| 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 | 29.6 | Very low | 33.5 | Very low | 217 Ų | 217 | 129.3 Ų | 129.3 | 100% | 1.069 | 85% | 0.847 | S | S | * | * | 0 | 63.2 | 0 | -54.2 | 178.9 | -168.4 | 0 | 0 | 107.4 | |||||
| 2 | E | 33.1 | Very low | 33.4 | Very low | 188 Ų | 188 | 133.5 Ų | 133.5 | 88% | 0.879 | 85% | 0.847 | S | S | * | * | 65.3 | 126.7 | 61.2 | -64.7 | 156.6 | 100.5 | 0 | 0 | 112.2 | |||||
| 3 | G | 35.2 | Very low | 35.1 | Very low | 65 Ų | 65 | 130.9 Ų | 130.9 | 67% | 0.67 | 83% | 0.832 | S | S | * | * | cis | 171.3 | -164.8 | -4.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 4 | T | 41 | Very low | 34.8 | Very low | 145 Ų | 145 | 132.6 Ų | 132.6 | 89% | 0.89 | 83% | 0.829 | S | S | * | * | trans | 61.3 | 113.6 | 160.2 | 38.3 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 5 | A | 37.1 | Very low | 34.6 | Very low | 109 Ų | 109 | 132.8 Ų | 132.8 | 90% | 0.901 | 83% | 0.829 | S | S | * | * | 74 | 165.1 | 126.1 | 0 | 0 | 0 | 0 | 0 | 120.9 | |||||
| 6 | G | 31.3 | Very low | 34.4 | Very low | 77 Ų | 77 | 132.5 Ų | 132.5 | 79% | 0.794 | 83% | 0.826 | S | S | * | * | trans | 122.1 | 64.3 | 161.2 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 7 | I | 37.4 | Very low | 34.2 | Very low | 171 Ų | 171 | 130.4 Ų | 130.4 | 88% | 0.877 | 83% | 0.825 | S | S | * | * | trans | -87.9 | 126.7 | 162.2 | 36.8 | 165.7 | 0 | 0 | 0 | 111.2 | ||||
| 8 | T | 31.1 | Very low | 34 | Very low | 150 Ų | 150 | 127.7 Ų | 127.7 | 92% | 0.92 | 82% | 0.817 | S | S | * | * | trans | -144.6 | 167.2 | 159.1 | 35.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 9 | S | 32.3 | Very low | 33.9 | Very low | 123 Ų | 123 | 130.6 Ų | 130.6 | 86% | 0.86 | 82% | 0.819 | S | S | * | * | trans | -115.7 | -169.6 | -164.8 | -167 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 10 | A | 30.2 | Very low | 33.8 | Very low | 93 Ų | 93 | 129.8 Ų | 129.8 | 77% | 0.769 | 82% | 0.817 | S | S | * | * | trans | 79.2 | 151.5 | 169.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 11 | A | 30 | Very low | 33.8 | Very low | 84 Ų | 84 | 131 Ų | 131 | 69% | 0.694 | 81% | 0.813 | S | S | * | * | cis | -173.3 | 157.8 | -22.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 12 | E | 32.4 | Very low | 33.8 | Very low | 180 Ų | 180 | 129.6 Ų | 129.6 | 84% | 0.841 | 80% | 0.801 | S | S | * | * | trans | 66.4 | 164.8 | 146.3 | -72.8 | -65.8 | 91.8 | 0 | 0 | 120.2 | ||||
| 13 | P | 55.8 | Low | 33.8 | Very low | 100 Ų | 100 | 126.4 Ų | 126.4 | 65% | 0.649 | 79% | 0.79 | S | S | * | * | trans | -123.8 | -113.1 | -144.3 | 41.7 | -25.6 | 0 | 0 | 0 | 115.5 | ||||
| 14 | I | 30.6 | Very low | 33.6 | Very low | 155 Ų | 155 | 128 Ų | 128 | 80% | 0.795 | 79% | 0.791 | S | S | * | * | trans | 82.7 | 134.9 | -171 | -50.9 | 161.4 | 0 | 0 | 0 | 111 | ||||
| 15 | T | 31.8 | Very low | 33.2 | Very low | 135 Ų | 135 | 128.9 Ų | 128.9 | 83% | 0.828 | 79% | 0.789 | S | S | * | * | cis | -120.5 | -138.2 | 36.8 | 60.6 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 16 | T | 30.8 | Very low | 33.1 | Very low | 128 Ų | 128 | 127.5 Ų | 127.5 | 79% | 0.785 | 78% | 0.778 | S | S | * | * | trans | -157.3 | 161.8 | -150.5 | -32.7 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 17 | A | 32 | Very low | 33.1 | Very low | 97 Ų | 97 | 131.3 Ų | 131.3 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | trans | 79.5 | 161.1 | 160 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 18 | A | 30.1 | Very low | 33 | Very low | 82 Ų | 82 | 129.2 Ų | 129.2 | 68% | 0.678 | 79% | 0.787 | S | S | * | * | cis | -148.6 | 134 | -1.7 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 19 | Q | 32.3 | Very low | 33 | Very low | 183 Ų | 183 | 125.2 Ų | 125.2 | 86% | 0.855 | 78% | 0.775 | S | S | * | * | 76.3 | 143.3 | 97.3 | -77.7 | -168.2 | -27.1 | 0 | 0 | 119.7 | |||||
| 20 | S | 31.7 | Very low | 32.9 | Very low | 113 Ų | 113 | 124.3 Ų | 124.3 | 79% | 0.79 | 78% | 0.775 | S | S | * | * | trans | 79.8 | 155.3 | 159 | 77.1 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 21 | H | 33.3 | Very low | 33 | Very low | 157 Ų | 157 | 125.6 Ų | 125.6 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | -166.9 | 174.7 | -52.5 | -134.5 | -104.5 | 0 | 0 | 0 | 110.9 | |||||
| 22 | F | 30.7 | Very low | 33.1 | Very low | 186 Ų | 186 | 128.4 Ų | 128.4 | 82% | 0.816 | 78% | 0.782 | S | S | * | * | trans | 71.6 | 159.4 | 171.9 | -63.4 | -89.6 | 0 | 0 | 0 | 118.7 | ||||
| 23 | D | 33.1 | Very low | 32.9 | Very low | 121 Ų | 121 | 123.2 Ų | 123.2 | 65% | 0.647 | 78% | 0.776 | S | S | * | * | cis | -171.3 | 159.9 | -49.8 | -142.1 | -67.3 | 0 | 0 | 0 | 110.9 | ||||
| 24 | S | 31.8 | Very low | 31.8 | Very low | 98 Ų | 98 | 123.1 Ų | 123.1 | 69% | 0.685 | 78% | 0.784 | S | S | * | * | trans | 60.2 | 154.7 | 148.2 | -78.4 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 25 | L | 31.8 | Very low | 31.9 | Very low | 165 Ų | 165 | 122 Ų | 122 | 86% | 0.864 | 79% | 0.789 | S | S | * | * | cis | -157.6 | 166.5 | -21.9 | -172.6 | 55 | 0 | 0 | 0 | 109.9 | ||||
| 26 | A | 34.6 | Very low | 31.7 | Very low | 80 Ų | 80 | 118.8 Ų | 118.8 | 66% | 0.661 | 78% | 0.784 | S | S | * | * | trans | -72.6 | 174.2 | -170.8 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 27 | T | 31.5 | Very low | 31.7 | Very low | 157 Ų | 157 | 117.4 Ų | 117.4 | 96% | 0.963 | 79% | 0.785 | S | S | * | * | trans | -158.2 | 178.7 | 133.6 | 5.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 28 | S | 35.7 | Very low | 31.6 | Very low | 127 Ų | 127 | 119.2 Ų | 119.2 | 89% | 0.888 | 79% | 0.786 | S | S | * | * | trans | -139.1 | 167 | -153.9 | -175.4 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 29 | G | 31.5 | Very low | 31.5 | Very low | 65 Ų | 65 | 120.4 Ų | 120.4 | 67% | 0.67 | 80% | 0.796 | S | S | * | * | trans | 144.8 | 115.8 | 144.9 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 30 | A | 29.8 | Very low | 31.1 | Very low | 104 Ų | 104 | 115 Ų | 115 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | trans | 62 | 174.5 | 138.1 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 31 | V | 32.5 | Very low | 31.1 | Very low | 121 Ų | 121 | 114.4 Ų | 114.4 | 73% | 0.733 | 79% | 0.792 | S | S | * | * | -173.5 | 157.6 | -67.8 | 139.2 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 32 | T | 31.6 | Very low | 30.8 | Very low | 143 Ų | 143 | 113.3 Ų | 113.3 | 88% | 0.877 | 79% | 0.791 | S | S | * | * | trans | 64.5 | 156 | 173.9 | 40.9 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 33 | G | 28 | Very low | 30.7 | Very low | 70 Ų | 70 | 111.5 Ų | 111.5 | 72% | 0.722 | 78% | 0.783 | S | S | * | * | cis | 171.9 | 139.7 | -11.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 34 | A | 33.1 | Very low | 30.4 | Very low | 98 Ų | 98 | 112.4 Ų | 112.4 | 81% | 0.81 | 78% | 0.783 | S | S | * | * | trans | 59.4 | 133.7 | 142.1 | 0 | 0 | 0 | 0 | 0 | 126.3 | ||||
| 35 | S | 32.4 | Very low | 30.1 | Very low | 131 Ų | 131 | 115.3 Ų | 115.3 | 92% | 0.916 | 79% | 0.786 | S | S | * | * | trans | 66.5 | 152.1 | 147.2 | -58.4 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 36 | G | 27.8 | Very low | 30 | Very low | 69 Ų | 69 | 111.4 Ų | 111.4 | 71% | 0.711 | 78% | 0.778 | S | S | * | * | cis | 158.2 | 157.9 | -11.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 37 | A | 30.9 | Very low | 29.6 | Very low | 98 Ų | 98 | 114.5 Ų | 114.5 | 81% | 0.81 | 79% | 0.788 | S | S | * | * | trans | 69.8 | 159.1 | 163.8 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 38 | T | 28.7 | Very low | 29.3 | Very low | 135 Ų | 135 | 110.4 Ų | 110.4 | 83% | 0.828 | 78% | 0.777 | S | S | * | * | cis | -167.6 | 166.5 | -15.6 | 19.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 39 | A | 28.4 | Very low | 28.8 | Very low | 107 Ų | 107 | 109 Ų | 109 | 88% | 0.884 | 77% | 0.774 | S | S | * | * | trans | 71.2 | 157.8 | 158.8 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 40 | G | 25.3 | Very low | 29.3 | Very low | 70 Ų | 70 | 111.8 Ų | 111.8 | 72% | 0.722 | 78% | 0.78 | S | S | * | * | cis | 157.2 | 140.6 | -13.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 41 | A | 30.1 | Very low | 29.1 | Very low | 101 Ų | 101 | 111 Ų | 111 | 84% | 0.835 | 77% | 0.774 | S | S | * | * | trans | 65.7 | 168 | 171.9 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 42 | D | 27.3 | Very low | 28.8 | Very low | 134 Ų | 134 | 110.3 Ų | 110.3 | 72% | 0.717 | 77% | 0.774 | S | S | * | * | cis | -157.7 | 175.6 | 3.6 | -153.6 | -13.4 | 0 | 0 | 0 | 112.4 | ||||
| 43 | K | 28.1 | Very low | 28.6 | Very low | 147 Ų | 147 | 111.5 Ų | 111.5 | 64% | 0.639 | 78% | 0.775 | S | S | * | * | trans | 73.4 | 123 | 155.3 | -75.6 | -178 | 175.9 | -89.3 | 0 | 119.7 | ||||
| 44 | Q | 27.5 | Very low | 28.5 | Very low | 140 Ų | 140 | 111.9 Ų | 111.9 | 65% | 0.654 | 78% | 0.779 | S | S | * | * | 85.7 | 147.3 | 65.1 | -78.6 | -179.7 | -5.5 | 0 | 0 | 113.3 | |||||
| 45 | Q | 26.3 | Very low | 28.2 | Very low | 159 Ų | 159 | 115.5 Ų | 115.5 | 74% | 0.743 | 79% | 0.785 | S | S | * | * | cis | -178.6 | 161 | -11.3 | 171.8 | 175.9 | 1.4 | 0 | 0 | 109.9 | ||||
| 46 | A | 28.5 | Very low | 27.9 | Very low | 83 Ų | 83 | 112.1 Ų | 112.1 | 69% | 0.686 | 77% | 0.77 | S | S | * | * | trans | 65.8 | 163.9 | 162.6 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 47 | T | 26 | Very low | 27.9 | Very low | 145 Ų | 145 | 113.2 Ų | 113.2 | 89% | 0.89 | 77% | 0.773 | S | S | * | * | cis | -156.8 | 165.9 | -12.1 | 11.9 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 48 | G | 25.1 | Very low | 27.7 | Very low | 71 Ų | 71 | 113.9 Ų | 113.9 | 73% | 0.732 | 77% | 0.766 | S | S | * | * | cis | -174.8 | -165.2 | 8.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 49 | A | 25.8 | Very low | 27.6 | Very low | 98 Ų | 98 | 115.4 Ų | 115.4 | 81% | 0.81 | 77% | 0.766 | S | S | * | * | trans | -98.7 | -164 | -176 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 50 | P | 42.3 | Very low | 27.4 | Very low | 124 Ų | 124 | 117 Ų | 117 | 81% | 0.805 | 76% | 0.76 | S | S | * | * | cis | -143.9 | -152.4 | 7.4 | 46 | -24.4 | 0 | 0 | 0 | 115.5 | ||||
| 51 | A | 26.6 | Very low | 27.4 | Very low | 88 Ų | 88 | 117.4 Ų | 117.4 | 73% | 0.727 | 75% | 0.751 | S | S | * | * | trans | 77.5 | 125.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 52 | S | 25.8 | Very low | 27.2 | Very low | 105 Ų | 105 | 120.3 Ų | 120.3 | 73% | 0.734 | 75% | 0.747 | S | S | * | * | cis | 110.4 | 147.6 | 13 | -65.8 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 53 | D | 26.1 | Very low | 27.5 | Very low | 169 Ų | 169 | 121.2 Ų | 121.2 | 90% | 0.904 | 75% | 0.75 | S | S | * | * | trans | 68.7 | 147 | 171.9 | -51 | -42.2 | 0 | 0 | 0 | 117.1 | ||||
| 54 | G | 26.5 | Very low | 28.1 | Very low | 78 Ų | 78 | 120.2 Ų | 120.2 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | cis | -147.1 | 168.4 | 2.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 55 | N | 26.8 | Very low | 28.1 | Very low | 174 Ų | 174 | 117.2 Ų | 117.2 | 93% | 0.93 | 77% | 0.765 | S | S | * | * | trans | -109.4 | 135.4 | -175.8 | -176.2 | 29.9 | 0 | 0 | 0 | 111.5 | ||||
| 56 | G | 27.1 | Very low | 28.1 | Very low | 59 Ų | 59 | 114.9 Ų | 114.9 | 61% | 0.608 | 77% | 0.766 | S | S | * | * | trans | -177.3 | 132.6 | 172 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 57 | A | 27.4 | Very low | 28.1 | Very low | 93 Ų | 93 | 122.4 Ų | 122.4 | 77% | 0.769 | 78% | 0.777 | S | S | * | * | cis | 72.9 | 134.4 | 41.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 58 | V | 26.1 | Very low | 28.4 | Very low | 111 Ų | 111 | 124.2 Ų | 124.2 | 67% | 0.673 | 78% | 0.776 | S | S | * | * | cis | -167.8 | 167.4 | 4.8 | -113 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 59 | M | 26.2 | Very low | 28.7 | Very low | 167 Ų | 167 | 126.6 Ų | 126.6 | 82% | 0.823 | 78% | 0.781 | S | S | * | * | trans | 69.2 | 163.3 | 144.5 | -75.2 | 158.7 | -165.8 | 0 | 0 | 118.9 | ||||
| 60 | N | 25 | Very low | 28.9 | Very low | 140 Ų | 140 | 129.2 Ų | 129.2 | 75% | 0.749 | 78% | 0.781 | S | S | * | * | cis | -170.4 | 175.3 | -26.3 | -172.4 | 17.6 | 0 | 0 | 0 | 110 | ||||
| 61 | C | 24.4 | Very low | 28.3 | Very low | 80 Ų | 80 | 128.6 Ų | 128.6 | 54% | 0.541 | 78% | 0.78 | S | S | . | * | trans | 87.8 | 125.1 | 150 | -79.9 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 62 | H | 25.7 | Very low | 28.5 | Very low | 162 Ų | 162 | 129.9 Ų | 129.9 | 75% | 0.75 | 78% | 0.784 | S | S | * | * | trans | 71.9 | 109.5 | 136.3 | -67.4 | -46 | 0 | 0 | 0 | 120.7 | ||||
| 63 | I | 33.8 | Very low | 28.9 | Very low | 152 Ų | 152 | 133.7 Ų | 133.7 | 78% | 0.779 | 79% | 0.79 | S | S | * | * | 46 | 126.7 | 57.9 | -76.6 | 178 | 0 | 0 | 0 | 112.3 | |||||
