176.1 | 178.3 | -172.8 | 0 | 112.1 | Y232 M233 G240 E267 M268 L271 F323 | Y232-K236 WeakPolarHBondContact O-CG 3.48Å; Y232-K236 PolarHBondContact O-N 3.02Å; Y232-K236 VanDerWaalsContact O-N 3.1Å; M233-K236 WeakPolarHBondContact O-CB 3.26Å; M233-K236 PolarHBondContact O-N 3.18Å; K236-G240 VanDerWaalsContact O-CA 3.27Å; K236-G240 WeakPolarHBondContact O-CA 3.36Å; K236-G240 PolarHBondContact O-N 2.92Å; K236-E267 WeakPolarHBondContact CE-OE2 3.39Å; K236-E267 IonicContact NZ-OE2 2.65Å; K236-E267 PolarHBondContact NZ-OE2 3.03Å; K236-M268 HydrophobicContact CG-CE 4.15Å; K236-L271 HydrophobicContact CG-CD2 3.95Å; K236-F323 HydrophobicContact CG-CZ 4.32Å |
| 237 | I | 94.9 | Very high | 93.3 | Very high | 13 Ų | 13 | 40.7 Ų | 40.7 | 7% | 0.067 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -72.9 | -52.2 | 177.6 | -70.8 | 157 | 0 | 0 | 0 | 111.8 | D193 I197 M233 V234 I235 V239 G240 A241 F242 | D193-I237 HydrophobicContact CB-CD1 3.3Å; I197-I237 HydrophobicContact CD1-CD1 3.68Å; I197-I237 HydrophobicContact CD1-CG1 4.1Å; I197-I237 HydrophobicContact CG1-CD1 4.04Å; I197-I237 HydrophobicContact CG1-CG1 4.35Å; I197-I237 HydrophobicContact CG1-CG2 3.84Å; M233-I237 HydrophobicContact CG-CD1 3.96Å; M233-I237 WeakPolarHBondContact O-CD1 3.44Å; M233-I237 WeakPolarHBondContact O-CG1 3.27Å; M233-I237 PolarHBondContact O-N 3.12Å; V234-I237 PolarHBondContact O-N 3.12Å; I235-I237 PolarHBondContact O-N 3.29Å; I237-V239 PolarHBondContact O-N 3.41Å; I237-G240 PolarHBondContact O-N 3.47Å; I237-A241 WeakPolarHBondContact O-CB 3.28Å; I237-A241 PolarHBondContact O-N 2.92Å; I237-F242 HydrophobicContact CG2-CD2 3.73Å; I237-F242 HydrophobicContact CG2-CE2 3.56Å; I237-F242 PolarHBondContact O-N 3.45Å |
| 238 | L | 94.1 | Very high | 93.2 | Very high | 1 Ų | 1 | 41.1 Ų | 41.1 | 1% | 0.005 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -57.7 | -46.4 | -179.6 | -75.1 | 174.6 | 0 | 0 | 0 | 111.8 | L196 P222 L223 V234 I235 F242 G243 A244 | L196-L238 HydrophobicContact CD2-CD2 4.2Å; L196-L238 HydrophobicContact CD2-CG 4.29Å; P222-L238 HydrophobicContact CB-CD1 4.04Å; L223-L238 HydrophobicContact CD1-CB 4.26Å; L223-L238 HydrophobicContact CD1-CD1 4.42Å; V234-L238 HydrophobicContact CG1-CD1 3.68Å; V234-L238 HydrophobicContact CG1-CG 4.03Å; V234-L238 WeakPolarHBondContact O-CB 3.37Å; V234-L238 WeakPolarHBondContact O-CG 3.44Å; V234-L238 PolarHBondContact O-N 3.31Å; I235-L238 PolarHBondContact O-N 3.27Å; L238-F242 CarbonylContact O-C 3.57Å; L238-G243 PolarHBondContact O-N 2.92Å; L238-G243 VanDerWaalsContact O-N 3.07Å; L238-A244 HydrophobicContact CB-CB 4Å; L238-A244 VanDerWaalsContact O-CB 3.26Å; L238-A244 WeakPolarHBondContact O-CB 3.3Å; L238-A244 PolarHBondContact O-N 3.26Å |
| 239 | V | 93.6 | Very high | 93.1 | Very high | 19 Ų | 19 | 42.5 Ų | 42.5 | 12% | 0.115 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -78.2 | -43 | -179.7 | -179.2 | 0 | 0 | 0 | 0 | 111.8 | L223 I235 I237 I246 L271 L272 | L223-V239 HydrophobicContact CD1-CG2 3.57Å; L223-V239 HydrophobicContact CD2-CG2 4.2Å; I235-V239 HydrophobicContact CG2-CG2 4.2Å; I235-V239 WeakPolarHBondContact O-CG2 3.44Å; I235-V239 PolarHBondContact O-N 3.16Å; I237-V239 PolarHBondContact O-N 3.41Å; V239-I246 HydrophobicContact CG1-CD1 3.82Å; V239-I246 HydrophobicContact CG1-CG1 4.03Å; V239-I246 HydrophobicContact CG2-CG1 4.31Å; V239-L271 HydrophobicContact CB-CD1 4.21Å; V239-L271 HydrophobicContact CB-CG 4.39Å; V239-L271 HydrophobicContact CG1-CD1 3.7Å; V239-L271 HydrophobicContact CG1-CG 4.22Å; V239-L272 HydrophobicContact CG2-CD2 4.02Å |
| 240 | G | 89.9 | Confident | 93.1 | Very high | 17 Ų | 17 | 39.4 Ų | 39.4 | 18% | 0.175 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -86.5 | -37.7 | -167.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | K236 I237 | K236-G240 VanDerWaalsContact O-CA 3.27Å; K236-G240 WeakPolarHBondContact O-CA 3.36Å; K236-G240 PolarHBondContact O-N 2.92Å; I237-G240 PolarHBondContact O-N 3.47Å |
| 241 | A | 89.1 | Confident | 93.1 | Very high | 44 Ų | 44 | 46.1 Ų | 46.1 | 36% | 0.364 | 24% | 0.24 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -93.8 | -53.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | I237 L331 | I237-A241 WeakPolarHBondContact O-CB 3.28Å; I237-A241 PolarHBondContact O-N 2.92Å; A241-L331 HydrophobicContact CB-CD2 4.2Å |
| 242 | F | 88.2 | Confident | 93 | Very high | 33 Ų | 33 | 47.4 Ų | 47.4 | 15% | 0.145 | 25% | 0.254 | C | S | . | . | S | Bend | trans | -96.9 | 3.1 | -170.3 | -57.6 | -71.4 | 0 | 0 | 0 | 115.1 | L200 E204 V212 I237 L238 A244 | L200-F242 HydrophobicContact CB-CD1 4.2Å; L200-F242 HydrophobicContact CB-CE1 3.53Å; L200-F242 HydrophobicContact CB-CE2 4.1Å; L200-F242 HydrophobicContact CB-CZ 3.47Å; L200-F242 VanDerWaalsContact CB-CZ 3.47Å; L200-F242 HydrophobicContact CD1-CD1 4.06Å; L200-F242 HydrophobicContact CD1-CD2 3.51Å; L200-F242 HydrophobicContact CD1-CE1 4.05Å; L200-F242 HydrophobicContact CD1-CE2 3.48Å; L200-F242 VanDerWaalsContact CD1-CE2 3.48Å; L200-F242 HydrophobicContact CD1-CG 3.81Å; L200-F242 HydrophobicContact CD1-CZ 3.76Å; L200-F242 HydrophobicContact CG-CE1 4.38Å; L200-F242 HydrophobicContact CG-CE2 4.42Å; L200-F242 HydrophobicContact CG-CZ 4.25Å; E204-F242 WeakPolarHBondContact OE1-CE1 3.26Å; V212-F242 HydrophobicContact CG1-CB 4.04Å; I237-F242 HydrophobicContact CG2-CD2 3.73Å; I237-F242 HydrophobicContact CG2-CE2 3.56Å; I237-F242 PolarHBondContact O-N 3.45Å; L238-F242 CarbonylContact O-C 3.57Å; F242-A244 PolarHBondContact O-N 3.07Å |
| 243 | G | 89 | Confident | 92.9 | Very high | 48 Ų | 48 | 46.2 Ų | 46.2 | 50% | 0.495 | 26% | 0.264 | S | S | . | . | trans | 64.7 | 31.6 | 169.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | L238 | L238-G243 PolarHBondContact O-N 2.92Å; L238-G243 VanDerWaalsContact O-N 3.07Å | ||
| 244 | A | 93.4 | Very high | 92.8 | Very high | 7 Ų | 7 | 48.6 Ų | 48.6 | 6% | 0.058 | 27% | 0.269 | C | S | . | . | trans | -54.2 | 142.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | V212 L223 L238 F242 I246 | V212-A244 HydrophobicContact CG2-CB 4.16Å; L223-A244 HydrophobicContact CD2-CB 4.42Å; L238-A244 HydrophobicContact CB-CB 4Å; L238-A244 VanDerWaalsContact O-CB 3.26Å; L238-A244 WeakPolarHBondContact O-CB 3.3Å; L238-A244 PolarHBondContact O-N 3.26Å; F242-A244 PolarHBondContact O-N 3.07Å; A244-I246 PolarHBondContact O-N 3.02Å | ||