| 64 | P | 41 | Very low | 29 | Very low | 126 Ų | 126 | 132.8 Ų | 132.8 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | cis | -124.6 | 176.6 | 33.5 | 36.4 | -20.2 | 0 | 0 | 0 | 115.4 | ||||
| 65 | G | 27.2 | Very low | 29 | Very low | 77 Ų | 77 | 133.3 Ų | 133.3 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | trans | -136.2 | 177.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 66 | S | 26.9 | Very low | 30.1 | Very low | 110 Ų | 110 | 130.5 Ų | 130.5 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | trans | -154.2 | 120.2 | 166.2 | -168.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 67 | R | 29.3 | Very low | 30.1 | Very low | 241 Ų | 241 | 133.2 Ų | 133.2 | 91% | 0.909 | 78% | 0.783 | S | S | * | * | trans | 56.7 | 151.3 | 154 | -66.9 | -175 | 167.7 | -176.4 | -4.4 | 121.2 | ||||
| 68 | Q | 30.6 | Very low | 30.1 | Very low | 184 Ų | 184 | 136.4 Ų | 136.4 | 86% | 0.86 | 79% | 0.787 | S | S | * | * | trans | -80.9 | 164.2 | -178.7 | -55.2 | 151 | -91.9 | 0 | 0 | 112.3 | ||||
| 69 | S | 31.4 | Very low | 30.1 | Very low | 120 Ų | 120 | 134.6 Ų | 134.6 | 84% | 0.839 | 79% | 0.791 | S | S | * | * | -170.5 | 162.3 | 119 | -94.5 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 70 | D | 30 | Very low | 30.7 | Very low | 153 Ų | 153 | 132 Ų | 132 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | -79.2 | 156.4 | -166.8 | -61 | -83.1 | 0 | 0 | 0 | 117.3 | ||||
| 71 | S | 30.3 | Very low | 30.9 | Very low | 111 Ų | 111 | 131.6 Ų | 131.6 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | -165.2 | 136.3 | 148.4 | -83.8 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 72 | S | 30.2 | Very low | 31.1 | Very low | 116 Ų | 116 | 133.1 Ų | 133.1 | 81% | 0.811 | 80% | 0.801 | S | S | * | * | cis | 93.6 | 147.4 | 48.4 | -68.5 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 73 | Q | 34.8 | Very low | 31.2 | Very low | 184 Ų | 184 | 129.5 Ų | 129.5 | 86% | 0.86 | 80% | 0.799 | S | S | * | * | trans | -69.1 | 148.8 | -174.4 | -55.6 | 170.3 | 6.2 | 0 | 0 | 112.7 | ||||
| 74 | T | 28.5 | Very low | 31.2 | Very low | 151 Ų | 151 | 127.6 Ų | 127.6 | 93% | 0.926 | 80% | 0.8 | S | S | * | * | trans | 177.8 | -175.7 | 134.3 | 24.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 75 | A | 27 | Very low | 31.2 | Very low | 88 Ų | 88 | 127.6 Ų | 127.6 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | trans | -118 | -155 | -179.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 76 | P | 49.4 | Very low | 31.2 | Very low | 116 Ų | 116 | 127.4 Ų | 127.4 | 75% | 0.753 | 80% | 0.797 | S | S | * | * | -122 | -164.4 | -57.3 | 22.7 | -0.7 | 0 | 0 | 0 | 112.2 | |||||
| 77 | V | 27 | Very low | 31.3 | Very low | 115 Ų | 115 | 132.3 Ų | 132.3 | 70% | 0.697 | 81% | 0.805 | S | S | * | * | trans | 105.6 | 124.6 | 150.9 | -175.7 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 78 | N | 26.7 | Very low | 31.6 | Very low | 160 Ų | 160 | 127.2 Ų | 127.2 | 86% | 0.856 | 80% | 0.795 | S | S | * | * | trans | 67.6 | 136.9 | 161.1 | -66.9 | -12.1 | 0 | 0 | 0 | 121.9 | ||||
| 79 | G | 25.9 | Very low | 31.5 | Very low | 73 Ų | 73 | 126.2 Ų | 126.2 | 75% | 0.753 | 79% | 0.793 | S | S | * | * | trans | -107 | -137.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 80 | P | 39 | Very low | 31.4 | Very low | 114 Ų | 114 | 131.4 Ų | 131.4 | 74% | 0.74 | 79% | 0.794 | S | S | * | * | cis | -139.7 | -179.5 | 27.6 | 41.1 | -22.6 | 0 | 0 | 0 | 116.9 | ||||
| 81 | T | 30.4 | Very low | 31.2 | Very low | 131 Ų | 131 | 131.1 Ų | 131.1 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | trans | 62.6 | 149.3 | 155.2 | 42.6 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 82 | S | 27.2 | Very low | 31 | Very low | 111 Ų | 111 | 130.6 Ų | 130.6 | 78% | 0.776 | 80% | 0.795 | S | S | * | * | cis | -157.4 | 153.1 | -15.1 | -148.4 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 83 | A | 29 | Very low | 30.9 | Very low | 87 Ų | 87 | 133 Ų | 133 | 72% | 0.719 | 80% | 0.798 | S | S | * | * | cis | -139.2 | -107.4 | 21 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 84 | S | 32.8 | Very low | 30.4 | Very low | 112 Ų | 112 | 130.2 Ų | 130.2 | 78% | 0.783 | 80% | 0.799 | S | S | * | * | trans | -175.8 | 175 | -143.4 | -113.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 85 | P | 42 | Very low | 30.4 | Very low | 126 Ų | 126 | 127.2 Ų | 127.2 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | cis | -142.2 | 174.2 | -15.6 | 33.3 | -13.6 | 0 | 0 | 0 | 115.7 | ||||
| 86 | G | 27.5 | Very low | 30.5 | Very low | 72 Ų | 72 | 132.5 Ų | 132.5 | 74% | 0.742 | 80% | 0.799 | S | S | * | * | trans | 166.9 | 109.2 | 155.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 87 | F | 27.9 | Very low | 29.5 | Very low | 213 Ų | 213 | 133.8 Ų | 133.8 | 93% | 0.934 | 80% | 0.799 | S | S | * | * | trans | -152.6 | 169.5 | 179.7 | -143 | -97.2 | 0 | 0 | 0 | 114.4 | ||||
| 88 | I | 36.1 | Very low | 30 | Very low | 135 Ų | 135 | 134 Ų | 134 | 69% | 0.692 | 80% | 0.803 | S | S | * | * | trans | -99.3 | 142.3 | -166.9 | -58.7 | 165.8 | 0 | 0 | 0 | 112.8 | ||||
| 89 | I | 27.7 | Very low | 30.1 | Very low | 162 Ų | 162 | 130.9 Ų | 130.9 | 83% | 0.831 | 79% | 0.794 | S | S | * | * | trans | -139.2 | 153.3 | 151.9 | -77.2 | -165 | 0 | 0 | 0 | 110.9 | ||||
| 90 | R | 30.7 | Very low | 30.2 | Very low | 229 Ų | 229 | 132.8 Ų | 132.8 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | trans | -96.5 | 145.4 | 175.3 | -48.6 | 158.4 | 89.8 | -158.4 | 13.1 | 110.7 | ||||
| 91 | T | 25.9 | Very low | 29.9 | Very low | 147 Ų | 147 | 132.3 Ų | 132.3 | 90% | 0.902 | 79% | 0.79 | S | S | * | * | trans | -158.3 | 171.1 | 150.4 | 5.2 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 92 | S | 26.3 | Very low | 30 | Very low | 101 Ų | 101 | 131.6 Ų | 131.6 | 71% | 0.706 | 79% | 0.79 | S | S | * | * | trans | -120 | 175.5 | 177.7 | 54.4 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 93 | L | 26.2 | Very low | 30.1 | Very low | 166 Ų | 166 | 130 Ų | 130 | 87% | 0.869 | 79% | 0.792 | S | S | * | * | trans | 95.9 | 132 | 163.6 | -65.1 | 165.7 | 0 | 0 | 0 | 120.2 | ||||
| 94 | S | 24.9 | Very low | 30.3 | Very low | 126 Ų | 126 | 131.3 Ų | 131.3 | 88% | 0.881 | 80% | 0.796 | S | S | * | * | trans | 74.5 | 161.5 | 150.3 | -142.4 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 95 | A | 29.7 | Very low | 30.3 | Very low | 87 Ų | 87 | 131.6 Ų | 131.6 | 72% | 0.719 | 80% | 0.798 | S | S | * | * | trans | -131.8 | 160.3 | -171.2 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 96 | Q | 27.9 | Very low | 29.8 | Very low | 199 Ų | 199 | 130.8 Ų | 130.8 | 93% | 0.93 | 80% | 0.795 | S | S | * | * | trans | -145.7 | 147.4 | 159.9 | -111.3 | 170.1 | 57.3 | 0 | 0 | 110 | ||||
| 97 | N | 28.7 | Very low | 29.9 | Very low | 144 Ų | 144 | 135.9 Ų | 135.9 | 77% | 0.77 | 80% | 0.799 | S | S | * | * | trans | -96.7 | 160.8 | 179.1 | -142 | 16.4 | 0 | 0 | 0 | 109 | ||||
| 98 | P | 37.8 | Very low | 31.1 | Very low | 118 Ų | 118 | 130.9 Ų | 130.9 | 77% | 0.766 | 79% | 0.789 | S | S | * | * | -142.5 | 160.2 | 108.9 | 33.4 | -17.7 | 0 | 0 | 0 | 116.4 | |||||
| 99 | S | 28.6 | Very low | 31 | Very low | 95 Ų | 95 | 128.3 Ų | 128.3 | 66% | 0.664 | 79% | 0.787 | S | S | * | * | trans | -57 | 165.8 | 169 | 49.4 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 100 | T | 28.8 | Very low | 31.3 | Very low | 113 Ų | 113 | 127.7 Ų | 127.7 | 69% | 0.693 | 78% | 0.781 | S | S | * | * | -168.3 | 156.7 | 54.8 | 47.4 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 101 | S | 31.5 | Very low | 31.5 | Very low | 104 Ų | 104 | 123.9 Ų | 123.9 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | trans | 60.3 | 148.7 | 141.8 | 58.7 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 102 | S | 32.5 | Very low | 31.7 | Very low | 116 Ų | 116 | 122.3 Ų | 122.3 | 81% | 0.811 | 76% | 0.761 | S | S | * | * | cis | -175.7 | 150.2 | -8.6 | 45.9 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 103 | G | 29.9 | Very low | 31.9 | Very low | 78 Ų | 78 | 123.3 Ų | 123.3 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | trans | 94.3 | 153.6 | 154.2 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 104 | S | 33.6 | Very low | 32.9 | Very low | 115 Ų | 115 | 121 Ų | 121 | 80% | 0.804 | 76% | 0.758 | S | S | * | * | cis | -174 | 147.3 | -13.9 | 50.7 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 105 | S | 32.5 | Very low | 33.1 | Very low | 117 Ų | 117 | 120.5 Ų | 120.5 | 82% | 0.818 | 75% | 0.749 | S | S | * | * | trans | 71.4 | 151.5 | 162.9 | -138 | 0 | 0 | 0 | 0 | 118 | ||||
| 106 | S | 31.5 | Very low | 33.1 | Very low | 110 Ų | 110 | 122.8 Ų | 122.8 | 77% | 0.769 | 75% | 0.754 | S | S | * | * | cis | -139 | 168.4 | 8.9 | -61.1 | 0 | 0 | 0 | 0 | 113 | ||||
| 107 | Q | 30 | Very low | 33.4 | Very low | 178 Ų | 178 | 117.6 Ų | 117.6 | 83% | 0.832 | 75% | 0.745 | S | S | * | * | trans | -141.3 | -165.2 | -176.9 | -122.2 | -155.2 | -13.7 | 0 | 0 | 109.2 | ||||
| 108 | P | 51.4 | Low | 33.4 | Very low | 109 Ų | 109 | 118.7 Ų | 118.7 | 71% | 0.708 | 75% | 0.75 | S | S | * | * | cis | -108.4 | -140.5 | -3.9 | 33.9 | -12.4 | 0 | 0 | 0 | 109.7 | ||||
| 109 | A | 35.6 | Very low | 32.9 | Very low | 80 Ų | 80 | 119.6 Ų | 119.6 | 66% | 0.661 | 75% | 0.753 | S | S | * | * | cis | -161.7 | 146.3 | 0.5 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 110 | E | 34.3 | Very low | 33.2 | Very low | 150 Ų | 150 | 125.8 Ų | 125.8 | 70% | 0.701 | 76% | 0.762 | S | S | * | * | cis | -125.6 | -82.6 | -16.2 | -77.3 | 174.3 | 65.4 | 0 | 0 | 109.1 | ||||
| 111 | K | 33.1 | Very low | 33.9 | Very low | 148 Ų | 148 | 125.8 Ų | 125.8 | 64% | 0.643 | 76% | 0.764 | S | S | * | * | -144.5 | 156.2 | -59.5 | -131.5 | 173.8 | 178.3 | 67.7 | 0 | 106 | |||||
| 112 | T | 30.7 | Very low | 35.2 | Very low | 115 Ų | 115 | 126.6 Ų | 126.6 | 71% | 0.706 | 77% | 0.767 | S | S | * | * | cis | -138.9 | -165.9 | 5.9 | -39.3 | 0 | 0 | 0 | 0 | 109 | ||||
| 113 | V | 30.8 | Very low | 35.5 | Very low | 122 Ų | 122 | 127.3 Ų | 127.3 | 74% | 0.739 | 77% | 0.768 | S | S | * | * | trans | -144.1 | 152.2 | -167.4 | 176.9 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 114 | P | 46.8 | Very low | 35.7 | Very low | 117 Ų | 117 | 130.4 Ų | 130.4 | 76% | 0.76 | 77% | 0.771 | S | S | * | * | cis | -128 | 177.2 | 28.5 | 13.3 | 15.1 | 0 | 0 | 0 | 115.6 | ||||
| 115 | T | 30 | Very low | 35.3 | Very low | 116 Ų | 116 | 134.2 Ų | 134.2 | 71% | 0.712 | 78% | 0.777 | S | S | * | * | cis | -159.1 | 143.6 | -9.6 | -110.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 116 | V | 28.7 | Very low | 35.1 | Very low | 135 Ų | 135 | 134.6 Ų | 134.6 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | 47.4 | 123.6 | 159.8 | 175.1 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 117 | A | 35.1 | Very low | 34.8 | Very low | 90 Ų | 90 | 134.8 Ų | 134.8 | 74% | 0.744 | 78% | 0.775 | S | S | * | * | trans | -141.2 | 137.3 | 156.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 118 | L | 27.9 | Very low | 34.7 | Very low | 167 Ų | 167 | 130.5 Ų | 130.5 | 87% | 0.874 | 77% | 0.77 | S | S | * | * | trans | -172.3 | 149.8 | 177.9 | -121.9 | 58.9 | 0 | 0 | 0 | 106.7 | ||||
| 119 | V | 28.1 | Very low | 33.5 | Very low | 136 Ų | 136 | 131.7 Ų | 131.7 | 82% | 0.824 | 77% | 0.771 | S | S | * | * | cis | -156.1 | -169.3 | -7.6 | 91.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 120 | R | 34.2 | Very low | 33.2 | Very low | 226 Ų | 226 | 135.2 Ų | 135.2 | 85% | 0.853 | 77% | 0.773 | S | S | * | * | trans | -159.1 | 153.5 | -172.2 | 159.6 | -176.6 | 166.4 | -151.3 | -1.8 | 109.4 | ||||
| 121 | P | 44.1 | Very low | 32.9 | Very low | 113 Ų | 113 | 132.3 Ų | 132.3 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | cis | -122 | 172.4 | 3.9 | 41.5 | -28.7 | 0 | 0 | 0 | 115.8 | ||||
| 122 | P | 59.2 | Low | 32.9 | Very low | 121 Ų | 121 | 133.1 Ų | 133.1 | 79% | 0.786 | 78% | 0.776 | S | S | * | * | trans | -109.9 | 155.8 | 174.7 | 39 | -31.5 | 0 | 0 | 0 | 115.4 | ||||
| 123 | P | 37.5 | Very low | 32.8 | Very low | 130 Ų | 130 | 132.4 Ų | 132.4 | 84% | 0.844 | 78% | 0.776 | S | S | * | * | trans | -109.6 | -172.3 | 163.2 | 40.7 | -30.5 | 0 | 0 | 0 | 113 | ||||
| 124 | V | 35.1 | Very low | 32.7 | Very low | 143 Ų | 143 | 132.4 Ų | 132.4 | 87% | 0.867 | 78% | 0.776 | S | S | * | * | trans | -109.9 | 124.4 | -176 | -78.7 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 125 | Q | 25.5 | Very low | 32 | Very low | 196 Ų | 196 | 133.4 Ų | 133.4 | 92% | 0.916 | 78% | 0.775 | S | S | * | * | -171.4 | 170.5 | 127.2 | -113.9 | -179.8 | -19 | 0 | 0 | 112.9 | |||||
| 126 | T | 27.8 | Very low | 32.2 | Very low | 124 Ų | 124 | 133 Ų | 133 | 76% | 0.761 | 78% | 0.777 | S | S | * | * | trans | -86.6 | 145.5 | -171.5 | 19.3 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 127 | S | 24.9 | Very low | 33.2 | Very low | 114 Ų | 114 | 131.9 Ų | 131.9 | 80% | 0.797 | 77% | 0.772 | S | S | * | * | 164.9 | 156.1 | 114.3 | -73.1 | 0 | 0 | 0 | 0 | 116.1 | |||||
| 128 | A | 27.8 | Very low | 33 | Very low | 88 Ų | 88 | 133.9 Ų | 133.9 | 73% | 0.727 | 77% | 0.771 | S | S | * | * | trans | 86.6 | 137.7 | 146.9 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 129 | N | 26.9 | Very low | 33.1 | Very low | 135 Ų | 135 | 131.4 Ų | 131.4 | 72% | 0.722 | 76% | 0.763 | S | S | * | * | trans | 58.4 | 135.9 | 163.9 | -68.9 | 40 | 0 | 0 | 0 | 118.4 | ||||
| 130 | E | 28.2 | Very low | 33.1 | Very low | 153 Ų | 153 | 130.3 Ų | 130.3 | 72% | 0.715 | 76% | 0.756 | S | S | * | * | cis | -165.7 | 176 | -0.1 | -125.5 | -168.3 | 87.9 | 0 | 0 | 109.7 | ||||
| 131 | S | 29.3 | Very low | 32.8 | Very low | 89 Ų | 89 | 126.4 Ų | 126.4 | 62% | 0.622 | 75% | 0.751 | S | S | * | * | cis | -132 | -163.7 | 0.8 | -53.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 132 | Q | 31.9 | Very low | 32.1 | Very low | 166 Ų | 166 | 125.9 Ų | 125.9 | 78% | 0.776 | 75% | 0.75 | S | S | * | * | cis | -158.6 | 141.9 | 6 | -163 | 171.5 | 56.2 | 0 | 0 | 109.3 | ||||
| 133 | S | 28.5 | Very low | 30.7 | Very low | 100 Ų | 100 | 125.8 Ų | 125.8 | 70% | 0.699 | 75% | 0.752 | S | S | * | * | trans | 58.9 | 143.5 | 164.6 | 45.1 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 134 | T | 30.1 | Very low | 30.3 | Very low | 121 Ų | 121 | 123.2 Ų | 123.2 | 74% | 0.742 | 75% | 0.749 | S | S | * | * | cis | -159.6 | 148.7 | -4.4 | 12.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 135 | D | 30.7 | Very low | 29.9 | Very low | 139 Ų | 139 | 123 Ų | 123 | 74% | 0.743 | 75% | 0.754 | S | S | * | * | trans | 48.3 | 97.1 | 153.8 | -57.5 | -46.6 | 0 | 0 | 0 | 123.5 | ||||
| 136 | S | 34.9 | Very low | 30 | Very low | 107 Ų | 107 | 116.9 Ų | 116.9 | 75% | 0.748 | 74% | 0.744 | S | S | * | * | 34.2 | 156.8 | 103.1 | -50.9 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 137 | P | 50.2 | Low | 29.9 | Very low | 111 Ų | 111 | 116.2 Ų | 116.2 | 72% | 0.721 | 74% | 0.744 | S | S | * | * | cis | -124.7 | -171.4 | -39.7 | 39 | -21.5 | 0 | 0 | 0 | 110.2 | ||||
| 138 | N | 29.9 | Very low | 30.1 | Very low | 133 Ų | 133 | 117 Ų | 117 | 71% | 0.711 | 74% | 0.744 | S | S | * | * | cis | -174.4 | 140.4 | 42 | -135.2 | -11.7 | 0 | 0 | 0 | 111.8 | ||||
| 139 | T | 29.7 | Very low | 30 | Very low | 115 Ų | 115 | 118 Ų | 118 | 71% | 0.706 | 75% | 0.746 | S | S | * | * | 61.8 | 130.7 | 122.1 | -71.5 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 140 | V | 28 | Very low | 29.8 | Very low | 112 Ų | 112 | 117 Ų | 117 | 68% | 0.679 | 75% | 0.748 | S | S | * | * | cis | -172.4 | 166.4 | -3.8 | 76 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 141 | L | 28.1 | Very low | 29.8 | Very low | 145 Ų | 145 | 119 Ų | 119 | 76% | 0.759 | 75% | 0.754 | S | S | * | * | trans | 65.2 | 133.3 | 162 | -63.1 | 176.8 | 0 | 0 | 0 | 118.3 | ||||
| 142 | S | 29.7 | Very low | 29.7 | Very low | 101 Ų | 101 | 119.8 Ų | 119.8 | 71% | 0.706 | 76% | 0.755 | S | S | * | * | 78.9 | 140.6 | 52.3 | -69.9 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 143 | S | 29.5 | Very low | 29.3 | Very low | 119 Ų | 119 | 120.4 Ų | 120.4 | 83% | 0.832 | 76% | 0.758 | S | S | * | * | cis | -169.3 | 154 | -8.4 | -88.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 144 | G | 28.8 | Very low | 29.4 | Very low | 76 Ų | 76 | 119.9 Ų | 119.9 | 78% | 0.784 | 76% | 0.76 | S | S | * | * | trans | 115.1 | 126.4 | 144.4 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 145 | S | 27.2 | Very low | 29.4 | Very low | 138 Ų | 138 | 119.2 Ų | 119.2 | 97% | 0.965 | 76% | 0.756 | S | S | * | * | trans | 44.1 | 135.4 | 139.6 | -155.1 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 146 | G | 27.7 | Very low | 29.5 | Very low | 68 Ų | 68 | 121.9 Ų | 121.9 | 70% | 0.701 | 76% | 0.761 | S | S | * | * | trans | 147.2 | 90 | 147 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 147 | S | 26.9 | Very low | 29.3 | Very low | 111 Ų | 111 | 121.8 Ų | 121.8 | 78% | 0.776 | 76% | 0.76 | S | S | * | * | 42.9 | 121.8 | 126.3 | -172.9 | 0 | 0 | 0 | 0 | 123.5 | |||||
| 148 | V | 28 | Very low | 28.3 | Very low | 131 Ų | 131 | 123.7 Ų | 123.7 | 79% | 0.794 | 76% | 0.762 | S | S | * | * | trans | 83.8 | 105.6 | 139.9 | 170.1 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 149 | S | 26.3 | Very low | 28.3 | Very low | 108 Ų | 108 | 123.2 Ų | 123.2 | 76% | 0.755 | 77% | 0.765 | S | S | * | * | trans | 72.6 | 164.6 | 130.7 | -151.4 | 0 | 0 | 0 | 0 | 124 | ||||
| 150 | C | 22.9 | Very low | 28.5 | Very low | 114 Ų | 114 | 126.5 Ų | 126.5 | 77% | 0.77 | 77% | 0.772 | S | S | * | * | trans | 73.7 | 89.8 | 161.6 | -66.3 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 151 | K | 27.1 | Very low | 28.7 | Very low | 196 Ų | 196 | 125.7 Ų | 125.7 | 85% | 0.852 | 78% | 0.777 | S | S | * | * | 14.4 | 141.4 | 127.3 | -152.4 | -167.6 | -179.3 | -177.1 | 0 | 120.7 | |||||
| 152 | T | 27.3 | Very low | 28.8 | Very low | 105 Ų | 105 | 122.3 Ų | 122.3 | 64% | 0.644 | 78% | 0.777 | S | S | * | * | trans | 99.2 | 126.7 | 147.2 | -6.6 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 153 | E | 24.3 | Very low | 28.9 | Very low | 179 Ų | 179 | 121.8 Ų | 121.8 | 84% | 0.836 | 78% | 0.779 | S | S | * | * | trans | 52.3 | 104.8 | 153 | -84.1 | 169.5 | 94.6 | 0 | 0 | 124.7 | ||||
| 154 | A | 29.5 | Very low | 28.9 | Very low | 88 Ų | 88 | 124.3 Ų | 124.3 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | 32.8 | 143.5 | 122.5 | 0 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 155 | T | 30.2 | Very low | 28.9 | Very low | 108 Ų | 108 | 127 Ų | 127 | 66% | 0.663 | 78% | 0.778 | S | S | * | * | 157.7 | 123.9 | 109 | -69.9 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 156 | K | 33.6 | Very low | 29 | Very low | 195 Ų | 195 | 127.7 Ų | 127.7 | 85% | 0.848 | 77% | 0.77 | S | S | * | * | trans | 69.6 | 159.8 | 153 | -79 | 169.6 | -160.3 | 165.4 | 0 | 119.8 | ||||
| 157 | S | 30.6 | Very low | 30.1 | Very low | 105 Ų | 105 | 129.6 Ų | 129.6 | 73% | 0.734 | 77% | 0.771 | S | S | * | * | cis | -167.8 | -159.1 | -14 | -172 | 0 | 0 | 0 | 0 | 110 | ||||
| 158 | I | 30.1 | Very low | 30.2 | Very low | 150 Ų | 150 | 130.4 Ų | 130.4 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | trans | 85.2 | 118.5 | 164.3 | -72 | 169.7 | 0 | 0 | 0 | 113.4 | ||||
| 159 | T | 29.6 | Very low | 30.3 | Very low | 124 Ų | 124 | 127.7 Ų | 127.7 | 76% | 0.761 | 77% | 0.774 | S | S | * | * | cis | -154 | 171.7 | 14.8 | -3.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 160 | Q | 33.1 | Very low | 30.4 | Very low | 184 Ų | 184 | 128.9 Ų | 128.9 | 86% | 0.86 | 78% | 0.777 | S | S | * | * | cis | -144.8 | -76.9 | 2.6 | -170.3 | 178.1 | 3 | 0 | 0 | 114.6 | ||||
| 161 | A | 33.2 | Very low | 30.8 | Very low | 94 Ų | 94 | 130.6 Ų | 130.6 | 78% | 0.777 | 78% | 0.778 | S | S | * | * | trans | -156.1 | 163 | -160.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 162 | G | 28.5 | Very low | 30.8 | Very low | 74 Ų | 74 | 127 Ų | 127 | 76% | 0.763 | 77% | 0.772 | S | S | * | * | cis | 149.9 | 168.6 | -1.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 163 | A | 32.4 | Very low | 31 | Very low | 90 Ų | 90 | 126.3 Ų | 126.3 | 74% | 0.744 | 78% | 0.778 | S | S | * | * | cis | -165.7 | 150.5 | -13 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 164 | Q | 28.8 | Very low | 31.4 | Very low | 173 Ų | 173 | 123.8 Ų | 123.8 | 81% | 0.808 | 78% | 0.775 | S | S | * | * | trans | 44.1 | 131.9 | 135.5 | -64.1 | -72.8 | -2.5 | 0 | 0 | 122.4 | ||||
| 165 | V | 28.5 | Very low | 31.5 | Very low | 131 Ų | 131 | 126.5 Ų | 126.5 | 79% | 0.794 | 77% | 0.774 | S | S | * | * | 169.6 | 148.8 | 118 | 154.5 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 166 | L | 30.6 | Very low | 31.6 | Very low | 153 Ų | 153 | 131.4 Ų | 131.4 | 80% | 0.801 | 78% | 0.78 | S | S | * | * | trans | -126.5 | -179.7 | 175.5 | -102.9 | 85 | 0 | 0 | 0 | 108.4 | ||||
| 167 | P | 50.3 | Low | 31.3 | Very low | 109 Ų | 109 | 129.4 Ų | 129.4 | 71% | 0.708 | 78% | 0.779 | S | S | * | * | cis | -136.3 | -172 | -12.6 | 36.2 | -15.9 | 0 | 0 | 0 | 115 | ||||
| 168 | S | 29.6 | Very low | 32.6 | Very low | 128 Ų | 128 | 128.8 Ų | 128.8 | 90% | 0.895 | 77% | 0.772 | S | S | * | * | trans | 76.2 | 152.4 | 144.1 | -150.1 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 169 | G | 29 | Very low | 32.8 | Very low | 73 Ų | 73 | 127.6 Ų | 127.6 | 75% | 0.753 | 77% | 0.772 | S | S | * | * | trans | 133.4 | 87.4 | 160.1 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 170 | V | 30.2 | Very low | 33 | Very low | 134 Ų | 134 | 127.2 Ų | 127.2 | 81% | 0.812 | 77% | 0.769 | S | S | * | * | trans | -37.5 | 143.6 | 167.5 | 175.8 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 171 | L | 29.5 | Very low | 32.9 | Very low | 150 Ų | 150 | 124.9 Ų | 124.9 | 79% | 0.785 | 76% | 0.762 | S | S | * | * | -179.6 | 121.7 | 125.6 | -95.4 | 174 | 0 | 0 | 0 | 116.7 | |||||
| 172 | T | 28.2 | Very low | 32.9 | Very low | 119 Ų | 119 | 127.7 Ų | 127.7 | 73% | 0.73 | 76% | 0.759 | S | S | * | * | trans | 33.5 | 144.1 | 143.3 | 54.5 | 0 | 0 | 0 | 0 | 126.3 | ||||
| 173 | A | 30.3 | Very low | 33 | Very low | 92 Ų | 92 | 130 Ų | 130 | 76% | 0.76 | 75% | 0.754 | S | S | * | * | trans | 84.6 | 149.9 | 142.7 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 174 | T | 32.8 | Very low | 32.9 | Very low | 126 Ų | 126 | 133.9 Ų | 133.9 | 77% | 0.773 | 76% | 0.759 | S | S | * | * | cis | -170.2 | 131.9 | -16.6 | -95.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 175 | M | 32.4 | Very low | 33 | Very low | 144 Ų | 144 | 136.8 Ų | 136.8 | 71% | 0.709 | 76% | 0.762 | S | S | * | * | trans | 72.1 | 139.3 | 150.7 | -74.3 | -80.1 | 170.1 | 0 | 0 | 126.6 | ||||
| 176 | R | 31.6 | Very low | 33.2 | Very low | 212 Ų | 212 | 135.7 Ų | 135.7 | 80% | 0.8 | 76% | 0.756 | S | S | * | * | trans | 69.9 | 121.4 | 146.1 | -65.1 | 157.4 | -161.2 | -179.6 | 2.8 | 119.4 | ||||
| 177 | N | 27.7 | Very low | 33 | Very low | 153 Ų | 153 | 135.5 Ų | 135.5 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | cis | 76.8 | 148.7 | 25.7 | -141.5 | 21.5 | 0 | 0 | 0 | 113.6 | ||||
| 178 | P | 57.6 | Low | 32.1 | Very low | 91 Ų | 91 | 138 Ų | 138 | 59% | 0.591 | 77% | 0.768 | S | S | * | * | cis | -147.8 | -166 | 6 | 40.9 | -17.3 | 0 | 0 | 0 | 118.9 | ||||
| 179 | T | 35.1 | Very low | 31.9 | Very low | 125 Ų | 125 | 136.8 Ų | 136.8 | 77% | 0.767 | 76% | 0.76 | S | S | * | * | trans | 73 | 151.2 | 148.3 | 42.6 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 180 | V | 33.3 | Very low | 31.8 | Very low | 116 Ų | 116 | 137.9 Ų | 137.9 | 70% | 0.703 | 76% | 0.756 | S | S | * | * | cis | -174 | 168.3 | -15.5 | 67.3 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 181 | L | 31.9 | Very low | 31.8 | Very low | 135 Ų | 135 | 137.8 Ų | 137.8 | 71% | 0.707 | 76% | 0.755 | S | S | * | * | trans | 72.4 | 159.8 | 162.8 | -59.6 | 175.3 | 0 | 0 | 0 | 118.2 | ||||
| 182 | Q | 31.8 | Very low | 31.8 | Very low | 153 Ų | 153 | 138 Ų | 138 | 72% | 0.715 | 76% | 0.756 | S | S | * | * | cis | -156.5 | 144.9 | 0.6 | -134.2 | 163.7 | 22.1 | 0 | 0 | 116 | ||||
| 183 | N | 30.9 | Very low | 31.7 | Very low | 124 Ų | 124 | 137.5 Ų | 137.5 | 66% | 0.663 | 76% | 0.757 | S | S | * | * | trans | 33.5 | 128.5 | 142.6 | -68.9 | 16.7 | 0 | 0 | 0 | 127.8 | ||||
| 184 | M | 31.3 | Very low | 31.5 | Very low | 170 Ų | 170 | 137.7 Ų | 137.7 | 84% | 0.837 | 76% | 0.759 | S | S | * | * | trans | 65.2 | 154.6 | 135.7 | -52.2 | -62.5 | 157.4 | 0 | 0 | 119.7 | ||||
| 185 | R | 29.8 | Very low | 31.2 | Very low | 234 Ų | 234 | 136 Ų | 136 | 88% | 0.883 | 76% | 0.757 | S | S | * | * | cis | -159 | 177.1 | 20.5 | -153.6 | -170 | 174.5 | 162.7 | 0.4 | 112.6 | ||||
| 186 | T | 32.6 | Very low | 32.1 | Very low | 109 Ų | 109 | 134.9 Ų | 134.9 | 67% | 0.669 | 76% | 0.761 | S | S | * | * | trans | -66 | 159 | 176 | 54 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 187 | T | 26.8 | Very low | 32.4 | Very low | 148 Ų | 148 | 130.7 Ų | 130.7 | 91% | 0.908 | 76% | 0.761 | S | S | * | * | -164.1 | 173.2 | 126.9 | 15.3 | 0 | 0 | 0 | 0 | 114 | |||||
| 188 | L | 31.1 | Very low | 32.5 | Very low | 161 Ų | 161 | 127.2 Ų | 127.2 | 84% | 0.843 | 76% | 0.762 | S | S | * | * | trans | -122.4 | 161.7 | -176.3 | -73.7 | 166.3 | 0 | 0 | 0 | 112.9 | ||||