| 245 | N | 92.3 | Very high | 92.7 | Very high | 76 Ų | 76 | 49.9 Ų | 49.9 | 41% | 0.406 | 27% | 0.274 | S | S | . | . | trans | -76.8 | 111.1 | -175.1 | -177.2 | 10.8 | 0 | 0 | 0 | 111 | N213 D247 A248 | N213-N245 WeakPolarHBondContact OD1-CB 3.18Å; N213-N245 PolarHBondContact OD1-N 3.19Å; N245-D247 PolarHBondContact OD1-N 3.19Å; N245-D247 VanDerWaalsContact OD1-N 3.08Å; N245-A248 HydrophobicContact CB-CB 4.19Å; N245-A248 VanDerWaalsContact O-CB 3.29Å; N245-A248 WeakPolarHBondContact O-CB 3.44Å; N245-A248 PolarHBondContact O-N 3.31Å | ||
| 246 | I | 92.2 | Very high | 92.5 | Very high | 44 Ų | 44 | 49.9 Ų | 49.9 | 23% | 0.226 | 28% | 0.275 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68 | -36.6 | 178.8 | -58.3 | 160.9 | 0 | 0 | 0 | 111.2 | V239 A244 A248 L271 L272 | V239-I246 HydrophobicContact CG1-CD1 3.82Å; V239-I246 HydrophobicContact CG1-CG1 4.03Å; V239-I246 HydrophobicContact CG2-CG1 4.31Å; A244-I246 PolarHBondContact O-N 3.02Å; I246-A248 PolarHBondContact O-N 3.4Å; I246-L271 WeakPolarHBondContact CD1-O 3.29Å; I246-L272 HydrophobicContact CG2-CB 4.4Å; I246-L272 HydrophobicContact CG2-CD2 4.42Å; I246-L272 VanDerWaalsContact CG2-O 3.31Å; I246-L272 WeakPolarHBondContact CG2-O 3.44Å |
| 247 | D | 90.7 | Very high | 92.4 | Very high | 100 Ų | 100 | 50 Ų | 50 | 54% | 0.535 | 27% | 0.273 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.3 | 5.6 | 179.2 | -65.5 | -69.7 | 0 | 0 | 0 | 113.5 | N245 M249 K255 | N245-D247 PolarHBondContact OD1-N 3.19Å; N245-D247 VanDerWaalsContact OD1-N 3.08Å; D247-M249 PolarHBondContact O-N 3.41Å; D247-K255 IonicContact OD1-NZ 3.92Å; D247-K255 PolarHBondContact OD1-NZ 3.49Å |
| 248 | A | 92.1 | Very high | 92.3 | Very high | 10 Ų | 10 | 53.4 Ų | 53.4 | 8% | 0.083 | 29% | 0.289 | C | S | . | . | trans | -62.4 | 123.7 | 169.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | T221 H224 N245 I246 | T221-A248 HydrophobicContact CG2-CB 4.18Å; H224-A248 PolarHBondContact CE1-O 2.85Å; H224-A248 PolarHBondContact NE2-O 2.96Å; N245-A248 HydrophobicContact CB-CB 4.19Å; N245-A248 VanDerWaalsContact O-CB 3.29Å; N245-A248 WeakPolarHBondContact O-CB 3.44Å; N245-A248 PolarHBondContact O-N 3.31Å; I246-A248 PolarHBondContact O-N 3.4Å | ||
| 249 | M | 93.9 | Very high | 92.2 | Very high | 96 Ų | 96 | 55.8 Ų | 55.8 | 47% | 0.473 | 30% | 0.298 | S | S | . | . | B | Isolated β-bridge | trans | -100.2 | 148.8 | 171.4 | -64.4 | 176.8 | -71.8 | 0 | 0 | 111.3 | K215 D247 R254 K255 | K215-M249 WeakPolarHBondContact CE-O 3.33Å; K215-M249 PolarHBondContact NZ-O 3.08Å; D247-M249 PolarHBondContact O-N 3.41Å; M249-R254 CarbonylContact C-O 3.59Å; M249-R254 WeakPolarHBondContact CA-O 3.39Å; M249-K255 HydrophobicContact CG-CG 4.04Å |
| 250 | D | 94.7 | Very high | 92.2 | Very high | 9 Ų | 9 | 56 Ų | 56 | 5% | 0.048 | 30% | 0.299 | C | S | . | . | trans | -75.8 | -169.4 | 169.2 | 71.8 | 7.1 | 0 | 0 | 0 | 112.6 | L220 N252 G253 R254 Y259 | L220-D250 HydrophobicContact CD2-CB 4Å; D250-N252 VanDerWaalsContact C-N 3.28Å; D250-N252 VanDerWaalsContact OD1-C 3.26Å; D250-N252 VanDerWaalsContact OD1-CA 3.24Å; D250-N252 WeakPolarHBondContact OD1-CA 3.5Å; D250-N252 WeakPolarHBondContact OD1-CB 3.26Å; D250-N252 PolarHBondContact OD1-N 2.85Å; D250-G253 PolarHBondContact O-N 3.47Å; D250-G253 PolarHBondContact OD1-N 3.05Å; D250-R254 PolarHBondContact N-O 3.45Å; D250-R254 PolarHBondContact OD1-N 3.38Å; D250-Y259 PolarHBondContact OD2-OH 3.24Å; D250-Y259 VanDerWaalsContact OD2-OH 3.06Å | ||
| 251 | Y | 95.3 | Very high | 92.1 | Very high | 163 Ų | 163 | 60.9 Ų | 60.9 | 64% | 0.639 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.5 | -10.3 | 175.5 | -59.8 | -22.3 | 0 | 0 | 0 | 113.6 | K215 G218 G219 G253 | K215-Y251 HydrophobicContact CD-CE1 4.31Å; G218-Y251 WeakPolarHBondContact O-CB 3.48Å; G218-Y251 PolarHBondContact O-N 3.32Å; G219-Y251 VanDerWaalsContact CA-CE1 3.45Å; G219-Y251 VanDerWaalsContact N-CD2 3.32Å; G219-Y251 VanDerWaalsContact N-CE2 3.3Å; Y251-G253 VanDerWaalsContact C-N 3.33Å |
| 252 | N | 93.1 | Very high | 91.9 | Very high | 119 Ų | 119 | 62.2 Ų | 62.2 | 64% | 0.636 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.9 | 3.4 | 172.4 | -69 | 93.5 | 0 | 0 | 0 | 112.3 | D250 R254 | D250-N252 VanDerWaalsContact C-N 3.28Å; D250-N252 VanDerWaalsContact OD1-C 3.26Å; D250-N252 VanDerWaalsContact OD1-CA 3.24Å; D250-N252 WeakPolarHBondContact OD1-CA 3.5Å; D250-N252 WeakPolarHBondContact OD1-CB 3.26Å; D250-N252 PolarHBondContact OD1-N 2.85Å; N252-R254 VanDerWaalsContact C-N 3.28Å; N252-R254 HydrophobicContact CB-CG 4.24Å |
| 253 | G | 93.3 | Very high | 91.9 | Very high | 47 Ų | 47 | 68.1 Ų | 68.1 | 49% | 0.485 | 37% | 0.366 | S | S | . | . | S | Bend | trans | 74.7 | 15.5 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | D250 Y251 | D250-G253 PolarHBondContact O-N 3.47Å; D250-G253 PolarHBondContact OD1-N 3.05Å; Y251-G253 VanDerWaalsContact C-N 3.33Å |
| 254 | R | 92.7 | Very high | 91.9 | Very high | 123 Ų | 123 | 66.2 Ų | 66.2 | 46% | 0.464 | 35% | 0.345 | S | S | . | . | trans | -96 | 143.5 | -175.6 | -64.2 | 177.6 | 173.3 | -163 | -2.8 | 111.6 | H224 M249 D250 N252 Q258 Y259 | H224-R254 PolarHBondContact NE2-O 2.9Å; M249-R254 CarbonylContact C-O 3.59Å; M249-R254 WeakPolarHBondContact CA-O 3.39Å; D250-R254 PolarHBondContact N-O 3.45Å; D250-R254 PolarHBondContact OD1-N 3.38Å; N252-R254 VanDerWaalsContact C-N 3.28Å; N252-R254 HydrophobicContact CB-CG 4.24Å; R254-Q258 VanDerWaalsContact CB-OE1 3.24Å; R254-Y259 HydrophobicContact CB-CE2 3.84Å; R254-Y259 WeakPolarHBondContact CD-OH 3.21Å | ||
| 255 | K | 93.6 | Very high | 91.7 | Very high | 27 Ų | 27 | 68.3 Ų | 68.3 | 12% | 0.117 | 36% | 0.359 | C | S | . | . | B | Isolated β-bridge | trans | -90 | 160.2 | 171.3 | -64.6 | -170.7 | -169.4 | 176.5 | 0 | 111 | D247 M249 W257 Q258 D277 | D247-K255 IonicContact OD1-NZ 3.92Å; D247-K255 PolarHBondContact OD1-NZ 3.49Å; M249-K255 HydrophobicContact CG-CG 4.04Å; K255-W257 VanDerWaalsContact C-N 3.26Å; K255-W257 PolarHBondContact O-N 3.14Å; K255-W257 VanDerWaalsContact O-N 3.16Å; K255-Q258 WeakPolarHBondContact O-CB 3.48Å; K255-Q258 PolarHBondContact O-N 3.1Å; K255-Q258 VanDerWaalsContact O-N 3.08Å; K255-D277 WeakPolarHBondContact CD-OD2 3.49Å; K255-D277 VanDerWaalsContact CE-OD2 3.28Å; K255-D277 WeakPolarHBondContact CE-OD2 3.48Å; K255-D277 VanDerWaalsContact NZ-CG 3.29Å; K255-D277 IonicContact NZ-OD1 2.77Å; K255-D277 PolarHBondContact NZ-OD1 3.48Å; K255-D277 IonicContact NZ-OD2 3.03Å; K255-D277 PolarHBondContact NZ-OD2 3.38Å |