| 189 | S | 25.9 | Very low | 31.1 | Very low | 104 Ų | 104 | 126 Ų | 126 | 73% | 0.727 | 77% | 0.766 | S | S | * | * | trans | 78.7 | 130.3 | 143.8 | -69.6 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 190 | S | 27.6 | Very low | 31 | Very low | 96 Ų | 96 | 127.4 Ų | 127.4 | 67% | 0.671 | 77% | 0.767 | S | S | * | * | trans | 83.8 | 115.1 | 133 | -64 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 191 | T | 28.6 | Very low | 30.9 | Very low | 131 Ų | 131 | 132.2 Ų | 132.2 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | 69 | 159.6 | 139.4 | 61.6 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 192 | I | 30.5 | Very low | 30.8 | Very low | 156 Ų | 156 | 131.2 Ų | 131.2 | 80% | 0.8 | 77% | 0.772 | S | S | * | * | cis | -141.2 | 147.4 | 30.4 | -71.3 | 173 | 0 | 0 | 0 | 113.9 | ||||
| 193 | S | 25.9 | Very low | 30.8 | Very low | 107 Ų | 107 | 131.1 Ų | 131.1 | 75% | 0.748 | 78% | 0.775 | S | S | * | * | trans | -19.6 | 140.9 | 159.4 | -166.3 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 194 | A | 25.8 | Very low | 30.6 | Very low | 96 Ų | 96 | 129.1 Ų | 129.1 | 79% | 0.793 | 78% | 0.776 | S | S | * | * | trans | -162 | 113.3 | 134.1 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 195 | A | 27.2 | Very low | 31.1 | Very low | 90 Ų | 90 | 126.6 Ų | 126.6 | 74% | 0.744 | 77% | 0.772 | S | S | * | * | 83.8 | 101.8 | 67.6 | 0 | 0 | 0 | 0 | 0 | 114 | |||||
| 196 | P | 51.3 | Low | 31 | Very low | 121 Ų | 121 | 123.2 Ų | 123.2 | 79% | 0.786 | 77% | 0.766 | S | S | * | * | trans | -110.6 | 171.7 | -178.3 | 41.4 | -34.5 | 0 | 0 | 0 | 114.6 | ||||
| 197 | P | 37.4 | Very low | 30.7 | Very low | 124 Ų | 124 | 123.9 Ų | 123.9 | 81% | 0.805 | 77% | 0.77 | S | S | * | * | trans | -125.1 | 156.9 | 134.3 | 37 | -28.1 | 0 | 0 | 0 | 110.8 | ||||
| 198 | G | 29.7 | Very low | 30.7 | Very low | 81 Ų | 81 | 124.4 Ų | 124.4 | 84% | 0.835 | 77% | 0.766 | S | S | * | * | cis | 98.6 | 127 | 15.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 199 | G | 28.2 | Very low | 30.4 | Very low | 66 Ų | 66 | 120.7 Ų | 120.7 | 68% | 0.68 | 76% | 0.759 | S | S | * | * | cis | 167.8 | -166.4 | -0.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 200 | I | 32.6 | Very low | 30.7 | Very low | 153 Ų | 153 | 121.9 Ų | 121.9 | 79% | 0.785 | 76% | 0.764 | S | S | * | * | trans | 156.8 | 107.7 | 140.7 | -82.9 | 161.7 | 0 | 0 | 0 | 113.9 | ||||
| 201 | R | 33.3 | Very low | 30.9 | Very low | 217 Ų | 217 | 127.2 Ų | 127.2 | 82% | 0.819 | 77% | 0.77 | S | S | * | * | trans | 61.4 | 158.3 | 136.2 | -57.1 | -179.9 | -168.4 | -107.4 | -2.1 | 120.2 | ||||
| 202 | T | 29.6 | Very low | 30.9 | Very low | 114 Ų | 114 | 127.3 Ų | 127.3 | 70% | 0.699 | 76% | 0.764 | S | S | * | * | cis | -139.2 | -165.7 | 1.2 | -15.5 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 203 | I | 31.9 | Very low | 30.7 | Very low | 152 Ų | 152 | 125.8 Ų | 125.8 | 78% | 0.779 | 76% | 0.762 | S | S | * | * | cis | -152.9 | 150.5 | 6.1 | 10.8 | 173.5 | 0 | 0 | 0 | 106.1 | ||||
| 204 | A | 25.2 | Very low | 31.3 | Very low | 82 Ų | 82 | 129.2 Ų | 129.2 | 68% | 0.678 | 77% | 0.767 | S | S | * | * | cis | 74.9 | 144.7 | 13.1 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 205 | P | 42.8 | Very low | 31.8 | Very low | 116 Ų | 116 | 129.9 Ų | 129.9 | 75% | 0.753 | 76% | 0.763 | S | S | * | * | cis | -123.6 | -174.7 | 5.4 | 43.8 | -29.8 | 0 | 0 | 0 | 115.3 | ||||
| 206 | Q | 26.9 | Very low | 31.8 | Very low | 163 Ų | 163 | 134.1 Ų | 134.1 | 76% | 0.762 | 77% | 0.767 | S | S | * | * | trans | 14.1 | 149.9 | 140.9 | -60.6 | -67.2 | -4.3 | 0 | 0 | 119.6 | ||||
| 207 | V | 26.8 | Very low | 31 | Very low | 124 Ų | 124 | 136.4 Ų | 136.4 | 75% | 0.752 | 77% | 0.767 | S | S | * | * | -153.4 | 145.7 | 53.2 | -152.8 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 208 | L | 27.2 | Very low | 30.6 | Very low | 159 Ų | 159 | 138.3 Ų | 138.3 | 83% | 0.832 | 77% | 0.771 | S | S | * | * | trans | 80.4 | 139.8 | 150.7 | -122.3 | 70.7 | 0 | 0 | 0 | 121.9 | ||||
| 209 | A | 24.7 | Very low | 31 | Very low | 83 Ų | 83 | 139 Ų | 139 | 69% | 0.686 | 77% | 0.769 | S | S | * | * | trans | -102.5 | -175.3 | 164.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 210 | P | 32 | Very low | 31.1 | Very low | 128 Ų | 128 | 142.2 Ų | 142.2 | 83% | 0.831 | 78% | 0.775 | S | S | * | * | cis | -143 | -165.4 | 37.6 | 42.7 | -20.9 | 0 | 0 | 0 | 116.5 | ||||
| 211 | R | 31.1 | Very low | 30.9 | Very low | 209 Ų | 209 | 139.5 Ų | 139.5 | 79% | 0.789 | 77% | 0.77 | S | S | * | * | trans | -80.6 | 161.7 | 178.7 | 154.1 | -174.6 | 176.8 | -116.5 | -0.1 | 113 | ||||
| 212 | L | 29.5 | Very low | 30.9 | Very low | 132 Ų | 132 | 136.2 Ų | 136.2 | 69% | 0.691 | 77% | 0.767 | S | S | * | * | trans | 74 | 137.3 | 176 | -76 | 150.3 | 0 | 0 | 0 | 113.3 | ||||
| 213 | T | 26 | Very low | 31.3 | Very low | 124 Ų | 124 | 138.7 Ų | 138.7 | 76% | 0.761 | 77% | 0.77 | S | S | * | * | cis | -139.3 | 166.3 | 26.9 | 51.8 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 214 | Q | 37.8 | Very low | 32.1 | Very low | 180 Ų | 180 | 138.1 Ų | 138.1 | 84% | 0.841 | 77% | 0.769 | S | S | * | * | trans | -62.6 | 152.4 | 154 | -162 | 177.2 | 11.4 | 0 | 0 | 108.7 | ||||
| 215 | P | 37.5 | Very low | 33.7 | Very low | 109 Ų | 109 | 139.4 Ų | 139.4 | 71% | 0.708 | 76% | 0.763 | S | S | * | * | cis | -138.2 | -161.7 | 27.6 | 43.9 | -24.7 | 0 | 0 | 0 | 115.8 | ||||
| 216 | Q | 25.5 | Very low | 34.1 | Very low | 179 Ų | 179 | 141.8 Ų | 141.8 | 84% | 0.836 | 77% | 0.765 | S | S | * | * | trans | 115.5 | 137.6 | 145.3 | -157.8 | 164.6 | 3.3 | 0 | 0 | 117.6 | ||||
| 217 | Q | 36.4 | Very low | 35.9 | Very low | 169 Ų | 169 | 137.4 Ų | 137.4 | 79% | 0.79 | 75% | 0.746 | S | S | * | * | trans | -78.1 | 140.3 | -177 | -56.2 | 144.9 | -33.8 | 0 | 0 | 111.1 | ||||
| 218 | N | 27.2 | Very low | 37.8 | Very low | 165 Ų | 165 | 135.3 Ų | 135.3 | 88% | 0.882 | 73% | 0.734 | S | S | * | * | -163.8 | 167.5 | 115.9 | -111.7 | -43 | 0 | 0 | 0 | 113.2 | |||||
| 219 | A | 38.1 | Very low | 39.5 | Very low | 95 Ų | 95 | 133 Ų | 133 | 79% | 0.785 | 74% | 0.738 | S | S | * | * | trans | -86.6 | 149.5 | -165.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 220 | T | 30.4 | Very low | 41.8 | Very low | 134 Ų | 134 | 130.4 Ų | 130.4 | 82% | 0.822 | 72% | 0.72 | S | S | * | * | trans | -135.9 | 123.2 | 165.5 | 31.4 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 221 | S | 28.1 | Very low | 44.1 | Very low | 96 Ų | 96 | 128 Ų | 128 | 67% | 0.671 | 70% | 0.699 | S | S | * | * | trans | 22.7 | 112.1 | 151.9 | -155.5 | 0 | 0 | 0 | 0 | 119.7 | Q223 | S221-Q223 PolarHBondContact O-N 3.2Š| ||
| 222 | I | 33.5 | Very low | 46.5 | Very low | 148 Ų | 148 | 120.2 Ų | 120.2 | 76% | 0.759 | 67% | 0.674 | S | S | * | * | trans | -79 | 107.7 | 158.1 | -59.7 | -67.5 | 0 | 0 | 0 | 108.5 | I225 | I222-I225 HydrophobicContact CG2-CD1 4.14Š| ||
| 223 | Q | 38.7 | Very low | 48.9 | Very low | 165 Ų | 165 | 116.8 Ų | 116.8 | 77% | 0.771 | 66% | 0.656 | S | S | * | * | trans | -100.2 | 131.4 | 165.6 | -69.8 | -166.7 | 5.5 | 0 | 0 | 111.4 | S221 | S221-Q223 PolarHBondContact O-N 3.2Š| ||
| 224 | N | 47.6 | Very low | 51.5 | Low | 140 Ų | 140 | 112.8 Ų | 112.8 | 75% | 0.749 | 63% | 0.631 | S | S | * | * | trans | 39.3 | 77.4 | 157 | -161.7 | 32.6 | 0 | 0 | 0 | 118.4 | Q226 | N224-Q226 PolarHBondContact O-N 3.15Š| ||
| 225 | I | 60.3 | Low | 53.5 | Low | 109 Ų | 109 | 112.9 Ų | 112.9 | 56% | 0.559 | 62% | 0.624 | S | S | * | * | trans | -88.5 | 100.1 | 166.4 | -58.6 | 169.2 | 0 | 0 | 0 | 108.8 | I222 I227 | I222-I225 HydrophobicContact CG2-CD1 4.14Å; I225-I227 HydrophobicContact CG2-CG1 4.39Å; I225-I227 PolarHBondContact O-N 3.41Å | ||
| 226 | Q | 50.3 | Low | 55.3 | Low | 167 Ų | 167 | 109.2 Ų | 109.2 | 78% | 0.78 | 60% | 0.601 | S | S | * | * | trans | -82.1 | 106.5 | 178.3 | -170.5 | 155.7 | 9.6 | 0 | 0 | 111.3 | N224 | N224-Q226 PolarHBondContact O-N 3.15Š| ||
| 227 | I | 65 | Low | 57.7 | Low | 71 Ų | 71 | 110.6 Ų | 110.6 | 36% | 0.364 | 61% | 0.607 | S | S | . | * | P | Polyproline II helix | trans | -81.3 | 127.5 | -177.8 | -57 | 176.6 | 0 | 0 | 0 | 110.1 | I225 M231 L233 M243 | I225-I227 HydrophobicContact CG2-CG1 4.39Å; I225-I227 PolarHBondContact O-N 3.41Å; I227-M231 HydrophobicContact CG2-CB 3.8Å; I227-M231 WeakPolarHBondContact CG2-O 3.32Å; I227-L233 HydrophobicContact CD1-CB 4.27Å; I227-L233 HydrophobicContact CD1-CD1 4.1Å; I227-L233 HydrophobicContact CG1-CD1 4.49Å; I227-M243 HydrophobicContact CG2-CE 4.39Å |
| 228 | P | 66.4 | Low | 59.5 | Low | 79 Ų | 79 | 106.7 Ų | 106.7 | 51% | 0.513 | 60% | 0.599 | S | S | . | * | P | Polyproline II helix | trans | -62.9 | 147.6 | 176 | -24.5 | 35.2 | 0 | 0 | 0 | 113.6 | G230 M231 | P228-G230 PolarHBondContact O-N 3.43Å; P228-M231 WeakPolarHBondContact O-CB 3.36Å; P228-M231 PolarHBondContact O-N 3.33Å |
| 229 | A | 64.3 | Low | 61.8 | Low | 110 Ų | 110 | 100.1 Ų | 100.1 | 91% | 0.909 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.5 | 128.5 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 230 | G | 72.1 | Confident | 63.5 | Low | 30 Ų | 30 | 102 Ų | 102 | 31% | 0.309 | 56% | 0.562 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 90.9 | -10.1 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | P228 H245 Q246 | P228-G230 PolarHBondContact O-N 3.43Å; G230-H245 PolarHBondContact O-ND1 3.35Å; G230-Q246 WeakPolarHBondContact O-CB 3.25Å; G230-Q246 PolarHBondContact O-N 3.25Å |
| 231 | M | 79.8 | Confident | 65.9 | Low | 77 Ų | 77 | 101.1 Ų | 101.1 | 38% | 0.379 | 55% | 0.552 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -91.4 | 149.2 | 168.7 | -67.1 | -60.5 | -165.1 | 0 | 0 | 111.5 | I227 P228 M243 H245 | I227-M231 HydrophobicContact CG2-CB 3.8Å; I227-M231 WeakPolarHBondContact CG2-O 3.32Å; P228-M231 WeakPolarHBondContact O-CB 3.36Å; P228-M231 PolarHBondContact O-N 3.33Å; M231-M243 HydrophobicContact CB-CG 3.74Å; M231-M243 HydrophobicContact CB-SD 3.86Å; M231-M243 HydrophobicContact CG-CG 4.02Å; M231-M243 HydrophobicContact CG-SD 3.88Å; M231-M243 HydrophobicContact SD-CG 4.17Å; M231-H245 HydrophobicContact SD-CB 3.97Å |
| 232 | V | 81.2 | Confident | 68.2 | Low | 46 Ų | 46 | 100.6 Ų | 100.6 | 28% | 0.279 | 54% | 0.541 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.8 | 134 | 175.4 | -177.5 | 0 | 0 | 0 | 0 | 108.7 | V234 I244 Q246 | V232-V234 HydrophobicContact CG1-CG2 4.36Å; V232-I244 PolarHBondContact N-O 2.91Å; V232-I244 PolarHBondContact O-N 3.24Å; V232-Q246 HydrophobicContact CG2-CB 4.2Å; V232-Q246 HydrophobicContact CG2-CG 4.3Å |
| 233 | L | 81.1 | Confident | 70.5 | Confident | 60 Ų | 60 | 98 Ų | 98 | 31% | 0.314 | 53% | 0.527 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.4 | 122.4 | 169.4 | -113.4 | 68.3 | 0 | 0 | 0 | 109.8 | I227 L241 L242 M243 | I227-L233 HydrophobicContact CD1-CB 4.27Å; I227-L233 HydrophobicContact CD1-CD1 4.1Å; I227-L233 HydrophobicContact CG1-CD1 4.49Å; L233-L241 HydrophobicContact CD2-CB 4.03Å; L233-L241 HydrophobicContact CD2-CD1 4.2Å; L233-L241 HydrophobicContact CG-CB 4.37Å; L233-L242 WeakPolarHBondContact CA-O 3.5Å; L233-M243 HydrophobicContact CD1-CB 3.9Å; L233-M243 HydrophobicContact CD1-CE 3.59Å; L233-M243 HydrophobicContact CD1-CG 4.06Å |
| 234 | V | 79.7 | Confident | 72.3 | Confident | 39 Ų | 39 | 92 Ų | 92 | 24% | 0.236 | 50% | 0.5 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 128.2 | 178.8 | -176.7 | 0 | 0 | 0 | 0 | 108.3 | V232 L242 I244 L249 | V232-V234 HydrophobicContact CG1-CG2 4.36Å; V234-L242 PolarHBondContact N-O 2.83Å; V234-L242 PolarHBondContact O-N 2.91Å; V234-I244 HydrophobicContact CB-CD1 3.99Å; V234-I244 HydrophobicContact CB-CG1 4.47Å; V234-I244 HydrophobicContact CG1-CD1 4.46Å; V234-I244 HydrophobicContact CG2-CB 4.2Å; V234-I244 HydrophobicContact CG2-CD1 4.11Å; V234-I244 HydrophobicContact CG2-CG1 4.35Å; V234-L249 HydrophobicContact CG2-CD1 4.19Å; V234-L249 HydrophobicContact CG2-CD2 3.87Å |
| 235 | R | 80 | Confident | 73.9 | Confident | 183 Ų | 183 | 89 Ų | 89 | 69% | 0.691 | 48% | 0.481 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -82.7 | 126.2 | 176.2 | -165 | -178.7 | 179.3 | -138.2 | -1.4 | 109.7 | G239 Q240 L241 | R235-G239 PolarHBondContact NE-O 2.77Å; R235-Q240 CarbonylContact C-O 3.13Å; R235-Q240 VanDerWaalsContact CA-O 3.27Å; R235-Q240 WeakPolarHBondContact CA-O 3.31Å; R235-L241 HydrophobicContact CB-CD2 3.89Å; R235-L241 HydrophobicContact CG-CD2 4.08Å |
| 236 | S | 75.8 | Confident | 74.8 | Confident | 31 Ų | 31 | 89.8 Ų | 89.8 | 22% | 0.217 | 48% | 0.483 | C | S | . | . | trans | -69.4 | 162.8 | 170.1 | 64.5 | 0 | 0 | 0 | 0 | 111.2 | S238 G239 Q240 | S236-S238 PolarHBondContact O-N 2.84Å; S236-S238 PolarHBondContact OG-N 2.99Å; S236-S238 PolarHBondContact OG-OG 3.19Å; S236-G239 WeakPolarHBondContact O-CA 3.46Å; S236-G239 PolarHBondContact O-N 3.28Å; S236-G239 PolarHBondContact OG-N 3.11Å; S236-Q240 PolarHBondContact N-O 3.29Å; S236-Q240 PolarHBondContact OG-N 3.45Å; S236-Q240 PolarHBondContact OG-O 2.91Å | ||
| 237 | E | 76.4 | Confident | 76.2 | Confident | 208 Ų | 208 | 88.9 Ų | 88.9 | 97% | 0.972 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.3 | -32 | 169.3 | 66.2 | -162.2 | 162.8 | 0 | 0 | 112.3 | G239 | E237-G239 PolarHBondContact O-N 2.93Å; E237-G239 VanDerWaalsContact O-N 3.14Å |
| 238 | S | 74.5 | Confident | 76.7 | Confident | 87 Ų | 87 | 88.8 Ų | 88.8 | 61% | 0.608 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.4 | 5 | 169.5 | 58.5 | 0 | 0 | 0 | 0 | 114.4 | S236 Q240 | S236-S238 PolarHBondContact O-N 2.84Å; S236-S238 PolarHBondContact OG-N 2.99Å; S236-S238 PolarHBondContact OG-OG 3.19Å; S238-Q240 VanDerWaalsContact C-N 3.31Å; S238-Q240 PolarHBondContact O-N 2.95Å |
| 239 | G | 74.6 | Confident | 77.2 | Confident | 27 Ų | 27 | 86.9 Ų | 86.9 | 28% | 0.278 | 47% | 0.466 | S | S | . | . | S | Bend | trans | 82.5 | -5.4 | 171.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | R235 S236 E237 | R235-G239 PolarHBondContact NE-O 2.77Å; S236-G239 WeakPolarHBondContact O-CA 3.46Å; S236-G239 PolarHBondContact O-N 3.28Å; S236-G239 PolarHBondContact OG-N 3.11Å; E237-G239 PolarHBondContact O-N 2.93Å; E237-G239 VanDerWaalsContact O-N 3.14Å |
| 240 | Q | 73.6 | Confident | 77.5 | Confident | 134 Ų | 134 | 84.6 Ų | 84.6 | 63% | 0.626 | 45% | 0.448 | S | S | * | . | trans | -76.2 | 155.7 | 179.4 | -59.5 | -177 | 0.9 | 0 | 0 | 111.4 | R235 S236 S238 L242 | R235-Q240 CarbonylContact C-O 3.13Å; R235-Q240 VanDerWaalsContact CA-O 3.27Å; R235-Q240 WeakPolarHBondContact CA-O 3.31Å; S236-Q240 PolarHBondContact N-O 3.29Å; S236-Q240 PolarHBondContact OG-N 3.45Å; S236-Q240 PolarHBondContact OG-O 2.91Å; S238-Q240 VanDerWaalsContact C-N 3.31Å; S238-Q240 PolarHBondContact O-N 2.95Å; Q240-L242 HydrophobicContact CB-CD1 4.43Å | ||
| 241 | L | 80.5 | Confident | 77.3 | Confident | 117 Ų | 117 | 90.3 Ų | 90.3 | 61% | 0.613 | 47% | 0.467 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -105.5 | 112 | -179.9 | -66.9 | 169 | 0 | 0 | 0 | 110.2 | L233 R235 | L233-L241 HydrophobicContact CD2-CB 4.03Å; L233-L241 HydrophobicContact CD2-CD1 4.2Å; L233-L241 HydrophobicContact CG-CB 4.37Å; R235-L241 HydrophobicContact CB-CD2 3.89Å; R235-L241 HydrophobicContact CG-CD2 4.08Å |
| 242 | L | 77 | Confident | 76.7 | Confident | 84 Ų | 84 | 92.5 Ų | 92.5 | 44% | 0.44 | 48% | 0.477 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.2 | 136.7 | 177.3 | -66.3 | 89.4 | 0 | 0 | 0 | 110.1 | L233 V234 Q240 I244 | L233-L242 WeakPolarHBondContact CA-O 3.5Å; V234-L242 PolarHBondContact N-O 2.83Å; V234-L242 PolarHBondContact O-N 2.91Å; Q240-L242 HydrophobicContact CB-CD1 4.43Å; L242-I244 HydrophobicContact CB-CD1 4.39Å; L242-I244 HydrophobicContact CB-CG1 4.24Å |
| 243 | M | 82.2 | Confident | 76 | Confident | 94 Ų | 94 | 95.3 Ų | 95.3 | 46% | 0.463 | 49% | 0.487 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.5 | 115.3 | 173.1 | -170.6 | 175.3 | -69.5 | 0 | 0 | 109.6 | I227 M231 L233 | I227-M243 HydrophobicContact CG2-CE 4.39Å; M231-M243 HydrophobicContact CB-CG 3.74Å; M231-M243 HydrophobicContact CB-SD 3.86Å; M231-M243 HydrophobicContact CG-CG 4.02Å; M231-M243 HydrophobicContact CG-SD 3.88Å; M231-M243 HydrophobicContact SD-CG 4.17Å; L233-M243 HydrophobicContact CD1-CB 3.9Å; L233-M243 HydrophobicContact CD1-CE 3.59Å; L233-M243 HydrophobicContact CD1-CG 4.06Å |
| 244 | I | 77.1 | Confident | 74.6 | Confident | 40 Ų | 40 | 95.9 Ų | 95.9 | 21% | 0.205 | 50% | 0.5 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.8 | 137.6 | -174.4 | -57.2 | -177 | 0 | 0 | 0 | 109.4 | V232 V234 L242 T248 L249 | V232-I244 PolarHBondContact N-O 2.91Å; V232-I244 PolarHBondContact O-N 3.24Å; V234-I244 HydrophobicContact CB-CD1 3.99Å; V234-I244 HydrophobicContact CB-CG1 4.47Å; V234-I244 HydrophobicContact CG1-CD1 4.46Å; V234-I244 HydrophobicContact CG2-CB 4.2Å; V234-I244 HydrophobicContact CG2-CD1 4.11Å; V234-I244 HydrophobicContact CG2-CG1 4.35Å; L242-I244 HydrophobicContact CB-CD1 4.39Å; L242-I244 HydrophobicContact CB-CG1 4.24Å; I244-T248 HydrophobicContact CG2-CG2 4.44Å; I244-L249 HydrophobicContact CG2-CB 4.38Å |
| 245 | H | 79.9 | Confident | 73.3 | Confident | 76 Ų | 76 | 101.9 Ų | 101.9 | 35% | 0.352 | 53% | 0.526 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.9 | 137.7 | 177 | -170 | 69.1 | 0 | 0 | 0 | 111.2 | G230 M231 Q247 T248 L249 | G230-H245 PolarHBondContact O-ND1 3.35Å; M231-H245 HydrophobicContact SD-CB 3.97Å; H245-Q247 VanDerWaalsContact C-N 3.28Å; H245-Q247 PolarHBondContact O-N 3.18Å; H245-Q247 VanDerWaalsContact O-N 3.16Å; H245-T248 WeakPolarHBondContact O-CB 3.36Å; H245-T248 PolarHBondContact O-N 3.07Å; H245-L249 PolarHBondContact O-N 3.31Å |
| 246 | Q | 80.4 | Confident | 72 | Confident | 126 Ų | 126 | 97 Ų | 97 | 59% | 0.589 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -58.8 | -35.8 | -167.5 | -169.6 | 178.8 | 99.1 | 0 | 0 | 113.6 | G230 V232 A250 | G230-Q246 WeakPolarHBondContact O-CB 3.25Å; G230-Q246 PolarHBondContact O-N 3.25Å; V232-Q246 HydrophobicContact CG2-CB 4.2Å; V232-Q246 HydrophobicContact CG2-CG 4.3Å; Q246-A250 PolarHBondContact O-N 2.93Å |
| 247 | Q | 78.8 | Confident | 70.6 | Confident | 147 Ų | 147 | 104.1 Ų | 104.1 | 69% | 0.687 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -69 | -34.7 | 177.6 | -58.4 | -171.9 | 3.8 | 0 | 0 | 112.8 | H245 A250 Q251 | H245-Q247 VanDerWaalsContact C-N 3.28Å; H245-Q247 PolarHBondContact O-N 3.18Å; H245-Q247 VanDerWaalsContact O-N 3.16Å; Q247-A250 PolarHBondContact O-N 3.01Å; Q247-Q251 PolarHBondContact O-N 3.34Å |
| 248 | T | 76.3 | Confident | 69.2 | Low | 69 Ų | 69 | 99.1 Ų | 99.1 | 42% | 0.423 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -66.5 | -40.7 | 178 | -47 | 0 | 0 | 0 | 0 | 111.2 | I244 H245 A250 Q251 M252 | I244-T248 HydrophobicContact CG2-CG2 4.44Å; H245-T248 WeakPolarHBondContact O-CB 3.36Å; H245-T248 PolarHBondContact O-N 3.07Å; T248-A250 VanDerWaalsContact C-N 3.29Å; T248-A250 PolarHBondContact O-N 2.92Å; T248-Q251 PolarHBondContact O-N 2.78Å; T248-M252 PolarHBondContact O-N 3.4Å |
| 249 | L | 75.8 | Confident | 67.7 | Low | 39 Ų | 39 | 103.4 Ų | 103.4 | 20% | 0.204 | 55% | 0.553 | C | S | . | * | H | α-helix | trans | -63.2 | -36 | 176.3 | -174.6 | 62 | 0 | 0 | 0 | 112.1 | V234 I244 H245 Q253 | V234-L249 HydrophobicContact CG2-CD1 4.19Å; V234-L249 HydrophobicContact CG2-CD2 3.87Å; I244-L249 HydrophobicContact CG2-CB 4.38Å; H245-L249 PolarHBondContact O-N 3.31Å; L249-Q253 WeakPolarHBondContact O-CG 3.43Å; L249-Q253 PolarHBondContact O-N 2.92Å |
| 250 | A | 71 | Confident | 65.6 | Low | 63 Ų | 63 | 108.2 Ų | 108.2 | 52% | 0.521 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -67.1 | -39.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q246 Q247 T248 A254 | Q246-A250 PolarHBondContact O-N 2.93Å; Q247-A250 PolarHBondContact O-N 3.01Å; T248-A250 VanDerWaalsContact C-N 3.29Å; T248-A250 PolarHBondContact O-N 2.92Å; A250-A254 PolarHBondContact O-N 2.86Å; A250-A254 VanDerWaalsContact O-N 3.15Å |
| 251 | Q | 68.5 | Low | 63.5 | Low | 150 Ų | 150 | 106.6 Ų | 106.6 | 70% | 0.701 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.5 | -42.6 | 175 | -77.6 | -172.1 | -7.3 | 0 | 0 | 112.7 | Q247 T248 Q253 A254 Q255 | Q247-Q251 PolarHBondContact O-N 3.34Å; T248-Q251 PolarHBondContact O-N 2.78Å; Q251-Q253 VanDerWaalsContact C-N 3.3Å; Q251-Q253 PolarHBondContact O-N 3.4Å; Q251-A254 PolarHBondContact O-N 2.96Å; Q251-Q255 PolarHBondContact O-N 2.82Å |
| 252 | M | 67.3 | Low | 61.3 | Low | 122 Ų | 122 | 107.8 Ų | 107.8 | 60% | 0.601 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -58.8 | -41.1 | 176.4 | -77.2 | -178.8 | 66.1 | 0 | 0 | 112.3 | T248 Q255 A256 | T248-M252 PolarHBondContact O-N 3.4Å; M252-Q255 PolarHBondContact O-N 2.88Å; M252-A256 PolarHBondContact O-N 3.04Å |
| 253 | Q | 65 | Low | 59.1 | Low | 106 Ų | 106 | 110.6 Ų | 110.6 | 50% | 0.495 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -70.4 | -32.7 | 178.2 | -71 | 177.6 | 15.9 | 0 | 0 | 112.6 | L249 Q251 Q255 | L249-Q253 WeakPolarHBondContact O-CG 3.43Å; L249-Q253 PolarHBondContact O-N 2.92Å; Q251-Q253 VanDerWaalsContact C-N 3.3Å; Q251-Q253 PolarHBondContact O-N 3.4Å; Q253-Q255 VanDerWaalsContact C-N 3.32Å; Q253-Q255 PolarHBondContact O-N 3.39Å |
| 254 | A | 52.3 | Low | 56.7 | Low | 71 Ų | 71 | 112.4 Ų | 112.4 | 59% | 0.587 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -66.8 | -30.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | A250 Q251 | A250-A254 PolarHBondContact O-N 2.86Å; A250-A254 VanDerWaalsContact O-N 3.15Å; Q251-A254 PolarHBondContact O-N 2.96Å |
| 255 | Q | 53.4 | Low | 54.4 | Low | 166 Ų | 166 | 121.6 Ų | 121.6 | 78% | 0.776 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -87.6 | -21.8 | -177 | -160.9 | 168.4 | 9.4 | 0 | 0 | 113.7 | Q251 M252 Q253 Q257 | Q251-Q255 PolarHBondContact O-N 2.82Å; M252-Q255 PolarHBondContact O-N 2.88Å; Q253-Q255 VanDerWaalsContact C-N 3.32Å; Q253-Q255 PolarHBondContact O-N 3.39Å; Q255-Q257 VanDerWaalsContact C-N 3.32Å; Q255-Q257 PolarHBondContact O-N 3.47Å |
| 256 | A | 51.8 | Low | 52.2 | Low | 81 Ų | 81 | 124 Ų | 124 | 67% | 0.669 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -74.3 | -18.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | M252 S258 | M252-A256 PolarHBondContact O-N 3.04Å; A256-S258 PolarHBondContact O-N 3.04Å |
| 257 | Q | 46 | Very low | 49.7 | Very low | 179 Ų | 179 | 122.9 Ų | 122.9 | 84% | 0.836 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89 | 5.1 | -169.7 | -147.3 | 167.2 | 23.1 | 0 | 0 | 114.5 | Q255 | Q255-Q257 VanDerWaalsContact C-N 3.32Å; Q255-Q257 PolarHBondContact O-N 3.47Å |
| 258 | S | 46.8 | Very low | 47.1 | Very low | 103 Ų | 103 | 120.5 Ų | 120.5 | 72% | 0.72 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.8 | -1.9 | -175.7 | -52.5 | 0 | 0 | 0 | 0 | 115.4 | A256 | A256-S258 PolarHBondContact O-N 3.04Š|
| 259 | Q | 43.2 | Very low | 45.6 | Very low | 178 Ų | 178 | 122.9 Ų | 122.9 | 83% | 0.832 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -141.4 | 79.1 | 178.7 | -66.8 | -170.9 | 25.1 | 0 | 0 | 112.8 | ||
| 260 | S | 31 | Very low | 43.3 | Very low | 128 Ų | 128 | 127.4 Ų | 127.4 | 90% | 0.895 | 76% | 0.762 | S | S | * | * | trans | -167.5 | 96.9 | 159 | -85.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 261 | A | 29.1 | Very low | 41.1 | Very low | 100 Ų | 100 | 128.7 Ų | 128.7 | 83% | 0.826 | 77% | 0.767 | S | S | * | * | trans | -150.5 | 53 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 262 | T | 33.8 | Very low | 39.3 | Very low | 142 Ų | 142 | 127.8 Ų | 127.8 | 87% | 0.871 | 77% | 0.772 | S | S | * | * | trans | -131.9 | 145.6 | 168.2 | 46.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 263 | T | 32.2 | Very low | 38 | Very low | 142 Ų | 142 | 127.3 Ų | 127.3 | 87% | 0.871 | 78% | 0.778 | S | S | * | * | trans | -105.7 | 157.5 | -170.3 | 49.3 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 264 | P | 31.3 | Very low | 37.2 | Very low | 132 Ų | 132 | 127.8 Ų | 127.8 | 86% | 0.857 | 79% | 0.79 | S | S | * | * | trans | -123 | 163.3 | 146.6 | 35.6 | -26.3 | 0 | 0 | 0 | 112.8 | ||||
| 265 | R | 29.4 | Very low | 36 | Very low | 234 Ų | 234 | 129.7 Ų | 129.7 | 88% | 0.883 | 79% | 0.794 | S | S | * | * | trans | -127.9 | 145.2 | -173.7 | 171.4 | -175.5 | 168.2 | 176.8 | -2.7 | 109.5 | ||||
| 266 | P | 32.6 | Very low | 34.7 | Very low | 126 Ų | 126 | 129.8 Ų | 129.8 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -70.3 | 165.1 | 178.8 | 28.1 | -34.7 | 0 | 0 | 0 | 113.8 | ||||
| 267 | A | 27.9 | Very low | 33.5 | Very low | 103 Ų | 103 | 132.3 Ų | 132.3 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | trans | -123.2 | 172.9 | -145.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 268 | A | 25 | Very low | 32.6 | Very low | 96 Ų | 96 | 128.1 Ų | 128.1 | 79% | 0.793 | 80% | 0.798 | S | S | * | * | trans | -146.6 | 163.1 | 165.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 269 | P | 44.4 | Very low | 31.6 | Very low | 119 Ų | 119 | 128.2 Ų | 128.2 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | trans | -108.9 | 168.6 | -148.3 | 40.1 | -36.6 | 0 | 0 | 0 | 116.6 | ||||
| 270 | T | 28.1 | Very low | 30.8 | Very low | 134 Ų | 134 | 126.4 Ų | 126.4 | 82% | 0.822 | 79% | 0.794 | S | S | * | * | 166.1 | 128.5 | 127.7 | -71.3 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 271 | S | 24.9 | Very low | 30.7 | Very low | 91 Ų | 91 | 128.5 Ų | 128.5 | 64% | 0.636 | 79% | 0.789 | S | S | * | * | trans | 48.2 | 124.6 | 149.3 | -147.8 | 0 | 0 | 0 | 0 | 125.7 | ||||
| 272 | T | 30.3 | Very low | 30.5 | Very low | 131 Ų | 131 | 129.8 Ų | 129.8 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | trans | 73.2 | 157.6 | 138 | 44 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 273 | P | 39.4 | Very low | 30.8 | Very low | 112 Ų | 112 | 129.2 Ų | 129.2 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | trans | -124.6 | -158.7 | -161.9 | 47.2 | -32.8 | 0 | 0 | 0 | 113.6 | ||||