| 256 | A | 92.9 | Very high | 91.4 | Very high | 1 Ų | 1 | 70.6 Ų | 70.6 | 1% | 0.008 | 37% | 0.367 | C | S | . | . | G | 310 helix | trans | -55.2 | -34.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | L223 H224 A227 Q258 Y259 L272 | L223-A256 HydrophobicContact CB-CB 4.45Å; L223-A256 HydrophobicContact CD2-CB 4.15Å; L223-A256 HydrophobicContact CG-CB 3.86Å; H224-A256 PolarHBondContact NE2-N 2.95Å; A227-A256 WeakPolarHBondContact CB-O 3.33Å; A256-Q258 PolarHBondContact O-N 3Å; A256-Y259 PolarHBondContact O-N 2.84Å; A256-L272 HydrophobicContact CB-CD1 4.31Å |
| 257 | W | 92.1 | Very high | 91.3 | Very high | 52 Ų | 52 | 73.7 Ų | 73.7 | 20% | 0.197 | 38% | 0.381 | C | S | . | . | G | 310 helix | trans | -62.2 | -30.1 | 179.3 | 72 | -109.2 | 0 | 0 | 0 | 113.5 | K255 Y259 L260 L272 T274 D277 | K255-W257 VanDerWaalsContact C-N 3.26Å; K255-W257 PolarHBondContact O-N 3.14Å; K255-W257 VanDerWaalsContact O-N 3.16Å; W257-Y259 PolarHBondContact O-N 3.43Å; W257-L260 HydrophobicContact CB-CD1 4.48Å; W257-L260 VanDerWaalsContact O-CB 3.3Å; W257-L260 WeakPolarHBondContact O-CB 3.34Å; W257-L260 WeakPolarHBondContact O-CG 3.23Å; W257-L260 PolarHBondContact O-N 3.1Å; W257-L272 HydrophobicContact CB-CB 3.66Å; W257-L272 HydrophobicContact CB-CD1 4.42Å; W257-T274 HydrophobicContact CB-CG2 3.87Å; W257-T274 HydrophobicContact CD2-CG2 3.67Å; W257-T274 HydrophobicContact CE3-CG2 3.63Å; W257-T274 HydrophobicContact CG-CG2 3.82Å; W257-T274 HydrophobicContact CZ3-CG2 4.32Å; W257-D277 HydrophobicContact CZ2-CB 3.83Å; W257-D277 PolarHBondContact NE1-OD2 3.2Å |
| 258 | Q | 92.2 | Very high | 91.4 | Very high | 85 Ų | 85 | 69 Ų | 69 | 40% | 0.397 | 36% | 0.355 | S | S | . | . | G | 310 helix | trans | -72.2 | -9.6 | -178.2 | -62 | 175 | -24.1 | 0 | 0 | 113 | R254 K255 A256 | R254-Q258 VanDerWaalsContact CB-OE1 3.24Å; K255-Q258 WeakPolarHBondContact O-CB 3.48Å; K255-Q258 PolarHBondContact O-N 3.1Å; K255-Q258 VanDerWaalsContact O-N 3.08Å; A256-Q258 PolarHBondContact O-N 3Å |
| 259 | Y | 92.9 | Very high | 91.2 | Very high | 51 Ų | 51 | 71.8 Ų | 71.8 | 20% | 0.2 | 37% | 0.366 | C | S | . | . | G | 310 helix | trans | -97.3 | -1.7 | 173.1 | -74.5 | -79.4 | 0 | 0 | 0 | 113.6 | L220 A227 M228 D250 R254 A256 W257 | L220-Y259 HydrophobicContact CD2-CE2 4.36Å; A227-Y259 CarbonylContact C-O 3.52Å; M228-Y259 HydrophobicContact CG-CD1 3.39Å; M228-Y259 HydrophobicContact CG-CE1 4.17Å; M228-Y259 HydrophobicContact CG-CG 3.64Å; M228-Y259 HydrophobicContact SD-CD1 4.12Å; M228-Y259 HydrophobicContact SD-CE1 4.33Å; D250-Y259 PolarHBondContact OD2-OH 3.24Å; D250-Y259 VanDerWaalsContact OD2-OH 3.06Å; R254-Y259 HydrophobicContact CB-CE2 3.84Å; R254-Y259 WeakPolarHBondContact CD-OH 3.21Å; A256-Y259 PolarHBondContact O-N 2.84Å; W257-Y259 PolarHBondContact O-N 3.43Å |
| 260 | L | 92 | Very high | 90.9 | Very high | 24 Ų | 24 | 71 Ų | 71 | 13% | 0.126 | 36% | 0.361 | C | S | . | . | S | Bend | trans | -66.5 | 140.7 | 169.6 | -64.3 | 176.6 | 0 | 0 | 0 | 110.5 | A227 I235 W257 A264 M268 K269 L272 | A227-L260 HydrophobicContact CB-CD2 3.94Å; A227-L260 HydrophobicContact CB-CG 4.44Å; I235-L260 HydrophobicContact CD1-CD2 4.38Å; W257-L260 HydrophobicContact CB-CD1 4.48Å; W257-L260 VanDerWaalsContact O-CB 3.3Å; W257-L260 WeakPolarHBondContact O-CB 3.34Å; W257-L260 WeakPolarHBondContact O-CG 3.23Å; W257-L260 PolarHBondContact O-N 3.1Å; L260-A264 HydrophobicContact CB-CB 3.94Å; L260-A264 HydrophobicContact CD1-CB 4.38Å; L260-A264 HydrophobicContact CD2-CB 4.31Å; L260-A264 HydrophobicContact CG-CB 4.45Å; L260-M268 HydrophobicContact CD1-CB 4.38Å; L260-M268 HydrophobicContact CD1-CG 3.92Å; L260-M268 HydrophobicContact CD2-CG 3.59Å; L260-M268 HydrophobicContact CG-CG 4.43Å; L260-K269 HydrophobicContact CD1-CG 4.07Å; L260-L272 HydrophobicContact CD1-CD1 4.22Å; L260-L272 HydrophobicContact CD2-CD1 4.31Å; L260-L272 HydrophobicContact CG-CD1 4.34Å |
| 261 | K | 88.8 | Confident | 90.7 | Very high | 120 Ų | 120 | 71.7 Ų | 71.7 | 52% | 0.522 | 36% | 0.364 | S | S | . | . | trans | -68.6 | 151.3 | 170.3 | -63.6 | 173 | -173.2 | 145.3 | 0 | 109.3 | S230 N263 A264 | S230-K261 VanDerWaalsContact OG-CD 3.31Å; S230-K261 WeakPolarHBondContact OG-CD 3.29Å; S230-K261 VanDerWaalsContact OG-CE 3.23Å; S230-K261 WeakPolarHBondContact OG-CE 3.43Å; S230-K261 PolarHBondContact OG-NZ 3.43Å; K261-N263 PolarHBondContact O-N 3.47Å; K261-N263 VanDerWaalsContact O-N 3.14Å; K261-A264 WeakPolarHBondContact O-CB 3.31Å; K261-A264 PolarHBondContact O-N 2.92Å | ||
| 262 | G | 84.6 | Confident | 90.3 | Very high | 71 Ų | 71 | 64 Ų | 64 | 73% | 0.732 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54 | -38.1 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | A264 K269 | G262-A264 PolarHBondContact O-N 2.73Å; G262-K269 PolarHBondContact O-NZ 3.42Å |
| 263 | N | 87.8 | Confident | 89.5 | Confident | 158 Ų | 158 | 59.2 Ų | 59.2 | 85% | 0.845 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.4 | 28.1 | 173.7 | -163.9 | 36.1 | 0 | 0 | 0 | 114 | K261 | K261-N263 PolarHBondContact O-N 3.47Å; K261-N263 VanDerWaalsContact O-N 3.14Å |
| 264 | A | 89.3 | Confident | 88.3 | Confident | 7 Ų | 7 | 57.6 Ų | 57.6 | 6% | 0.058 | 29% | 0.294 | C | S | . | . | S | Bend | trans | -74.9 | 142.1 | 166.7 | 0 | 0 | 0 | 0 | 0 | 110 | Y232 L260 K261 G262 K269 | Y232-A264 HydrophobicContact CE1-CB 4.18Å; Y232-A264 WeakPolarHBondContact OH-CA 3.48Å; L260-A264 HydrophobicContact CB-CB 3.94Å; L260-A264 HydrophobicContact CD1-CB 4.38Å; L260-A264 HydrophobicContact CD2-CB 4.31Å; L260-A264 HydrophobicContact CG-CB 4.45Å; K261-A264 WeakPolarHBondContact O-CB 3.31Å; K261-A264 PolarHBondContact O-N 2.92Å; G262-A264 PolarHBondContact O-N 2.73Å; A264-K269 WeakPolarHBondContact O-CE 3.44Å |