| 274 | P | 48.1 | Very low | 30.6 | Very low | 115 Ų | 115 | 126.3 Ų | 126.3 | 75% | 0.747 | 78% | 0.784 | S | S | * | * | cis | -126.9 | -159.6 | -28.8 | 26.8 | -3.5 | 0 | 0 | 0 | 112.8 | ||||
| 275 | V | 26.7 | Very low | 30.5 | Very low | 111 Ų | 111 | 123.5 Ų | 123.5 | 67% | 0.673 | 78% | 0.779 | S | S | * | * | trans | 127.3 | 112.1 | 143.8 | 174 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 276 | Q | 27.2 | Very low | 31.5 | Very low | 169 Ų | 169 | 117.8 Ų | 117.8 | 79% | 0.79 | 77% | 0.772 | S | S | * | * | trans | 48.5 | 167.2 | 140.1 | -53.5 | 173.7 | 14.8 | 0 | 0 | 121.4 | ||||
| 277 | V | 26.9 | Very low | 31.4 | Very low | 133 Ų | 133 | 118.9 Ų | 118.9 | 81% | 0.806 | 77% | 0.771 | S | S | * | * | cis | -145.5 | -174.4 | 5.5 | -135.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 278 | A | 26.4 | Very low | 31.6 | Very low | 92 Ų | 92 | 121.9 Ų | 121.9 | 76% | 0.76 | 77% | 0.772 | S | S | * | * | trans | -64.6 | -179.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 279 | S | 26.8 | Very low | 31.7 | Very low | 105 Ų | 105 | 121.6 Ų | 121.6 | 73% | 0.734 | 77% | 0.769 | S | S | * | * | cis | -176.7 | 178.2 | 38 | 71.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 280 | L | 26 | Very low | 30.9 | Very low | 140 Ų | 140 | 126.9 Ų | 126.9 | 73% | 0.733 | 77% | 0.774 | S | S | * | * | cis | -166.7 | 176.4 | -12.4 | -121.5 | 175.2 | 0 | 0 | 0 | 110.4 | ||||
| 281 | Q | 28.1 | Very low | 30.9 | Very low | 171 Ų | 171 | 125 Ų | 125 | 80% | 0.799 | 77% | 0.765 | S | S | * | * | trans | 60.8 | 130.7 | 150.8 | -91.2 | 154.6 | -14.3 | 0 | 0 | 124.4 | ||||
| 282 | T | 25.6 | Very low | 31.1 | Very low | 128 Ų | 128 | 126.9 Ų | 126.9 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | trans | -93.8 | -170.6 | 153.3 | 57.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 283 | P | 39.4 | Very low | 31.2 | Very low | 129 Ų | 129 | 126.5 Ų | 126.5 | 84% | 0.838 | 77% | 0.771 | S | S | * | * | cis | -133 | -175.8 | -6.7 | 42.4 | -25.8 | 0 | 0 | 0 | 114.6 | ||||
| 284 | G | 28.1 | Very low | 31.3 | Very low | 81 Ų | 81 | 126.6 Ų | 126.6 | 84% | 0.835 | 77% | 0.771 | S | S | * | * | trans | 140.6 | 140.8 | 152 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 285 | G | 29.1 | Very low | 30.5 | Very low | 73 Ų | 73 | 126.2 Ų | 126.2 | 75% | 0.753 | 77% | 0.767 | S | S | * | * | trans | -132.8 | -156.1 | 155.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 286 | P | 50.6 | Low | 30.6 | Very low | 114 Ų | 114 | 127.3 Ų | 127.3 | 74% | 0.74 | 77% | 0.774 | S | S | * | * | cis | -139 | -159.5 | 1.4 | 29.3 | -3.4 | 0 | 0 | 0 | 113.6 | ||||
| 287 | L | 29.6 | Very low | 30.8 | Very low | 150 Ų | 150 | 125 Ų | 125 | 79% | 0.785 | 77% | 0.766 | S | S | * | * | trans | 92.9 | 147.7 | 155.2 | -49.7 | 178.1 | 0 | 0 | 0 | 120.5 | ||||
| 288 | L | 34.1 | Very low | 31.1 | Very low | 166 Ų | 166 | 125.9 Ų | 125.9 | 87% | 0.869 | 77% | 0.765 | S | S | * | * | trans | 60.8 | 143.1 | 166.3 | -45.6 | -172.6 | 0 | 0 | 0 | 117.9 | ||||
| 289 | A | 26.5 | Very low | 31.2 | Very low | 89 Ų | 89 | 129.2 Ų | 129.2 | 74% | 0.736 | 76% | 0.762 | S | S | * | * | cis | 158.3 | 156.7 | -29.2 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 290 | R | 27.2 | Very low | 31.2 | Very low | 231 Ų | 231 | 132 Ų | 132 | 87% | 0.872 | 76% | 0.764 | S | S | * | * | trans | 77.8 | 100.8 | 155.6 | -174.8 | 170.6 | 147.3 | 97.1 | -7.8 | 119.6 | ||||
| 291 | S | 28.2 | Very low | 31.3 | Very low | 93 Ų | 93 | 129.2 Ų | 129.2 | 65% | 0.65 | 77% | 0.768 | S | S | * | * | trans | 46.9 | 148.5 | 135.8 | 68 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 292 | V | 28.9 | Very low | 31.4 | Very low | 131 Ų | 131 | 126.4 Ų | 126.4 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | cis | -155.1 | 177.2 | 26.8 | -135.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 293 | T | 33.4 | Very low | 32 | Very low | 124 Ų | 124 | 126.1 Ų | 126.1 | 76% | 0.761 | 77% | 0.768 | S | S | * | * | trans | -57.9 | 163.7 | 163.8 | 17.5 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 294 | P | 39.6 | Very low | 31.3 | Very low | 113 Ų | 113 | 125.4 Ų | 125.4 | 73% | 0.734 | 76% | 0.761 | S | S | * | * | cis | -153.8 | 162.9 | 48.9 | 41.6 | -19.4 | 0 | 0 | 0 | 121.9 | ||||
| 295 | T | 32.8 | Very low | 31.2 | Very low | 107 Ų | 107 | 129.6 Ų | 129.6 | 66% | 0.656 | 76% | 0.759 | S | S | * | * | trans | 41.8 | 123.8 | 137.5 | -48.4 | 0 | 0 | 0 | 0 | 124.8 | I297 | T295-I297 HydrophobicContact CG2-CD1 3.36Å; T295-I297 HydrophobicContact CG2-CG1 3.89Å | ||
| 296 | T | 28.9 | Very low | 31 | Very low | 135 Ų | 135 | 131.2 Ų | 131.2 | 83% | 0.828 | 75% | 0.754 | S | S | * | * | trans | -172.3 | 143.1 | 141.8 | -77.4 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 297 | I | 31 | Very low | 29.9 | Very low | 120 Ų | 120 | 131.5 Ų | 131.5 | 62% | 0.615 | 75% | 0.754 | S | S | * | * | cis | 115.3 | 125.8 | -5.6 | -61.5 | -175.2 | 0 | 0 | 0 | 117.1 | T295 | T295-I297 HydrophobicContact CG2-CD1 3.36Å; T295-I297 HydrophobicContact CG2-CG1 3.89Å | ||
| 298 | I | 32.7 | Very low | 29.8 | Very low | 152 Ų | 152 | 130.5 Ų | 130.5 | 78% | 0.779 | 75% | 0.754 | S | S | * | * | trans | 68.9 | 136.6 | 164.5 | -76.7 | 167.6 | 0 | 0 | 0 | 116.9 | ||||
| 299 | K | 28.1 | Very low | 29.5 | Very low | 161 Ų | 161 | 127.2 Ų | 127.2 | 70% | 0.7 | 75% | 0.751 | S | S | * | * | cis | -155.8 | 148.9 | -1.3 | -131 | -169.3 | -178.1 | -150.8 | 0 | 114.3 | ||||
| 300 | Q | 28.5 | Very low | 29.6 | Very low | 165 Ų | 165 | 129.8 Ų | 129.8 | 77% | 0.771 | 76% | 0.757 | S | S | * | * | trans | 37.6 | 129.5 | 141.5 | -76.5 | 175.4 | -33.6 | 0 | 0 | 124.5 | ||||
| 301 | G | 26.6 | Very low | 29.6 | Very low | 81 Ų | 81 | 125.1 Ų | 125.1 | 84% | 0.835 | 76% | 0.755 | S | S | * | * | trans | -178.1 | 135.1 | 152.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 302 | S | 31.4 | Very low | 29.5 | Very low | 112 Ų | 112 | 125.7 Ų | 125.7 | 78% | 0.783 | 77% | 0.765 | S | S | * | * | trans | -152.8 | 143.5 | -178 | -167.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 303 | P | 36.6 | Very low | 29.5 | Very low | 121 Ų | 121 | 125.4 Ų | 125.4 | 79% | 0.786 | 76% | 0.764 | S | S | * | * | -141.4 | 145.4 | 91.4 | 19.8 | 3.2 | 0 | 0 | 0 | 117 | |||||
| 304 | V | 26 | Very low | 29.3 | Very low | 115 Ų | 115 | 128 Ų | 128 | 70% | 0.697 | 77% | 0.772 | S | S | * | * | 32.4 | 127.9 | 113 | 167.5 | 0 | 0 | 0 | 0 | 116.9 | |||||
| 305 | Q | 26.5 | Very low | 28.7 | Very low | 169 Ų | 169 | 131.1 Ų | 131.1 | 79% | 0.79 | 78% | 0.777 | S | S | * | * | cis | -170.5 | 166.6 | 17.3 | -134.4 | -179.7 | 42.8 | 0 | 0 | 115.5 | ||||
| 306 | T | 24.3 | Very low | 28.5 | Very low | 106 Ų | 106 | 136.6 Ų | 136.6 | 65% | 0.65 | 79% | 0.786 | S | S | * | * | trans | 83.3 | 147.7 | 141.4 | -58.7 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 307 | T | 26.8 | Very low | 28.7 | Very low | 120 Ų | 120 | 135.4 Ų | 135.4 | 74% | 0.736 | 78% | 0.78 | S | S | * | * | trans | 83.6 | 83.9 | 171.9 | -22.5 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 308 | V | 27.5 | Very low | 29.5 | Very low | 129 Ų | 129 | 135 Ų | 135 | 78% | 0.782 | 79% | 0.785 | S | S | * | * | 73 | 114.4 | 78.9 | 176.5 | 0 | 0 | 0 | 0 | 114 | |||||
| 309 | A | 28 | Very low | 29.2 | Very low | 98 Ų | 98 | 134.7 Ų | 134.7 | 81% | 0.81 | 79% | 0.79 | S | S | * | * | trans | -87.1 | 155.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 310 | T | 28.2 | Very low | 29.4 | Very low | 142 Ų | 142 | 134 Ų | 134 | 87% | 0.871 | 79% | 0.793 | S | S | * | * | trans | -119.8 | 149 | 170.1 | 45.4 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 311 | T | 27 | Very low | 29.4 | Very low | 133 Ų | 133 | 135 Ų | 135 | 82% | 0.816 | 80% | 0.798 | S | S | * | * | trans | -83.3 | 126.6 | -174.2 | 48.2 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 312 | A | 26 | Very low | 29.5 | Very low | 106 Ų | 106 | 137.4 Ų | 137.4 | 88% | 0.876 | 79% | 0.792 | S | S | * | * | trans | -88.3 | 122.3 | 168.2 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 313 | T | 29.8 | Very low | 29.2 | Very low | 124 Ų | 124 | 138.5 Ų | 138.5 | 76% | 0.761 | 79% | 0.794 | S | S | * | * | trans | -105.5 | 122.9 | 174.1 | 50.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 314 | L | 28.5 | Very low | 28.9 | Very low | 178 Ų | 178 | 139.7 Ų | 139.7 | 93% | 0.932 | 79% | 0.792 | S | S | * | * | trans | 10.5 | 111.3 | 159.6 | -74.3 | 160.6 | 0 | 0 | 0 | 118 | ||||
| 315 | Q | 28.1 | Very low | 29.2 | Very low | 180 Ų | 180 | 141.1 Ų | 141.1 | 84% | 0.841 | 79% | 0.794 | S | S | * | * | trans | -98.6 | 148.2 | 153 | -71.4 | -179.3 | -23.1 | 0 | 0 | 110.4 | ||||
| 316 | R | 27.7 | Very low | 29.3 | Very low | 222 Ų | 222 | 141.2 Ų | 141.2 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | trans | -140.8 | 151.9 | 142.7 | -98.7 | -139.3 | 175.8 | -176.5 | 0.9 | 110.5 | ||||
| 317 | P | 34.1 | Very low | 29.5 | Very low | 110 Ų | 110 | 140.1 Ų | 140.1 | 71% | 0.714 | 81% | 0.809 | S | S | * | * | trans | -128.1 | -145.5 | -148.4 | 46.3 | -26.6 | 0 | 0 | 0 | 110.6 | ||||
| 318 | P | 47.1 | Very low | 29.5 | Very low | 110 Ų | 110 | 137.7 Ų | 137.7 | 71% | 0.714 | 81% | 0.808 | S | S | * | * | -122.2 | 167.4 | -127.9 | 30.1 | -7 | 0 | 0 | 0 | 115.4 | |||||
| 319 | V | 27.4 | Very low | 29.5 | Very low | 146 Ų | 146 | 139.5 Ų | 139.5 | 89% | 0.885 | 81% | 0.813 | S | S | * | * | trans | -136.8 | 143.8 | 155.2 | -178.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 320 | L | 30.6 | Very low | 29.5 | Very low | 146 Ų | 146 | 139.9 Ų | 139.9 | 76% | 0.764 | 82% | 0.816 | S | S | * | * | trans | -104.1 | 152.3 | -178.7 | -60.4 | 162 | 0 | 0 | 0 | 109.7 | ||||
| 321 | Q | 28.8 | Very low | 29.5 | Very low | 187 Ų | 187 | 139.8 Ų | 139.8 | 87% | 0.874 | 82% | 0.816 | S | S | * | * | 177.1 | 159.5 | 105.4 | -95.4 | -177.6 | 0.6 | 0 | 0 | 115 | |||||
| 322 | N | 28.6 | Very low | 29.5 | Very low | 132 Ų | 132 | 138.6 Ų | 138.6 | 71% | 0.706 | 81% | 0.813 | S | S | * | * | trans | -45.3 | 151 | -169.8 | -54 | 2.9 | 0 | 0 | 0 | 119.1 | I324 | N322-I324 HydrophobicContact CB-CG1 4.21Š| ||
| 323 | T | 26.6 | Very low | 29.5 | Very low | 134 Ų | 134 | 140.3 Ų | 140.3 | 82% | 0.822 | 81% | 0.812 | S | S | * | * | trans | -89.7 | 136.7 | 144.4 | -58.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 324 | I | 29.5 | Very low | 29.4 | Very low | 146 Ų | 146 | 137.7 Ų | 137.7 | 75% | 0.749 | 81% | 0.81 | S | S | * | * | trans | -124.6 | 143.1 | 169.9 | -64.9 | 177.2 | 0 | 0 | 0 | 108.2 | N322 | N322-I324 HydrophobicContact CB-CG1 4.21Š| ||
| 325 | I | 31.3 | Very low | 29.5 | Very low | 145 Ų | 145 | 139 Ų | 139 | 74% | 0.744 | 81% | 0.811 | S | S | * | * | trans | -117.5 | 119.5 | 177.3 | -52.9 | 173.8 | 0 | 0 | 0 | 108.7 | ||||
| 326 | L | 30 | Very low | 29.5 | Very low | 172 Ų | 172 | 135 Ų | 135 | 90% | 0.901 | 81% | 0.809 | S | S | * | * | trans | -173.7 | 157 | 139.1 | -121.9 | 64.4 | 0 | 0 | 0 | 108.4 | ||||
| 327 | G | 28 | Very low | 29.4 | Very low | 82 Ų | 82 | 133.3 Ų | 133.3 | 85% | 0.845 | 82% | 0.816 | S | S | * | * | trans | -116.6 | 173.1 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 328 | G | 27.9 | Very low | 29.1 | Very low | 70 Ų | 70 | 131.4 Ų | 131.4 | 72% | 0.722 | 82% | 0.816 | S | S | * | * | trans | 170.5 | 106.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 329 | N | 27.2 | Very low | 28.5 | Very low | 166 Ų | 166 | 132.8 Ų | 132.8 | 89% | 0.888 | 82% | 0.823 | S | S | * | * | trans | 44.5 | 118.9 | 147.2 | -57.8 | 19.1 | 0 | 0 | 0 | 121.8 | ||||
| 330 | A | 27.2 | Very low | 28.8 | Very low | 107 Ų | 107 | 131.7 Ų | 131.7 | 88% | 0.884 | 82% | 0.819 | S | S | * | * | trans | -151.9 | 108.4 | 144.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 331 | T | 27.6 | Very low | 28.6 | Very low | 140 Ų | 140 | 130.4 Ų | 130.4 | 86% | 0.859 | 82% | 0.817 | S | S | * | * | trans | -46.8 | 139.4 | 173 | -51 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 332 | S | 27.8 | Very low | 28.4 | Very low | 107 Ų | 107 | 128.1 Ų | 128.1 | 75% | 0.748 | 82% | 0.816 | S | S | * | * | -168.9 | 139.1 | 129.9 | 48.8 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 333 | T | 26 | Very low | 28.2 | Very low | 142 Ų | 142 | 127.7 Ų | 127.7 | 87% | 0.871 | 82% | 0.818 | S | S | * | * | trans | 5.6 | 136.8 | 160.2 | 50 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 334 | G | 26.7 | Very low | 28.2 | Very low | 69 Ų | 69 | 130.1 Ų | 130.1 | 71% | 0.711 | 82% | 0.82 | S | S | * | * | cis | 164.4 | -173.7 | 0.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 335 | Q | 30.8 | Very low | 28 | Very low | 205 Ų | 205 | 127.3 Ų | 127.3 | 96% | 0.958 | 82% | 0.819 | S | S | * | * | trans | 74.4 | 125.8 | -175.1 | -54.7 | -163.6 | 16.2 | 0 | 0 | 117 | ||||
| 336 | A | 28.1 | Very low | 27.7 | Very low | 96 Ų | 96 | 126.5 Ų | 126.5 | 79% | 0.793 | 82% | 0.821 | S | S | * | * | trans | -161 | 135.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 337 | L | 26.4 | Very low | 27.5 | Very low | 187 Ų | 187 | 122.7 Ų | 122.7 | 98% | 0.979 | 81% | 0.814 | S | S | * | * | trans | -171.1 | 142.5 | 162.3 | -137.7 | 66.6 | 0 | 0 | 0 | 107.7 | ||||
| 338 | G | 27.2 | Very low | 27.5 | Very low | 70 Ų | 70 | 123.5 Ų | 123.5 | 72% | 0.722 | 81% | 0.813 | S | S | * | * | cis | -169.7 | 170.9 | -8.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 339 | T | 34 | Very low | 27.4 | Very low | 140 Ų | 140 | 127 Ų | 127 | 86% | 0.859 | 82% | 0.819 | S | S | * | * | trans | -100 | 161.9 | 170 | 54.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 340 | P | 35.2 | Very low | 27.4 | Very low | 122 Ų | 122 | 124.1 Ų | 124.1 | 79% | 0.792 | 81% | 0.808 | S | S | * | * | -146.2 | 163.3 | 95.4 | 38.3 | -22.3 | 0 | 0 | 0 | 117 | |||||
| 341 | T | 26.4 | Very low | 27.6 | Very low | 119 Ų | 119 | 126.1 Ų | 126.1 | 73% | 0.73 | 80% | 0.799 | S | S | * | * | trans | -20.8 | 146 | 154.1 | -32.2 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 342 | T | 24 | Very low | 27.9 | Very low | 139 Ų | 139 | 129.6 Ų | 129.6 | 85% | 0.853 | 80% | 0.797 | S | S | * | * | -160.5 | 139.2 | 123.5 | -77 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 343 | V | 24.5 | Very low | 27.8 | Very low | 123 Ų | 123 | 131.2 Ų | 131.2 | 75% | 0.745 | 80% | 0.802 | S | S | * | * | trans | -49.9 | 145 | 174.4 | 177.8 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 344 | Q | 26.5 | Very low | 27.8 | Very low | 186 Ų | 186 | 127.2 Ų | 127.2 | 87% | 0.869 | 79% | 0.789 | S | S | * | * | -172.8 | 154.7 | 113.8 | -163.5 | 152.5 | -0.3 | 0 | 0 | 112.8 | |||||
| 345 | A | 24.4 | Very low | 28.9 | Very low | 87 Ų | 87 | 130 Ų | 130 | 72% | 0.719 | 79% | 0.794 | S | S | * | * | trans | -144 | 152.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 346 | T | 25.5 | Very low | 28.9 | Very low | 128 Ų | 128 | 128.2 Ų | 128.2 | 79% | 0.785 | 79% | 0.791 | S | S | * | * | trans | -144 | 109.2 | 161.6 | 47.6 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 347 | A | 27 | Very low | 28.8 | Very low | 92 Ų | 92 | 126.5 Ų | 126.5 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | 57.6 | 102.6 | 84 | 0 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 348 | A | 27 | Very low | 29 | Very low | 99 Ų | 99 | 123.6 Ų | 123.6 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | cis | 83.6 | 118.5 | 28.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 349 | V | 25.9 | Very low | 29.2 | Very low | 142 Ų | 142 | 127.3 Ų | 127.3 | 86% | 0.861 | 78% | 0.781 | S | S | * | * | trans | 177.6 | 139.7 | 169.9 | 137.1 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 350 | T | 26.8 | Very low | 29.1 | Very low | 107 Ų | 107 | 124.1 Ų | 124.1 | 66% | 0.656 | 78% | 0.777 | S | S | * | * | cis | -160.7 | 124.1 | -14.3 | -81.7 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 351 | Q | 31.9 | Very low | 29 | Very low | 149 Ų | 149 | 124.2 Ų | 124.2 | 70% | 0.696 | 78% | 0.775 | S | S | * | * | 54.9 | 138.8 | 98 | -112.5 | -170.5 | 76 | 0 | 0 | 114.6 | |||||
| 352 | R | 33.2 | Very low | 29.2 | Very low | 212 Ų | 212 | 124.5 Ų | 124.5 | 80% | 0.8 | 78% | 0.778 | S | S | * | * | cis | -139 | -175 | 17.1 | -68 | -174.9 | 161.7 | -168.4 | -5 | 109.7 | ||||
| 353 | V | 26.4 | Very low | 30 | Very low | 141 Ų | 141 | 123.8 Ų | 123.8 | 86% | 0.855 | 77% | 0.773 | S | S | * | * | cis | -148.2 | 154 | 25.8 | 177.3 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 354 | G | 26.1 | Very low | 30.3 | Very low | 59 Ų | 59 | 123.4 Ų | 123.4 | 61% | 0.608 | 77% | 0.772 | S | S | * | * | trans | -145.2 | -148.5 | 166.8 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 355 | P | 48.9 | Very low | 31 | Very low | 127 Ų | 127 | 120.7 Ų | 120.7 | 83% | 0.825 | 77% | 0.77 | S | S | * | * | cis | -96.5 | -151 | -7.2 | 35.7 | -22.6 | 0 | 0 | 0 | 110 | ||||
| 356 | L | 31.4 | Very low | 32.1 | Very low | 167 Ų | 167 | 122.4 Ų | 122.4 | 87% | 0.874 | 77% | 0.772 | S | S | * | * | cis | -157.8 | 163.9 | 5.5 | -173.3 | 57.3 | 0 | 0 | 0 | 109.4 | ||||
| 357 | G | 26.6 | Very low | 33.1 | Very low | 60 Ų | 60 | 120.5 Ų | 120.5 | 62% | 0.619 | 77% | 0.769 | S | S | * | * | trans | 154.8 | 57.5 | 163.5 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 358 | T | 30.5 | Very low | 34.8 | Very low | 127 Ų | 127 | 121.1 Ų | 121.1 | 78% | 0.779 | 76% | 0.759 | S | S | * | * | trans | 41.8 | 105.8 | 158.3 | 55.1 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 359 | T | 31.6 | Very low | 37.1 | Very low | 147 Ų | 147 | 120.1 Ų | 120.1 | 90% | 0.902 | 74% | 0.742 | S | S | * | * | 55.8 | 103 | 129.3 | -41.2 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 360 | G | 30.4 | Very low | 39.5 | Very low | 74 Ų | 74 | 117.4 Ų | 117.4 | 76% | 0.763 | 74% | 0.735 | S | S | * | * | trans | -136.7 | 137.2 | 163.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 361 | V | 34.1 | Very low | 42.1 | Very low | 124 Ų | 124 | 118.1 Ų | 118.1 | 75% | 0.752 | 73% | 0.731 | S | S | * | * | trans | -79.3 | 138.9 | 174.6 | 176.4 | 0 | 0 | 0 | 0 | 109.4 | V363 | V361-V363 PolarHBondContact O-N 2.94Š| ||
| 362 | P | 30.2 | Very low | 44.6 | Very low | 124 Ų | 124 | 112.5 Ų | 112.5 | 81% | 0.805 | 71% | 0.707 | S | S | * | * | trans | -70.4 | 93.7 | 176 | 28.8 | -35.1 | 0 | 0 | 0 | 111.2 | ||||
| 363 | V | 40.5 | Very low | 47.2 | Very low | 124 Ų | 124 | 105.4 Ų | 105.4 | 75% | 0.752 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 117 | 173.4 | -179.7 | 0 | 0 | 0 | 0 | 109.5 | V361 | V361-V363 PolarHBondContact O-N 2.94Š|
| 364 | T | 31.9 | Very low | 50.2 | Low | 115 Ų | 115 | 103.6 Ų | 103.6 | 71% | 0.706 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 131.5 | 172.4 | 36.1 | 0 | 0 | 0 | 0 | 111.3 | T366 | T364-T366 PolarHBondContact O-N 2.87Š|
| 365 | P | 41.4 | Very low | 53.4 | Low | 129 Ų | 129 | 101.5 Ų | 101.5 | 84% | 0.838 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 119.5 | 179.4 | 26.5 | -33.7 | 0 | 0 | 0 | 110.5 | ||
| 366 | T | 46.9 | Very low | 55.5 | Low | 124 Ų | 124 | 95.7 Ų | 95.7 | 76% | 0.761 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 128.4 | 178.9 | -60.1 | 0 | 0 | 0 | 0 | 110.2 | T364 I368 | T364-T366 PolarHBondContact O-N 2.87Å; T366-I368 PolarHBondContact O-N 3.32Å |
| 367 | A | 46.2 | Very low | 58.5 | Low | 88 Ų | 88 | 94.4 Ų | 94.4 | 73% | 0.727 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 122.8 | 179 | 0 | 0 | 0 | 0 | 0 | 111.7 | T369 | A367-T369 PolarHBondContact O-N 2.99Š|
| 368 | I | 63.3 | Low | 61.7 | Low | 105 Ų | 105 | 95.7 Ų | 95.7 | 54% | 0.538 | 58% | 0.58 | S | S | . | * | trans | -77.8 | 111.2 | -178.3 | -56.7 | 176.8 | 0 | 0 | 0 | 109.2 | T366 T372 L373 | T366-I368 PolarHBondContact O-N 3.32Å; I368-T372 HydrophobicContact CG2-CG2 4.18Å; I368-L373 HydrophobicContact CG2-CB 4.49Å | ||
| 369 | T | 74.8 | Confident | 64.8 | Low | 77 Ų | 77 | 89.7 Ų | 89.7 | 47% | 0.472 | 54% | 0.543 | S | S | . | . | trans | -75.1 | 157 | 175.1 | 73.6 | 0 | 0 | 0 | 0 | 111.6 | A367 E371 T372 L373 | A367-T369 PolarHBondContact O-N 2.99Å; T369-E371 PolarHBondContact O-N 2.91Å; T369-T372 WeakPolarHBondContact O-CB 3.32Å; T369-T372 PolarHBondContact O-N 3.4Å; T369-T372 PolarHBondContact OG1-N 3.09Å; T369-T372 PolarHBondContact OG1-OG1 3.05Å; T369-T372 VanDerWaalsContact OG1-OG1 3.11Å; T369-L373 PolarHBondContact O-N 2.97Å | ||
| 370 | A | 77.1 | Confident | 67.7 | Low | 86 Ų | 86 | 83.2 Ų | 83.2 | 71% | 0.711 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.7 | -35.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | L373 E374 | A370-L373 PolarHBondContact O-N 3.39Å; A370-E374 PolarHBondContact O-N 2.71Å |
| 371 | E | 80.5 | Confident | 70.8 | Confident | 121 Ų | 121 | 84.9 Ų | 84.9 | 57% | 0.565 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.3 | -43.7 | 172 | -71 | -163.3 | -171.7 | 0 | 0 | 112.2 | T369 L373 E374 N375 R442 | T369-E371 PolarHBondContact O-N 2.91Å; E371-L373 VanDerWaalsContact C-N 3.29Å; E371-L373 PolarHBondContact O-N 3.13Å; E371-E374 PolarHBondContact O-N 3.46Å; E371-N375 WeakPolarHBondContact O-CB 3.13Å; E371-N375 PolarHBondContact O-N 3.12Å; E371-N375 PolarHBondContact O-ND2 2.82Å; E371-R442 IonicContact OE2-NH1 3.65Å; E371-R442 PolarHBondContact OE2-NH1 2.92Å |
| 372 | T | 83.8 | Confident | 73.8 | Confident | 32 Ų | 32 | 81.2 Ų | 81.2 | 20% | 0.196 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -59.2 | -43.9 | 177 | -61.8 | 0 | 0 | 0 | 0 | 110.3 | I368 T369 E374 N375 V376 A446 | I368-T372 HydrophobicContact CG2-CG2 4.18Å; T369-T372 WeakPolarHBondContact O-CB 3.32Å; T369-T372 PolarHBondContact O-N 3.4Å; T369-T372 PolarHBondContact OG1-N 3.09Å; T369-T372 PolarHBondContact OG1-OG1 3.05Å; T369-T372 VanDerWaalsContact OG1-OG1 3.11Å; T372-E374 PolarHBondContact O-N 2.97Å; T372-N375 PolarHBondContact O-N 3.08Å; T372-V376 HydrophobicContact CG2-CG2 4.37Å; T372-V376 VanDerWaalsContact O-CG2 3.27Å; T372-V376 WeakPolarHBondContact O-CG2 3.3Å; T372-V376 PolarHBondContact O-N 3.4Å; T372-A446 HydrophobicContact CG2-CB 3.81Å |
| 373 | L | 87.9 | Confident | 76.9 | Confident | 62 Ų | 62 | 75.3 Ų | 75.3 | 33% | 0.325 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -64.2 | -36.9 | 177.4 | -173.5 | 62.6 | 0 | 0 | 0 | 113.1 | I368 T369 A370 E371 K377 M450 | I368-L373 HydrophobicContact CG2-CB 4.49Å; T369-L373 PolarHBondContact O-N 2.97Å; A370-L373 PolarHBondContact O-N 3.39Å; E371-L373 VanDerWaalsContact C-N 3.29Å; E371-L373 PolarHBondContact O-N 3.13Å; L373-K377 WeakPolarHBondContact O-CG 3.44Å; L373-K377 PolarHBondContact O-N 3.21Å; L373-K377 VanDerWaalsContact O-N 3.07Å; L373-M450 HydrophobicContact CD1-CE 4.07Å; L373-M450 HydrophobicContact CD1-SD 4Å |
| 374 | E | 90.8 | Very high | 79.4 | Confident | 104 Ų | 104 | 70.5 Ų | 70.5 | 49% | 0.486 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -68.1 | -39.3 | 174.3 | -153.9 | -148.7 | 167.7 | 0 | 0 | 111.7 | A370 E371 T372 K377 K378 | A370-E374 PolarHBondContact O-N 2.71Å; E371-E374 PolarHBondContact O-N 3.46Å; T372-E374 PolarHBondContact O-N 2.97Å; E374-K377 PolarHBondContact O-N 2.82Å; E374-K378 VanDerWaalsContact O-CG 3.31Å; E374-K378 WeakPolarHBondContact O-CG 3.28Å; E374-K378 PolarHBondContact O-N 3.44Å; E374-K378 WeakPolarHBondContact OE1-CE 3.39Å; E374-K378 IonicContact OE1-NZ 2.62Å; E374-K378 PolarHBondContact OE1-NZ 2.9Å; E374-K378 IonicContact OE2-NZ 3.39Å; E374-K378 PolarHBondContact OE2-NZ 2.69Å |
| 375 | N | 91.4 | Very high | 82.4 | Confident | 14 Ų | 14 | 67.7 Ų | 67.7 | 8% | 0.075 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -67.7 | -39.8 | 176.1 | -70.4 | -50.1 | 0 | 0 | 0 | 112.1 | E371 T372 K378 C379 F439 | E371-N375 WeakPolarHBondContact O-CB 3.13Å; E371-N375 PolarHBondContact O-N 3.12Å; E371-N375 PolarHBondContact O-ND2 2.82Å; T372-N375 PolarHBondContact O-N 3.08Å; N375-K378 PolarHBondContact O-N 3.26Å; N375-C379 VanDerWaalsContact O-CB 3.3Å; N375-C379 WeakPolarHBondContact O-CB 3.27Å; N375-C379 PolarHBondContact O-N 2.84Å; N375-F439 HydrophobicContact CB-CE2 4.27Å |
| 376 | V | 94.6 | Very high | 84.9 | Confident | 6 Ų | 6 | 62.4 Ų | 62.4 | 4% | 0.036 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -58.7 | -47 | 171.4 | 169.1 | 0 | 0 | 0 | 0 | 111.1 | T372 K378 C379 G380 A446 L447 M450 | T372-V376 HydrophobicContact CG2-CG2 4.37Å; T372-V376 VanDerWaalsContact O-CG2 3.27Å; T372-V376 WeakPolarHBondContact O-CG2 3.3Å; T372-V376 PolarHBondContact O-N 3.4Å; V376-K378 PolarHBondContact O-N 3.14Å; V376-C379 PolarHBondContact O-N 3.22Å; V376-C379 VanDerWaalsContact O-N 3.13Å; V376-G380 PolarHBondContact O-N 3.4Å; V376-A446 HydrophobicContact CG2-CB 3.49Å; V376-A446 VanDerWaalsContact CG2-CB 3.49Å; V376-L447 HydrophobicContact CG1-CB 4.1Å; V376-L447 HydrophobicContact CG1-CD1 3.84Å; V376-M450 HydrophobicContact CG1-SD 3.82Å |
| 377 | K | 93.8 | Very high | 87.1 | Confident | 139 Ų | 139 | 56.5 Ų | 56.5 | 60% | 0.604 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -60.9 | -41.5 | 176.4 | -74.2 | 173.7 | -179.8 | 180 | 0 | 112.3 | L373 E374 N381 | L373-K377 WeakPolarHBondContact O-CG 3.44Å; L373-K377 PolarHBondContact O-N 3.21Å; L373-K377 VanDerWaalsContact O-N 3.07Å; E374-K377 PolarHBondContact O-N 2.82Å; K377-N381 VanDerWaalsContact O-CB 3.31Å; K377-N381 WeakPolarHBondContact O-CB 3.32Å; K377-N381 PolarHBondContact O-N 3.32Å |