| 265 | P | 89.8 | Confident | 86.6 | Confident | 52 Ų | 52 | 58 Ų | 58 | 34% | 0.338 | 30% | 0.295 | S | S | . | . | trans | -62.4 | 147.2 | 179.3 | 27.4 | -34 | 0 | 0 | 0 | 110.6 | Y232 E267 M268 | Y232-P265 HydrophobicContact CD2-CG 4.18Å; Y232-P265 HydrophobicContact CE1-CG 4.47Å; Y232-P265 HydrophobicContact CE2-CG 4.13Å; Y232-P265 HydrophobicContact CG-CG 4.39Å; Y232-P265 VanDerWaalsContact CZ-CD 3.41Å; P265-E267 VanDerWaalsContact C-N 3.29Å; P265-E267 PolarHBondContact O-N 3.34Å; P265-M268 HydrophobicContact CG-CB 4.11Å; P265-M268 VanDerWaalsContact O-CB 3.28Å; P265-M268 WeakPolarHBondContact O-CB 3.37Å; P265-M268 PolarHBondContact O-N 3.47Å | ||
| 266 | E | 86.6 | Confident | 84.9 | Confident | 124 Ų | 124 | 62.8 Ų | 62.8 | 58% | 0.579 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -61.6 | -36.4 | -173.7 | -165.9 | 156.8 | -154 | 0 | 0 | 112.6 | M268 K269 E270 | E266-M268 PolarHBondContact O-N 2.88Å; E266-K269 WeakPolarHBondContact O-CA 3.48Å; E266-K269 WeakPolarHBondContact O-CB 3.27Å; E266-K269 PolarHBondContact O-N 3.07Å; E266-E270 PolarHBondContact O-N 3.43Å |
| 267 | E | 89.8 | Confident | 83.1 | Confident | 109 Ų | 109 | 64.2 Ų | 64.2 | 51% | 0.509 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -47 | -34.4 | 168.7 | -59.8 | -177.4 | 172.6 | 0 | 0 | 113.6 | K236 P265 L271 | K236-E267 WeakPolarHBondContact CE-OE2 3.39Å; K236-E267 IonicContact NZ-OE2 2.65Å; K236-E267 PolarHBondContact NZ-OE2 3.03Å; P265-E267 VanDerWaalsContact C-N 3.29Å; P265-E267 PolarHBondContact O-N 3.34Å; E267-L271 WeakPolarHBondContact O-CB 3.41Å; E267-L271 PolarHBondContact O-N 3.26Å |
| 268 | M | 91.3 | Very high | 81.2 | Confident | 1 Ų | 1 | 67.5 Ų | 67.5 | 1% | 0.005 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -83.6 | -27.4 | -177.1 | -166.3 | 54.8 | 51 | 0 | 0 | 112.5 | Y232 I235 K236 L260 P265 E266 L271 L272 | Y232-M268 HydrophobicContact CD1-CB 4.46Å; Y232-M268 HydrophobicContact CD1-CE 4.12Å; Y232-M268 HydrophobicContact CD1-CG 3.91Å; Y232-M268 HydrophobicContact CD1-SD 4.48Å; Y232-M268 HydrophobicContact CE1-CG 4.3Å; Y232-M268 HydrophobicContact CG-CE 4.35Å; Y232-M268 WeakPolarHBondContact O-CE 3.43Å; I235-M268 HydrophobicContact CB-CE 4.05Å; I235-M268 HydrophobicContact CB-SD 3.6Å; I235-M268 HydrophobicContact CD1-CE 4.39Å; I235-M268 HydrophobicContact CD1-CG 4.17Å; I235-M268 HydrophobicContact CD1-SD 3.49Å; I235-M268 WeakPolarHBondContact CD1-SD 3.4Å; I235-M268 HydrophobicContact CG1-SD 4.13Å; I235-M268 HydrophobicContact CG2-CE 4.2Å; I235-M268 HydrophobicContact CG2-SD 3.29Å; I235-M268 WeakPolarHBondContact CG2-SD 3.41Å; K236-M268 HydrophobicContact CG-CE 4.15Å; L260-M268 HydrophobicContact CD1-CB 4.38Å; L260-M268 HydrophobicContact CD1-CG 3.92Å; L260-M268 HydrophobicContact CD2-CG 3.59Å; L260-M268 HydrophobicContact CG-CG 4.43Å; P265-M268 HydrophobicContact CG-CB 4.11Å; P265-M268 VanDerWaalsContact O-CB 3.28Å; P265-M268 WeakPolarHBondContact O-CB 3.37Å; P265-M268 PolarHBondContact O-N 3.47Å; E266-M268 PolarHBondContact O-N 2.88Å; M268-L271 HydrophobicContact CE-CD2 4.24Å; M268-L271 HydrophobicContact SD-CD2 4.28Å; M268-L272 WeakPolarHBondContact O-CG 3.26Å; M268-L272 PolarHBondContact O-N 3.2Å; M268-L272 HydrophobicContact SD-CD1 4.43Å; M268-L272 HydrophobicContact SD-CG 4.47Å |
| 269 | K | 88.4 | Confident | 79.2 | Confident | 69 Ų | 69 | 70 Ų | 70 | 30% | 0.3 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -74.1 | -45.8 | 173.4 | -63.3 | 176.5 | -176.4 | 170.8 | 0 | 109.5 | L260 G262 A264 E266 L272 G273 T274 | L260-K269 HydrophobicContact CD1-CG 4.07Å; G262-K269 PolarHBondContact O-NZ 3.42Å; A264-K269 WeakPolarHBondContact O-CE 3.44Å; E266-K269 WeakPolarHBondContact O-CA 3.48Å; E266-K269 WeakPolarHBondContact O-CB 3.27Å; E266-K269 PolarHBondContact O-N 3.07Å; K269-L272 CarbonylContact O-C 3.58Å; K269-L272 PolarHBondContact O-N 3.43Å; K269-G273 PolarHBondContact O-N 3.1Å; K269-G273 VanDerWaalsContact O-N 3.12Å; K269-T274 HydrophobicContact CB-CG2 3.91Å; K269-T274 HydrophobicContact CG-CG2 4.47Å; K269-T274 PolarHBondContact O-N 2.89Å; K269-T274 VanDerWaalsContact O-N 3.12Å; K269-T274 PolarHBondContact O-OG1 3.1Å |
| 270 | E | 87.6 | Confident | 77 | Confident | 79 Ų | 79 | 75.9 Ų | 75.9 | 37% | 0.369 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -54.3 | -54.8 | 168.3 | -73.8 | 178.9 | 179.5 | 0 | 0 | 112.5 | E266 L272 G273 W275 | E266-E270 PolarHBondContact O-N 3.43Å; E270-L272 PolarHBondContact O-N 3.39Å; E270-G273 PolarHBondContact O-N 3.45Å; E270-W275 VanDerWaalsContact CG-NE1 3.35Å |
| 271 | L | 89.9 | Confident | 74.8 | Confident | 23 Ų | 23 | 79 Ų | 79 | 12% | 0.12 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -61.6 | -26.9 | -176.1 | -178.4 | 62.1 | 0 | 0 | 0 | 113.5 | I235 K236 V239 I246 E267 M268 F323 | I235-L271 HydrophobicContact CG2-CD2 4.19Å; K236-L271 HydrophobicContact CG-CD2 3.95Å; V239-L271 HydrophobicContact CB-CD1 4.21Å; V239-L271 HydrophobicContact CB-CG 4.39Å; V239-L271 HydrophobicContact CG1-CD1 3.7Å; V239-L271 HydrophobicContact CG1-CG 4.22Å; I246-L271 WeakPolarHBondContact CD1-O 3.29Å; E267-L271 WeakPolarHBondContact O-CB 3.41Å; E267-L271 PolarHBondContact O-N 3.26Å; M268-L271 HydrophobicContact CE-CD2 4.24Å; M268-L271 HydrophobicContact SD-CD2 4.28Å; L271-F323 HydrophobicContact CD1-CD1 4.32Å; L271-F323 HydrophobicContact CD1-CE1 3.75Å; L271-F323 HydrophobicContact CD1-CE2 4.05Å; L271-F323 HydrophobicContact CD1-CZ 3.61Å; L271-F323 HydrophobicContact CD2-CE2 4.5Å; L271-F323 HydrophobicContact CD2-CZ 3.86Å; L271-F323 HydrophobicContact CG-CZ 4.37Å |
| 272 | L | 86.9 | Confident | 72.7 | Confident | 1 Ų | 1 | 79.2 Ų | 79.2 | 1% | 0.005 | 42% | 0.416 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -103 | 12.8 | 176.9 | -58.8 | -176.9 | 0 | 0 | 0 | 113.9 | L223 A227 I235 V239 I246 A256 W257 L260 M268 K269 E270 | L223-L272 HydrophobicContact CD1-CD2 4.05Å; L223-L272 HydrophobicContact CD2-CD2 4.12Å; L223-L272 HydrophobicContact CG-CD2 4.26Å; A227-L272 HydrophobicContact CB-CD1 4.47Å; I235-L272 HydrophobicContact CG2-CD1 4.25Å; I235-L272 HydrophobicContact CG2-CD2 3.86Å; I235-L272 HydrophobicContact CG2-CG 4.23Å; V239-L272 HydrophobicContact CG2-CD2 4.02Å; I246-L272 HydrophobicContact CG2-CB 4.4Å; I246-L272 HydrophobicContact CG2-CD2 4.42Å; I246-L272 VanDerWaalsContact CG2-O 3.31Å; I246-L272 WeakPolarHBondContact CG2-O 3.44Å; A256-L272 HydrophobicContact CB-CD1 4.31Å; W257-L272 HydrophobicContact CB-CB 3.66Å; W257-L272 HydrophobicContact CB-CD1 4.42Å; L260-L272 HydrophobicContact CD1-CD1 4.22Å; L260-L272 HydrophobicContact CD2-CD1 4.31Å; L260-L272 HydrophobicContact CG-CD1 4.34Å; M268-L272 WeakPolarHBondContact O-CG 3.26Å; M268-L272 PolarHBondContact O-N 3.2Å; M268-L272 HydrophobicContact SD-CD1 4.43Å; M268-L272 HydrophobicContact SD-CG 4.47Å; K269-L272 CarbonylContact O-C 3.58Å; K269-L272 PolarHBondContact O-N 3.43Å; E270-L272 PolarHBondContact O-N 3.39Å |
| 273 | G | 76.9 | Confident | 70.8 | Confident | 19 Ų | 19 | 79 Ų | 79 | 20% | 0.196 | 41% | 0.413 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 79.1 | 25.5 | 163.9 | 0 | 0 | 0 | 0 | 0 | 117 | K269 E270 W275 D276 | K269-G273 PolarHBondContact O-N 3.1Å; K269-G273 VanDerWaalsContact O-N 3.12Å; E270-G273 PolarHBondContact O-N 3.45Å; G273-W275 PolarHBondContact O-N 3.27Å; G273-W275 VanDerWaalsContact O-N 3.16Å; G273-D276 PolarHBondContact O-N 3.34Å |
| 274 | T | 67.8 | Low | 68.8 | Low | 14 Ų | 14 | 78.4 Ų | 78.4 | 9% | 0.086 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -56.1 | -34.2 | -177.8 | 53.8 | 0 | 0 | 0 | 0 | 114.1 | W257 K269 D276 D277 E278 | W257-T274 HydrophobicContact CB-CG2 3.87Å; W257-T274 HydrophobicContact CD2-CG2 3.67Å; W257-T274 HydrophobicContact CE3-CG2 3.63Å; W257-T274 HydrophobicContact CG-CG2 3.82Å; W257-T274 HydrophobicContact CZ3-CG2 4.32Å; K269-T274 HydrophobicContact CB-CG2 3.91Å; K269-T274 HydrophobicContact CG-CG2 4.47Å; K269-T274 PolarHBondContact O-N 2.89Å; K269-T274 VanDerWaalsContact O-N 3.12Å; K269-T274 PolarHBondContact O-OG1 3.1Å; T274-D276 VanDerWaalsContact C-N 3.28Å; T274-D276 PolarHBondContact O-N 3Å; T274-D277 PolarHBondContact O-N 3.2Å; T274-E278 PolarHBondContact O-N 3.12Å |
| 275 | W | 58.4 | Low | 66.4 | Low | 130 Ų | 130 | 86.3 Ų | 86.3 | 49% | 0.492 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.8 | -26.7 | -176.2 | -60.5 | 79.2 | 0 | 0 | 0 | 114.1 | E270 G273 H279 | E270-W275 VanDerWaalsContact CG-NE1 3.35Å; G273-W275 PolarHBondContact O-N 3.27Å; G273-W275 VanDerWaalsContact O-N 3.16Å; W275-H279 PolarHBondContact O-CD2 3Å; W275-H279 VanDerWaalsContact O-CD2 3.29Å |
| 276 | D | 56.7 | Low | 64.5 | Low | 128 Ų | 128 | 90.1 Ų | 90.1 | 68% | 0.684 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -83.4 | -26.7 | 179.2 | -75.1 | -48.7 | 0 | 0 | 0 | 112.9 | G273 T274 | G273-D276 PolarHBondContact O-N 3.34Å; T274-D276 VanDerWaalsContact C-N 3.28Å; T274-D276 PolarHBondContact O-N 3Å |
| 277 | D | 54.7 | Low | 62.4 | Low | 31 Ų | 31 | 89.8 Ų | 89.8 | 17% | 0.166 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -88.3 | -35.4 | -178.6 | -72.1 | -37.2 | 0 | 0 | 0 | 112.5 | K255 W257 T274 H279 R280 S281 | K255-D277 WeakPolarHBondContact CD-OD2 3.49Å; K255-D277 VanDerWaalsContact CE-OD2 3.28Å; K255-D277 WeakPolarHBondContact CE-OD2 3.48Å; K255-D277 VanDerWaalsContact NZ-CG 3.29Å; K255-D277 IonicContact NZ-OD1 2.77Å; K255-D277 PolarHBondContact NZ-OD1 3.48Å; K255-D277 IonicContact NZ-OD2 3.03Å; K255-D277 PolarHBondContact NZ-OD2 3.38Å; W257-D277 HydrophobicContact CZ2-CB 3.83Å; W257-D277 PolarHBondContact NE1-OD2 3.2Å; T274-D277 PolarHBondContact O-N 3.2Å; D277-H279 VanDerWaalsContact C-N 3.32Å; D277-H279 PolarHBondContact O-N 2.97Å; D277-R280 WeakPolarHBondContact O-CB 3.12Å; D277-R280 PolarHBondContact O-N 3.28Å; D277-S281 PolarHBondContact O-N 2.92Å |
| 278 | E | 53.3 | Low | 60.4 | Low | 122 Ų | 122 | 91.3 Ų | 91.3 | 57% | 0.57 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63.9 | -35.4 | 177.4 | -72.6 | -171.1 | 171.4 | 0 | 0 | 112.6 | T274 R280 S281 | T274-E278 PolarHBondContact O-N 3.12Å; E278-R280 PolarHBondContact O-N 3.26Å; E278-S281 PolarHBondContact O-OG 3.29Å |
| 279 | H | 50.2 | Low | 58.4 | Low | 136 Ų | 136 | 98.9 Ų | 98.9 | 63% | 0.63 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -80.3 | 1.6 | 173.4 | -66.8 | -45.1 | 0 | 0 | 0 | 114.3 | W275 D277 | W275-H279 PolarHBondContact O-CD2 3Å; W275-H279 VanDerWaalsContact O-CD2 3.29Å; D277-H279 VanDerWaalsContact C-N 3.32Å; D277-H279 PolarHBondContact O-N 2.97Å |
| 280 | R | 47.3 | Very low | 56.1 | Low | 175 Ų | 175 | 101 Ų | 101 | 66% | 0.66 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -105.1 | -32.9 | 180 | -160.5 | 175.8 | -170.6 | 179.4 | 3.9 | 112.9 | D277 E278 V282 G283 | D277-R280 WeakPolarHBondContact O-CB 3.12Å; D277-R280 PolarHBondContact O-N 3.28Å; E278-R280 PolarHBondContact O-N 3.26Å; R280-V282 VanDerWaalsContact C-N 3.33Å; R280-V282 PolarHBondContact O-N 3.29Å; R280-G283 PolarHBondContact O-N 3.49Å |
| 281 | S | 45.3 | Very low | 54 | Low | 89 Ų | 89 | 102.2 Ų | 102.2 | 62% | 0.622 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -65 | -32 | -178.9 | 62.3 | 0 | 0 | 0 | 0 | 113.8 | D277 E278 G283 | D277-S281 PolarHBondContact O-N 2.92Å; E278-S281 PolarHBondContact O-OG 3.29Å; S281-G283 PolarHBondContact O-N 3.39Å |
| 282 | V | 44.2 | Very low | 51.5 | Low | 126 Ų | 126 | 107.4 Ų | 107.4 | 76% | 0.764 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.4 | -19.5 | -179.6 | -172.1 | 0 | 0 | 0 | 0 | 112.6 | R280 | R280-V282 VanDerWaalsContact C-N 3.33Å; R280-V282 PolarHBondContact O-N 3.29Å |
| 283 | G | 45.3 | Very low | 49.1 | Very low | 65 Ų | 65 | 115.6 Ų | 115.6 | 67% | 0.67 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.3 | 2.1 | -171.4 | 0 | 0 | 0 | 0 | 0 | 117.3 | R280 S281 | R280-G283 PolarHBondContact O-N 3.49Å; S281-G283 PolarHBondContact O-N 3.39Å |
| 284 | Q | 44.5 | Very low | 47.1 | Very low | 147 Ų | 147 | 121.1 Ų | 121.1 | 69% | 0.687 | 67% | 0.669 | S | S | * | * | trans | -135.1 | 62.8 | -172.1 | -67.8 | -164.4 | -37 | 0 | 0 | 114.7 | N286 | Q284-N286 PolarHBondContact O-N 2.93Š| ||
| 285 | Q | 39.6 | Very low | 45.8 | Very low | 173 Ų | 173 | 126 Ų | 126 | 81% | 0.808 | 70% | 0.702 | S | S | * | * | trans | -77 | 99.8 | 156.3 | -67.4 | -168.6 | 8.4 | 0 | 0 | 109.5 | T287 | Q285-T287 PolarHBondContact O-N 3.23Š| ||
| 286 | N | 48.9 | Very low | 44.6 | Very low | 132 Ų | 132 | 129.5 Ų | 129.5 | 71% | 0.706 | 72% | 0.72 | S | S | * | * | trans | -73.3 | 84.3 | 176 | -83.4 | -30.5 | 0 | 0 | 0 | 111.4 | Q284 N288 | Q284-N286 PolarHBondContact O-N 2.93Å; N286-N288 PolarHBondContact O-N 3.29Å | ||
| 287 | T | 44.1 | Very low | 43.3 | Very low | 116 Ų | 116 | 128.6 Ų | 128.6 | 71% | 0.712 | 72% | 0.724 | S | S | * | * | trans | -79 | 32.3 | 177.3 | 46.2 | 0 | 0 | 0 | 0 | 113.9 | Q285 N289 | Q285-T287 PolarHBondContact O-N 3.23Å; T287-N289 PolarHBondContact O-N 3.17Å | ||
| 288 | N | 47.3 | Very low | 42.2 | Very low | 141 Ų | 141 | 135.1 Ų | 135.1 | 75% | 0.754 | 75% | 0.753 | S | S | * | * | trans | -91.5 | 50.8 | -170.5 | -72.1 | -6.8 | 0 | 0 | 0 | 114.2 | N286 | N286-N288 PolarHBondContact O-N 3.29Š| ||
| 289 | N | 49.9 | Very low | 41.1 | Very low | 160 Ų | 160 | 136.4 Ų | 136.4 | 86% | 0.856 | 76% | 0.763 | S | S | * | * | trans | -159.4 | 78 | 156.9 | -146.3 | 0.3 | 0 | 0 | 0 | 116.1 | T287 | T287-N289 PolarHBondContact O-N 3.17Š| ||
| 290 | S | 40.2 | Very low | 40.1 | Very low | 113 Ų | 113 | 135.5 Ų | 135.5 | 79% | 0.79 | 77% | 0.773 | S | S | * | * | trans | -163.8 | 130.7 | 144.2 | 50.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 291 | A | 43.6 | Very low | 39.5 | Very low | 105 Ų | 105 | 134.4 Ų | 134.4 | 87% | 0.868 | 78% | 0.78 | S | S | * | * | trans | -107.2 | 113.8 | 180 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 292 | T | 37.6 | Very low | 39 | Very low | 133 Ų | 133 | 139.6 Ų | 139.6 | 82% | 0.816 | 79% | 0.794 | S | S | * | * | trans | -140.8 | 129.9 | 169.9 | -51 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 293 | L | 35 | Very low | 38.5 | Very low | 173 Ų | 173 | 140.4 Ų | 140.4 | 91% | 0.906 | 79% | 0.79 | S | S | * | * | trans | -89.3 | 125.4 | 178.7 | -69.2 | 119 | 0 | 0 | 0 | 112 | ||||
| 294 | V | 36.3 | Very low | 37.9 | Very low | 134 Ų | 134 | 146.5 Ų | 146.5 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | trans | -147.2 | 132.8 | 151 | -173.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 295 | P | 39.1 | Very low | 37.3 | Very low | 118 Ų | 118 | 146.3 Ų | 146.3 | 77% | 0.766 | 80% | 0.796 | S | S | * | * | trans | -99.2 | 131.1 | -178.7 | 35.3 | -32 | 0 | 0 | 0 | 115.1 | ||||
| 296 | K | 33.4 | Very low | 37.3 | Very low | 203 Ų | 203 | 146 Ų | 146 | 88% | 0.883 | 80% | 0.8 | S | S | * | * | trans | 37.8 | 112.5 | 138 | -165.2 | -179.8 | -176.3 | -177.4 | 0 | 120.9 | ||||
| 297 | S | 29.4 | Very low | 37 | Very low | 108 Ų | 108 | 145.2 Ų | 145.2 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | trans | -149.9 | 106 | 148.8 | 55.8 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 298 | E | 31.2 | Very low | 36.7 | Very low | 168 Ų | 168 | 145.8 Ų | 145.8 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | 90.3 | 119 | 91.8 | -81.8 | -170.4 | 168.5 | 0 | 0 | 115.1 | |||||
| 299 | L | 31.5 | Very low | 35.9 | Very low | 149 Ų | 149 | 149 Ų | 149 | 78% | 0.78 | 81% | 0.808 | S | S | * | * | trans | 53.4 | 108.4 | 146.6 | -61.2 | 169.9 | 0 | 0 | 0 | 121.5 | ||||
| 300 | S | 28.9 | Very low | 35.3 | Very low | 118 Ų | 118 | 149.9 Ų | 149.9 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | -162.6 | 120 | 124.6 | 59.9 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 301 | D | 34.4 | Very low | 35 | Very low | 151 Ų | 151 | 148 Ų | 148 | 81% | 0.807 | 79% | 0.786 | S | S | * | * | trans | -85.2 | 128.3 | 173.7 | -52.3 | -88.5 | 0 | 0 | 0 | 110.7 | ||||
| 302 | E | 34.8 | Very low | 34.8 | Very low | 198 Ų | 198 | 153.3 Ų | 153.3 | 93% | 0.925 | 78% | 0.783 | S | S | * | * | trans | -139.5 | 159.2 | 160.8 | -78 | -155.7 | 145.8 | 0 | 0 | 111.6 | ||||
| 303 | E | 33.5 | Very low | 34.8 | Very low | 144 Ų | 144 | 152.3 Ų | 152.3 | 67% | 0.673 | 78% | 0.777 | S | S | * | * | trans | -80.9 | 164.3 | -161.6 | -82.7 | -175.1 | 73.4 | 0 | 0 | 117.3 | ||||
| 304 | R | 33.1 | Very low | 34.9 | Very low | 193 Ų | 193 | 154.9 Ų | 154.9 | 73% | 0.728 | 78% | 0.775 | S | S | * | * | trans | 72.2 | 144.8 | 155.4 | -71.4 | 158.1 | -138.4 | 166 | 7.5 | 116.6 | ||||
| 305 | D | 31.9 | Very low | 35.1 | Very low | 143 Ų | 143 | 157.3 Ų | 157.3 | 77% | 0.765 | 77% | 0.769 | S | S | * | * | cis | -135.8 | 162.4 | 8.8 | -85.1 | -50.3 | 0 | 0 | 0 | 111.5 | P307 | D305-P307 VanDerWaalsContact O-CD 3.26Å; D305-P307 WeakPolarHBondContact O-CD 3.3Å | ||
| 306 | D | 38.9 | Very low | 35.2 | Very low | 166 Ų | 166 | 159.6 Ų | 159.6 | 89% | 0.888 | 78% | 0.775 | S | S | * | * | trans | -76.7 | 116.4 | 175 | -81.3 | -54.2 | 0 | 0 | 0 | 113.4 | ||||
| 307 | P | 43.4 | Very low | 35.6 | Very low | 115 Ų | 115 | 153.1 Ų | 153.1 | 75% | 0.747 | 77% | 0.766 | S | S | * | * | trans | -85.9 | 114.1 | 164.9 | 33.4 | -29.2 | 0 | 0 | 0 | 110 | D305 Y309 | D305-P307 VanDerWaalsContact O-CD 3.26Å; D305-P307 WeakPolarHBondContact O-CD 3.3Å; P307-Y309 PolarHBondContact O-N 2.99Å; P307-Y309 VanDerWaalsContact O-N 3.09Å | ||
| 308 | V | 37.9 | Very low | 36.2 | Very low | 128 Ų | 128 | 151.4 Ų | 151.4 | 78% | 0.776 | 75% | 0.754 | S | S | * | * | trans | -47.4 | 116.4 | 179.7 | 177.1 | 0 | 0 | 0 | 0 | 111.8 | F310 | V308-F310 VanDerWaalsContact C-N 3.35Å; V308-F310 PolarHBondContact O-N 3Å | ||
| 309 | Y | 29.6 | Very low | 36.9 | Very low | 208 Ų | 208 | 151 Ų | 151 | 82% | 0.816 | 75% | 0.746 | S | S | * | * | trans | -66.3 | 90.4 | 175.6 | -178.6 | -94.5 | 0 | 0 | 0 | 110.4 | P307 D311 | P307-Y309 PolarHBondContact O-N 2.99Å; P307-Y309 VanDerWaalsContact O-N 3.09Å; Y309-D311 HydrophobicContact CE1-CB 4.47Å; Y309-D311 PolarHBondContact O-N 3.13Å | ||
| 310 | F | 37.6 | Very low | 37.8 | Very low | 180 Ų | 180 | 153.4 Ų | 153.4 | 79% | 0.789 | 74% | 0.744 | S | S | * | * | trans | -83.5 | 99.2 | -179.2 | -153.5 | -83.3 | 0 | 0 | 0 | 109.8 | V308 R312 | V308-F310 VanDerWaalsContact C-N 3.35Å; V308-F310 PolarHBondContact O-N 3Å; F310-R312 PolarHBondContact O-N 2.91Å | ||
| 311 | D | 33.5 | Very low | 38.5 | Very low | 74 Ų | 74 | 149.7 Ų | 149.7 | 40% | 0.396 | 73% | 0.725 | S | S | . | * | trans | -52.5 | 108.8 | -177 | 177.6 | 1.6 | 0 | 0 | 0 | 112 | Y309 T313 | Y309-D311 HydrophobicContact CE1-CB 4.47Å; Y309-D311 PolarHBondContact O-N 3.13Å; D311-T313 PolarHBondContact O-N 2.93Å; D311-T313 WeakPolarHBondContact OD1-CB 3.49Å; D311-T313 WeakPolarHBondContact OD1-CG2 3.28Å; D311-T313 PolarHBondContact OD1-N 3.01Å; D311-T313 PolarHBondContact OD1-OG1 3.15Å; D311-T313 PolarHBondContact OD2-OG1 2.96Å | ||
| 312 | R | 39.5 | Very low | 39.1 | Very low | 216 Ų | 216 | 146.1 Ų | 146.1 | 82% | 0.815 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | -3.4 | -172.4 | -130 | 170.5 | 178.3 | 163.9 | -1.9 | 113.6 | F310 | F310-R312 PolarHBondContact O-N 2.91Š|
| 313 | T | 38.5 | Very low | 39.8 | Very low | 111 Ų | 111 | 139.4 Ų | 139.4 | 68% | 0.681 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -17.8 | -176.2 | 66.6 | 0 | 0 | 0 | 0 | 114.3 | D311 | D311-T313 PolarHBondContact O-N 2.93Å; D311-T313 WeakPolarHBondContact OD1-CB 3.49Å; D311-T313 WeakPolarHBondContact OD1-CG2 3.28Å; D311-T313 PolarHBondContact OD1-N 3.01Å; D311-T313 PolarHBondContact OD1-OG1 3.15Å; D311-T313 PolarHBondContact OD2-OG1 2.96Å |
| 314 | R | 36.6 | Very low | 40.7 | Very low | 228 Ų | 228 | 139.1 Ų | 139.1 | 86% | 0.86 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -98.7 | 11.3 | -159.8 | -114.3 | 178.6 | -175.3 | -109.8 | 0.3 | 117.8 | ||
| 315 | R | 39.5 | Very low | 41.7 | Very low | 185 Ų | 185 | 137.6 Ų | 137.6 | 70% | 0.698 | 68% | 0.675 | S | S | * | * | trans | -114.6 | 2 | -173.4 | -135.1 | 179.7 | -173.6 | -169.3 | 1.8 | 118.4 | G317 | R315-G317 PolarHBondContact O-N 2.91Š| ||
| 316 | N | 42.3 | Very low | 42.7 | Very low | 165 Ų | 165 | 137.1 Ų | 137.1 | 88% | 0.882 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.1 | -3.6 | -179.2 | -84.4 | 28.3 | 0 | 0 | 0 | 116.7 | ||
| 317 | G | 42.3 | Very low | 43.2 | Very low | 68 Ų | 68 | 130.1 Ų | 130.1 | 70% | 0.701 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | -23.5 | -173.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | R315 | R315-G317 PolarHBondContact O-N 2.91Š|
| 318 | S | 42 | Very low | 43.6 | Very low | 72 Ų | 72 | 126.9 Ų | 126.9 | 50% | 0.503 | 62% | 0.617 | S | S | . | * | S | Bend | trans | -87.3 | -42.6 | -155.2 | -171.6 | 0 | 0 | 0 | 0 | 115.7 | R320 G321 | S318-R320 PolarHBondContact O-N 3.11Å; S318-G321 PolarHBondContact O-N 3.08Å |
| 319 | W | 45.9 | Very low | 44.3 | Very low | 160 Ų | 160 | 124.8 Ų | 124.8 | 61% | 0.606 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -71.5 | -31.5 | -168 | -78.2 | 49.8 | 0 | 0 | 0 | 114 | G321 S322 F323 | W319-G321 PolarHBondContact O-N 2.71Å; W319-G321 VanDerWaalsContact O-N 3.11Å; W319-S322 PolarHBondContact O-N 2.76Å; W319-F323 PolarHBondContact O-N 3.08Å |
| 320 | R | 49.5 | Very low | 45.4 | Very low | 198 Ų | 198 | 120 Ų | 120 | 75% | 0.747 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -62.9 | -15.6 | 175.1 | -66.8 | -173.7 | -176.7 | -94.8 | 1.9 | 113.4 | S318 K324 | S318-R320 PolarHBondContact O-N 3.11Å; R320-K324 WeakPolarHBondContact O-CD 3.47Å; R320-K324 VanDerWaalsContact O-CG 3.28Å; R320-K324 WeakPolarHBondContact O-CG 3.45Å |
| 321 | G | 42.9 | Very low | 45.8 | Very low | 40 Ų | 40 | 114 Ų | 114 | 41% | 0.412 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -79.4 | -45.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | S318 W319 K325 | S318-G321 PolarHBondContact O-N 3.08Å; W319-G321 PolarHBondContact O-N 2.71Å; W319-G321 VanDerWaalsContact O-N 3.11Å; G321-K325 PolarHBondContact O-N 3.43Å |
| 322 | S | 48.5 | Very low | 46.6 | Very low | 76 Ų | 76 | 114 Ų | 114 | 53% | 0.531 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -76.3 | -40.6 | -175.6 | -62.2 | 0 | 0 | 0 | 0 | 113 | W319 K324 K325 L326 | W319-S322 PolarHBondContact O-N 2.76Å; S322-K324 VanDerWaalsContact C-N 3.31Å; S322-K324 PolarHBondContact O-N 3.4Å; S322-K325 WeakPolarHBondContact O-CB 3.37Å; S322-K325 PolarHBondContact O-N 3.23Å; S322-L326 PolarHBondContact O-N 2.87Å |
| 323 | F | 48.2 | Very low | 47.1 | Very low | 58 Ų | 58 | 111.9 Ų | 111.9 | 25% | 0.254 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -65.1 | -35.9 | 178.4 | -163 | -109.9 | 0 | 0 | 0 | 112 | K236 L271 W319 K325 L326 L327 | K236-F323 HydrophobicContact CG-CZ 4.32Å; L271-F323 HydrophobicContact CD1-CD1 4.32Å; L271-F323 HydrophobicContact CD1-CE1 3.75Å; L271-F323 HydrophobicContact CD1-CE2 4.05Å; L271-F323 HydrophobicContact CD1-CZ 3.61Å; L271-F323 HydrophobicContact CD2-CE2 4.5Å; L271-F323 HydrophobicContact CD2-CZ 3.86Å; L271-F323 HydrophobicContact CG-CZ 4.37Å; W319-F323 PolarHBondContact O-N 3.08Å; F323-K325 PolarHBondContact O-N 3.39Å; F323-L326 PolarHBondContact O-N 3.1Å; F323-L327 HydrophobicContact CD1-CD1 3.82Å; F323-L327 HydrophobicContact CD1-CG 4.41Å; F323-L327 HydrophobicContact CE1-CD1 3.44Å; F323-L327 VanDerWaalsContact CE1-CD1 3.44Å; F323-L327 HydrophobicContact CE1-CG 4.12Å; F323-L327 HydrophobicContact CZ-CD1 4.18Å; F323-L327 HydrophobicContact CZ-CG 4.48Å; F323-L327 PolarHBondContact O-N 3.07Å |
| 324 | K | 52 | Low | 47.7 | Very low | 137 Ų | 137 | 107.9 Ų | 107.9 | 60% | 0.596 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -62.7 | -24.5 | 170.8 | -78.4 | -172.2 | 176.6 | -166.4 | 0 | 113.9 | R320 S322 A328 | R320-K324 WeakPolarHBondContact O-CD 3.47Å; R320-K324 VanDerWaalsContact O-CG 3.28Å; R320-K324 WeakPolarHBondContact O-CG 3.45Å; S322-K324 VanDerWaalsContact C-N 3.31Å; S322-K324 PolarHBondContact O-N 3.4Å; K324-A328 WeakPolarHBondContact O-CA 3.49Å; K324-A328 WeakPolarHBondContact O-CB 3.47Å; K324-A328 PolarHBondContact O-N 2.96Å |
| 325 | K | 55.1 | Low | 48 | Very low | 162 Ų | 162 | 103.6 Ų | 103.6 | 70% | 0.704 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -78.3 | -39.5 | 173 | -70.6 | 179 | 177.7 | -177.5 | 0 | 112.1 | G321 S322 F323 L327 A328 | G321-K325 PolarHBondContact O-N 3.43Å; S322-K325 WeakPolarHBondContact O-CB 3.37Å; S322-K325 PolarHBondContact O-N 3.23Å; F323-K325 PolarHBondContact O-N 3.39Å; K325-L327 VanDerWaalsContact C-N 3.33Å; K325-A328 VanDerWaalsContact O-CB 3.27Å; K325-A328 WeakPolarHBondContact O-CB 3.49Å; K325-A328 PolarHBondContact O-N 3.32Å; K325-A328 VanDerWaalsContact O-N 3.13Å |
| 326 | L | 53.2 | Low | 48.2 | Very low | 133 Ų | 133 | 102.4 Ų | 102.4 | 70% | 0.696 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -66.1 | -36.1 | 173.5 | -68.5 | 174.3 | 0 | 0 | 0 | 112.1 | S322 F323 P329 | S322-L326 PolarHBondContact O-N 2.87Å; F323-L326 PolarHBondContact O-N 3.1Å; L326-P329 WeakPolarHBondContact O-CD 3.23Å |
| 327 | L | 50.1 | Low | 47.9 | Very low | 18 Ų | 18 | 104 Ų | 104 | 9% | 0.094 | 55% | 0.546 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.2 | -5.2 | 170.7 | -73.9 | 178.9 | 0 | 0 | 0 | 114.1 | F323 K325 P329 F330 L331 | F323-L327 HydrophobicContact CD1-CD1 3.82Å; F323-L327 HydrophobicContact CD1-CG 4.41Å; F323-L327 HydrophobicContact CE1-CD1 3.44Å; F323-L327 VanDerWaalsContact CE1-CD1 3.44Å; F323-L327 HydrophobicContact CE1-CG 4.12Å; F323-L327 HydrophobicContact CZ-CD1 4.18Å; F323-L327 HydrophobicContact CZ-CG 4.48Å; F323-L327 PolarHBondContact O-N 3.07Å; K325-L327 VanDerWaalsContact C-N 3.33Å; L327-P329 VanDerWaalsContact C-CD 3.49Å; L327-F330 HydrophobicContact CD2-CB 4.27Å; L327-F330 HydrophobicContact CD2-CD2 4.45Å; L327-F330 CarbonylContact O-C 3.54Å; L327-F330 PolarHBondContact O-N 3.25Å; L327-F330 VanDerWaalsContact O-N 3.08Å; L327-L331 HydrophobicContact CB-CD1 4.02Å; L327-L331 HydrophobicContact CB-CG 4.21Å; L327-L331 WeakPolarHBondContact O-CB 3.33Å; L327-L331 WeakPolarHBondContact O-CG 3.33Å; L327-L331 PolarHBondContact O-N 3.02Å |
| 328 | A | 51.1 | Low | 48.2 | Very low | 48 Ų | 48 | 105.9 Ų | 105.9 | 40% | 0.397 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -57.5 | -38.8 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114 | K324 K325 S332 | K324-A328 WeakPolarHBondContact O-CA 3.49Å; K324-A328 WeakPolarHBondContact O-CB 3.47Å; K324-A328 PolarHBondContact O-N 2.96Å; K325-A328 VanDerWaalsContact O-CB 3.27Å; K325-A328 WeakPolarHBondContact O-CB 3.49Å; K325-A328 PolarHBondContact O-N 3.32Å; K325-A328 VanDerWaalsContact O-N 3.13Å; A328-S332 VanDerWaalsContact O-CB 3.3Å; A328-S332 WeakPolarHBondContact O-CB 3.13Å; A328-S332 PolarHBondContact O-N 3.41Å; A328-S332 PolarHBondContact O-OG 3.47Å |
| 329 | P | 53.2 | Low | 48.5 | Very low | 84 Ų | 84 | 107.6 Ų | 107.6 | 55% | 0.545 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.2 | -46.5 | 172.9 | -22.5 | 34.8 | 0 | 0 | 0 | 112.1 | L326 L327 S332 F333 | L326-P329 WeakPolarHBondContact O-CD 3.23Å; L327-P329 VanDerWaalsContact C-CD 3.49Å; P329-S332 PolarHBondContact O-N 2.86Å; P329-S332 PolarHBondContact O-OG 3.06Å; P329-F333 PolarHBondContact O-N 2.89Å; P329-F333 VanDerWaalsContact O-N 3.11Å |
| 330 | F | 50.9 | Low | 48.7 | Very low | 108 Ų | 108 | 104.7 Ų | 104.7 | 47% | 0.474 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.4 | -44.4 | 177.1 | -77 | -90.1 | 0 | 0 | 0 | 112 | M233 L327 S332 F333 V334 | M233-F330 HydrophobicContact CE-CZ 4.29Å; L327-F330 HydrophobicContact CD2-CB 4.27Å; L327-F330 HydrophobicContact CD2-CD2 4.45Å; L327-F330 CarbonylContact O-C 3.54Å; L327-F330 PolarHBondContact O-N 3.25Å; L327-F330 VanDerWaalsContact O-N 3.08Å; F330-S332 VanDerWaalsContact C-N 3.29Å; F330-S332 PolarHBondContact O-N 3.48Å; F330-F333 WeakPolarHBondContact O-CA 3.31Å; F330-F333 WeakPolarHBondContact O-CB 3.16Å; F330-F333 PolarHBondContact O-N 3.31Å; F330-F333 VanDerWaalsContact O-N 3.08Å; F330-V334 WeakPolarHBondContact O-CG2 3.48Å; F330-V334 PolarHBondContact O-N 2.65Å |
| 331 | L | 47.3 | Very low | 48.6 | Very low | 54 Ų | 54 | 99.2 Ų | 99.2 | 28% | 0.283 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.9 | -30.5 | 175.9 | -67.4 | 170.5 | 0 | 0 | 0 | 112 | A241 L327 F333 V334 N335 | A241-L331 HydrophobicContact CB-CD2 4.2Å; L327-L331 HydrophobicContact CB-CD1 4.02Å; L327-L331 HydrophobicContact CB-CG 4.21Å; L327-L331 WeakPolarHBondContact O-CB 3.33Å; L327-L331 WeakPolarHBondContact O-CG 3.33Å; L327-L331 PolarHBondContact O-N 3.02Å; L331-F333 VanDerWaalsContact C-N 3.29Å; L331-V334 PolarHBondContact O-N 3.18Å; L331-N335 WeakPolarHBondContact O-CB 3.46Å; L331-N335 PolarHBondContact O-N 3.18Å |
| 332 | S | 50.9 | Low | 49 | Very low | 74 Ų | 74 | 102.9 Ų | 102.9 | 52% | 0.517 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -73.1 | -20.8 | 172.7 | 78.9 | 0 | 0 | 0 | 0 | 113.8 | A328 P329 F330 | A328-S332 VanDerWaalsContact O-CB 3.3Å; A328-S332 WeakPolarHBondContact O-CB 3.13Å; A328-S332 PolarHBondContact O-N 3.41Å; A328-S332 PolarHBondContact O-OG 3.47Å; P329-S332 PolarHBondContact O-N 2.86Å; P329-S332 PolarHBondContact O-OG 3.06Å; F330-S332 VanDerWaalsContact C-N 3.29Å; F330-S332 PolarHBondContact O-N 3.48Å |
| 333 | F | 49 | Very low | 49 | Very low | 171 Ų | 171 | 104.7 Ų | 104.7 | 75% | 0.75 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -82.6 | -42.5 | 169.7 | -169.3 | -101.8 | 0 | 0 | 0 | 110.8 | P329 F330 L331 N335 K336 | P329-F333 PolarHBondContact O-N 2.89Å; P329-F333 VanDerWaalsContact O-N 3.11Å; F330-F333 WeakPolarHBondContact O-CA 3.31Å; F330-F333 WeakPolarHBondContact O-CB 3.16Å; F330-F333 PolarHBondContact O-N 3.31Å; F330-F333 VanDerWaalsContact O-N 3.08Å; L331-F333 VanDerWaalsContact C-N 3.29Å; F333-N335 VanDerWaalsContact C-N 3.31Å; F333-N335 PolarHBondContact O-N 2.97Å; F333-K336 PolarHBondContact O-N 3.27Å |
| 334 | V | 51.1 | Low | 49.1 | Very low | 26 Ų | 26 | 108.1 Ų | 108.1 | 16% | 0.158 | 55% | 0.551 | C | S | . | * | H | α-helix | trans | -60.3 | -35.9 | 173.5 | 169.3 | 0 | 0 | 0 | 0 | 112.3 | I197 R201 F330 L331 K336 | I197-V334 HydrophobicContact CG2-CG2 3.95Å; R201-V334 HydrophobicContact CG-CG1 4.42Å; R201-V334 PolarHBondContact NE-O 2.94Å; R201-V334 PolarHBondContact NH2-O 3.06Å; F330-V334 WeakPolarHBondContact O-CG2 3.48Å; F330-V334 PolarHBondContact O-N 2.65Å; L331-V334 PolarHBondContact O-N 3.18Å; V334-K336 VanDerWaalsContact C-N 3.31Å; V334-K336 PolarHBondContact O-N 2.85Å |
| 335 | N | 43.4 | Very low | 48.9 | Very low | 138 Ų | 138 | 105.8 Ų | 105.8 | 74% | 0.738 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.6 | 14.1 | 174.7 | -82.8 | 3.2 | 0 | 0 | 0 | 114.3 | L331 F333 | L331-N335 WeakPolarHBondContact O-CB 3.46Å; L331-N335 PolarHBondContact O-N 3.18Å; F333-N335 VanDerWaalsContact C-N 3.31Å; F333-N335 PolarHBondContact O-N 2.97Å |
| 336 | K | 44 | Very low | 48.3 | Very low | 160 Ų | 160 | 101.2 Ų | 101.2 | 70% | 0.696 | 54% | 0.535 | S | S | * | . | trans | -122.7 | 83.7 | 172.6 | -90.7 | -173.8 | 168.4 | -177.1 | 0 | 111 | F333 V334 | F333-K336 PolarHBondContact O-N 3.27Å; V334-K336 VanDerWaalsContact C-N 3.31Å; V334-K336 PolarHBondContact O-N 2.85Å | ||
| 337 | N | 35.9 | Very low | 47.9 | Very low | 200 Ų | 200 | 98.3 Ų | 98.3 | 100% | 1.07 | 52% | 0.52 | S | S | * | . | trans | 164.9 | 0 | 148.4 | -83.3 | -13 | 0 | 0 | 0 | 107.7 | R201 | R201-N337 PolarHBondContact NH1-O 3.14Å; R201-N337 PolarHBondContact NH2-O 3.18Å |
Retrieved 337 of 337 residues in 233 ms
(Link to these results)