| 378 | K | 93.6 | Very high | 89.3 | Confident | 88 Ų | 88 | 56.4 Ų | 56.4 | 38% | 0.383 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -63.8 | -39.6 | 173.1 | -70.6 | 163.7 | -175.2 | 165.4 | 0 | 112 | E374 N375 V376 N381 F382 F439 | E374-K378 VanDerWaalsContact O-CG 3.31Å; E374-K378 WeakPolarHBondContact O-CG 3.28Å; E374-K378 PolarHBondContact O-N 3.44Å; E374-K378 WeakPolarHBondContact OE1-CE 3.39Å; E374-K378 IonicContact OE1-NZ 2.62Å; E374-K378 PolarHBondContact OE1-NZ 2.9Å; E374-K378 IonicContact OE2-NZ 3.39Å; E374-K378 PolarHBondContact OE2-NZ 2.69Å; N375-K378 PolarHBondContact O-N 3.26Å; V376-K378 PolarHBondContact O-N 3.14Å; K378-N381 PolarHBondContact O-N 3.09Å; K378-F382 VanDerWaalsContact O-CB 3.31Å; K378-F382 WeakPolarHBondContact O-CB 3.39Å; K378-F382 PolarHBondContact O-N 2.76Å; K378-F439 HydrophobicContact CB-CE2 4.04Å; K378-F439 HydrophobicContact CB-CZ 3.69Å |
| 379 | C | 95.3 | Very high | 90.6 | Very high | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -70.3 | -44.5 | -178.1 | -171 | 0 | 0 | 0 | 0 | 111.4 | N375 V376 F382 L383 F439 S443 L447 | N375-C379 VanDerWaalsContact O-CB 3.3Å; N375-C379 WeakPolarHBondContact O-CB 3.27Å; N375-C379 PolarHBondContact O-N 2.84Å; V376-C379 PolarHBondContact O-N 3.22Å; V376-C379 VanDerWaalsContact O-N 3.13Å; C379-F382 PolarHBondContact O-N 3.26Å; C379-L383 WeakPolarHBondContact O-CG 3.29Å; C379-L383 PolarHBondContact O-N 3.03Å; C379-F439 HydrophobicContact CB-CE1 4.11Å; C379-F439 HydrophobicContact CB-CZ 3.87Å; C379-S443 VanDerWaalsContact CB-CB 3.49Å; C379-L447 HydrophobicContact CB-CD2 4.06Å |
| 380 | G | 94.2 | Very high | 91.1 | Very high | 11 Ų | 11 | 53 Ų | 53 | 11% | 0.113 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -58.7 | -48.6 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | V376 F382 L383 S384 | V376-G380 PolarHBondContact O-N 3.4Å; G380-F382 VanDerWaalsContact C-N 3.33Å; G380-F382 PolarHBondContact O-N 2.97Å; G380-L383 PolarHBondContact O-N 2.84Å; G380-S384 PolarHBondContact O-N 3.19Å; G380-S384 PolarHBondContact O-OG 2.93Å |
| 381 | N | 95.3 | Very high | 91.6 | Very high | 110 Ų | 110 | 50.9 Ų | 50.9 | 59% | 0.588 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -59.5 | -40.5 | 177.2 | -173 | -84.3 | 0 | 0 | 0 | 112.9 | K377 K378 T385 | K377-N381 VanDerWaalsContact O-CB 3.31Å; K377-N381 WeakPolarHBondContact O-CB 3.32Å; K377-N381 PolarHBondContact O-N 3.32Å; K378-N381 PolarHBondContact O-N 3.09Å; N381-T385 VanDerWaalsContact O-CB 3.25Å; N381-T385 WeakPolarHBondContact O-CB 3.2Å; N381-T385 PolarHBondContact O-N 2.75Å; N381-T385 PolarHBondContact O-OG1 3.31Å |
| 382 | F | 95.9 | Very high | 91.7 | Very high | 46 Ų | 46 | 49.4 Ų | 49.4 | 20% | 0.202 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.2 | -50.8 | 173.8 | 167.5 | -103.4 | 0 | 0 | 0 | 112 | K378 C379 G380 T385 L386 F420 L424 L436 L440 | K378-F382 VanDerWaalsContact O-CB 3.31Å; K378-F382 WeakPolarHBondContact O-CB 3.39Å; K378-F382 PolarHBondContact O-N 2.76Å; C379-F382 PolarHBondContact O-N 3.26Å; G380-F382 VanDerWaalsContact C-N 3.33Å; G380-F382 PolarHBondContact O-N 2.97Å; F382-T385 PolarHBondContact O-N 3.3Å; F382-T385 VanDerWaalsContact O-N 3.15Å; F382-L386 HydrophobicContact CD1-CD1 4.34Å; F382-L386 HydrophobicContact CE1-CD1 3.67Å; F382-L386 HydrophobicContact CE1-CG 4.44Å; F382-L386 HydrophobicContact CE2-CD1 4.17Å; F382-L386 HydrophobicContact CE2-CD2 4.34Å; F382-L386 HydrophobicContact CE2-CG 4.21Å; F382-L386 HydrophobicContact CZ-CD1 3.58Å; F382-L386 HydrophobicContact CZ-CD2 4.43Å; F382-L386 HydrophobicContact CZ-CG 4.12Å; F382-L386 PolarHBondContact O-N 3.24Å; F382-F420 HydrophobicContact CE1-CE1 4.34Å; F382-L424 HydrophobicContact CZ-CD2 4.47Å; F382-L436 HydrophobicContact CE1-CD1 3.95Å; F382-L436 HydrophobicContact CE2-CD1 4.13Å; F382-L436 HydrophobicContact CZ-CD1 3.67Å; F382-L436 HydrophobicContact CZ-CD2 3.92Å; F382-L436 HydrophobicContact CZ-CG 4.43Å; F382-L440 HydrophobicContact CD1-CD2 4.36Å; F382-L440 HydrophobicContact CE1-CD2 4.24Å |
| 383 | L | 95.4 | Very high | 91 | Very high | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.5 | -43.4 | 179.7 | -63.8 | 176.2 | 0 | 0 | 0 | 111.8 | C379 G380 T385 L386 I387 V407 L410 L411 F420 L447 F457 | C379-L383 WeakPolarHBondContact O-CG 3.29Å; C379-L383 PolarHBondContact O-N 3.03Å; G380-L383 PolarHBondContact O-N 2.84Å; L383-T385 VanDerWaalsContact C-N 3.27Å; L383-T385 PolarHBondContact O-N 3.35Å; L383-L386 HydrophobicContact CD2-CD1 4.42Å; L383-L386 PolarHBondContact O-N 3.49Å; L383-I387 WeakPolarHBondContact O-CD1 3.31Å; L383-I387 WeakPolarHBondContact O-CG1 3.39Å; L383-I387 PolarHBondContact O-N 3.16Å; L383-V407 HydrophobicContact CB-CG1 4.03Å; L383-V407 HydrophobicContact CD1-CG1 4.32Å; L383-V407 HydrophobicContact CD2-CG1 4.19Å; L383-V407 HydrophobicContact CD2-CG2 4.11Å; L383-V407 HydrophobicContact CG-CG1 4.4Å; L383-L410 HydrophobicContact CD2-CD2 4.04Å; L383-L411 HydrophobicContact CD1-CD2 3.95Å; L383-L411 HydrophobicContact CD1-CG 4.31Å; L383-F420 HydrophobicContact CD2-CE1 4.49Å; L383-F420 HydrophobicContact CD2-CZ 3.99Å; L383-L447 HydrophobicContact CD1-CD2 3.86Å; L383-F457 HydrophobicContact CB-CE1 3.87Å; L383-F457 HydrophobicContact CB-CZ 4.05Å |
| 384 | S | 94.1 | Very high | 90.4 | Very high | 23 Ų | 23 | 57.4 Ų | 57.4 | 16% | 0.161 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.1 | -36.1 | 172.4 | -63 | 0 | 0 | 0 | 0 | 112.4 | G380 I387 K388 F457 S461 | G380-S384 PolarHBondContact O-N 3.19Å; G380-S384 PolarHBondContact O-OG 2.93Å; S384-I387 PolarHBondContact O-N 3.08Å; S384-K388 WeakPolarHBondContact O-CB 3.35Å; S384-K388 VanDerWaalsContact O-CG 3.26Å; S384-K388 WeakPolarHBondContact O-CG 3.15Å; S384-K388 PolarHBondContact O-N 2.97Å; S384-F457 VanDerWaalsContact OG-CZ 3.28Å; S384-F457 WeakPolarHBondContact OG-CZ 2.99Å; S384-S461 WeakPolarHBondContact CA-OG 3.5Å; S384-S461 WeakPolarHBondContact CB-OG 3.21Å; S384-S461 PolarHBondContact OG-OG 2.98Å |
| 385 | T | 94.6 | Very high | 90.1 | Very high | 57 Ų | 57 | 56.7 Ų | 56.7 | 35% | 0.35 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -70.2 | -39.3 | 177.1 | -60.7 | 0 | 0 | 0 | 0 | 111.5 | N381 F382 L383 K388 L389 | N381-T385 VanDerWaalsContact O-CB 3.25Å; N381-T385 WeakPolarHBondContact O-CB 3.2Å; N381-T385 PolarHBondContact O-N 2.75Å; N381-T385 PolarHBondContact O-OG1 3.31Å; F382-T385 PolarHBondContact O-N 3.3Å; F382-T385 VanDerWaalsContact O-N 3.15Å; L383-T385 VanDerWaalsContact C-N 3.27Å; L383-T385 PolarHBondContact O-N 3.35Å; T385-K388 PolarHBondContact O-N 3.18Å; T385-L389 HydrophobicContact CG2-CD1 3.87Å; T385-L389 HydrophobicContact CG2-CG 4.21Å; T385-L389 WeakPolarHBondContact O-CB 3.39Å; T385-L389 VanDerWaalsContact O-CG 3.27Å; T385-L389 WeakPolarHBondContact O-CG 3.39Å; T385-L389 PolarHBondContact O-N 3.31Å |
| 386 | L | 93.7 | Very high | 89.8 | Confident | 18 Ų | 18 | 58.8 Ų | 58.8 | 9% | 0.094 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -59 | -47.9 | 171.2 | -71.5 | 179 | 0 | 0 | 0 | 111.6 | F382 L383 K388 L389 A390 V403 F420 L424 L428 | F382-L386 HydrophobicContact CD1-CD1 4.34Å; F382-L386 HydrophobicContact CE1-CD1 3.67Å; F382-L386 HydrophobicContact CE1-CG 4.44Å; F382-L386 HydrophobicContact CE2-CD1 4.17Å; F382-L386 HydrophobicContact CE2-CD2 4.34Å; F382-L386 HydrophobicContact CE2-CG 4.21Å; F382-L386 HydrophobicContact CZ-CD1 3.58Å; F382-L386 HydrophobicContact CZ-CD2 4.43Å; F382-L386 HydrophobicContact CZ-CG 4.12Å; F382-L386 PolarHBondContact O-N 3.24Å; L383-L386 HydrophobicContact CD2-CD1 4.42Å; L383-L386 PolarHBondContact O-N 3.49Å; L386-K388 VanDerWaalsContact C-N 3.32Å; L386-K388 PolarHBondContact O-N 3.01Å; L386-L389 PolarHBondContact O-N 3.36Å; L386-A390 VanDerWaalsContact O-CB 3.31Å; L386-A390 WeakPolarHBondContact O-CB 3.41Å; L386-A390 PolarHBondContact O-N 3Å; L386-V403 HydrophobicContact CB-CG1 4.42Å; L386-F420 HydrophobicContact CD1-CZ 3.92Å; L386-L424 HydrophobicContact CD1-CD1 4.21Å; L386-L424 HydrophobicContact CD1-CD2 3.69Å; L386-L424 HydrophobicContact CD2-CD1 4.49Å; L386-L424 HydrophobicContact CD2-CD2 4.24Å; L386-L428 HydrophobicContact CD2-CD1 4.27Å |
| 387 | I | 92.8 | Very high | 89.4 | Confident | 0 Ų | 0 | 63.6 Ų | 63.6 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -60.3 | -42.5 | 178.4 | -65.8 | 158 | 0 | 0 | 0 | 111.1 | L383 S384 S391 V407 F457 I458 L462 | L383-I387 WeakPolarHBondContact O-CD1 3.31Å; L383-I387 WeakPolarHBondContact O-CG1 3.39Å; L383-I387 PolarHBondContact O-N 3.16Å; S384-I387 PolarHBondContact O-N 3.08Å; I387-S391 WeakPolarHBondContact O-CB 3.49Å; I387-S391 PolarHBondContact O-N 3.47Å; I387-S391 PolarHBondContact O-OG 3.13Å; I387-V407 HydrophobicContact CD1-CB 4.48Å; I387-V407 HydrophobicContact CD1-CG1 3.95Å; I387-V407 HydrophobicContact CG1-CG1 4.48Å; I387-V407 HydrophobicContact CG1-CG2 4.36Å; I387-F457 HydrophobicContact CD1-CD1 4.35Å; I387-F457 HydrophobicContact CD1-CE1 4.07Å; I387-I458 HydrophobicContact CD1-CB 4.39Å; I387-I458 HydrophobicContact CD1-CG1 3.86Å; I387-I458 HydrophobicContact CG2-CG2 4.47Å; I387-L462 HydrophobicContact CG2-CD2 3.69Å; I387-L462 HydrophobicContact CG2-CG 3.98Å |
| 388 | K | 92.4 | Very high | 89.1 | Confident | 86 Ų | 86 | 64.1 Ų | 64.1 | 37% | 0.374 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -67.3 | -39.4 | 177.1 | -74.5 | 175.8 | -178.8 | -176.3 | 0 | 113.1 | S384 T385 L386 N392 S461 | S384-K388 WeakPolarHBondContact O-CB 3.35Å; S384-K388 VanDerWaalsContact O-CG 3.26Å; S384-K388 WeakPolarHBondContact O-CG 3.15Å; S384-K388 PolarHBondContact O-N 2.97Å; T385-K388 PolarHBondContact O-N 3.18Å; L386-K388 VanDerWaalsContact C-N 3.32Å; L386-K388 PolarHBondContact O-N 3.01Å; K388-N392 WeakPolarHBondContact O-CB 3.21Å; K388-N392 PolarHBondContact O-N 3.47Å; K388-N392 VanDerWaalsContact O-N 3.12Å; K388-S461 WeakPolarHBondContact CE-O 3.3Å; K388-S461 WeakPolarHBondContact CG-O 3.38Å |
| 389 | L | 89.7 | Confident | 88.9 | Confident | 109 Ų | 109 | 61 Ų | 61 | 57% | 0.571 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -71.9 | -41.1 | 178.1 | -72.6 | 173.8 | 0 | 0 | 0 | 111.9 | T385 L386 N392 | T385-L389 HydrophobicContact CG2-CD1 3.87Å; T385-L389 HydrophobicContact CG2-CG 4.21Å; T385-L389 WeakPolarHBondContact O-CB 3.39Å; T385-L389 VanDerWaalsContact O-CG 3.27Å; T385-L389 WeakPolarHBondContact O-CG 3.39Å; T385-L389 PolarHBondContact O-N 3.31Å; L386-L389 PolarHBondContact O-N 3.36Å; L389-N392 WeakPolarHBondContact O-CB 3.42Å; L389-N392 PolarHBondContact O-N 3.48Å |
| 390 | A | 87 | Confident | 88.7 | Confident | 2 Ų | 2 | 61.9 Ų | 61.9 | 2% | 0.017 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -65.3 | -43.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | L386 N392 Q395 T400 V403 | L386-A390 VanDerWaalsContact O-CB 3.31Å; L386-A390 WeakPolarHBondContact O-CB 3.41Å; L386-A390 PolarHBondContact O-N 3Å; A390-N392 PolarHBondContact O-N 2.85Å; A390-Q395 WeakPolarHBondContact O-CB 3.38Å; A390-T400 PolarHBondContact O-OG1 3.38Å; A390-V403 HydrophobicContact CB-CB 3.85Å; A390-V403 HydrophobicContact CB-CG1 3.78Å; A390-V403 HydrophobicContact CB-CG2 4.14Å |
| 391 | S | 86.3 | Confident | 88.5 | Confident | 41 Ų | 41 | 64.1 Ų | 64.1 | 29% | 0.287 | 37% | 0.368 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.6 | 3.5 | -179.8 | -47.2 | 0 | 0 | 0 | 0 | 114.1 | I387 T400 K404 L462 | I387-S391 WeakPolarHBondContact O-CB 3.49Å; I387-S391 PolarHBondContact O-N 3.47Å; I387-S391 PolarHBondContact O-OG 3.13Å; S391-T400 WeakPolarHBondContact OG-CG2 3.24Å; S391-K404 WeakPolarHBondContact OG-CE 3.48Å; S391-K404 PolarHBondContact OG-NZ 2.64Å; S391-L462 WeakPolarHBondContact OG-CD2 3.37Å |
| 392 | N | 82.4 | Confident | 88.5 | Confident | 90 Ų | 90 | 60.9 Ų | 60.9 | 48% | 0.481 | 35% | 0.353 | S | S | . | . | S | Bend | trans | -75.5 | 133.9 | 168.3 | -166.8 | 3 | 0 | 0 | 0 | 108 | K388 L389 A390 K394 Q395 | K388-N392 WeakPolarHBondContact O-CB 3.21Å; K388-N392 PolarHBondContact O-N 3.47Å; K388-N392 VanDerWaalsContact O-N 3.12Å; L389-N392 WeakPolarHBondContact O-CB 3.42Å; L389-N392 PolarHBondContact O-N 3.48Å; A390-N392 PolarHBondContact O-N 2.85Å; N392-K394 PolarHBondContact O-N 3.03Å; N392-Q395 PolarHBondContact O-N 2.96Å |
| 393 | G | 70.3 | Confident | 88.4 | Confident | 81 Ų | 81 | 58.7 Ų | 58.7 | 84% | 0.835 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.4 | 25 | -167.4 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||
| 394 | K | 75.4 | Confident | 88.3 | Confident | 180 Ų | 180 | 61.3 Ų | 61.3 | 78% | 0.783 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.1 | 3.3 | 172.4 | -59.5 | -172.6 | 177.7 | -172.7 | 0 | 112.9 | N392 | N392-K394 PolarHBondContact O-N 3.03Š|
| 395 | Q | 83.4 | Confident | 88.3 | Confident | 90 Ų | 90 | 65.8 Ų | 65.8 | 42% | 0.421 | 37% | 0.373 | S | S | . | . | S | Bend | trans | -115.4 | 161.7 | 174.3 | -57.8 | -69.4 | -102.9 | 0 | 0 | 109.8 | A390 N392 | A390-Q395 WeakPolarHBondContact O-CB 3.38Å; N392-Q395 PolarHBondContact O-N 2.96Å |
| 396 | S | 86.3 | Confident | 88.3 | Confident | 57 Ų | 57 | 63.6 Ų | 63.6 | 40% | 0.399 | 36% | 0.359 | S | S | . | . | trans | -71 | 154.1 | 176.3 | 68.5 | 0 | 0 | 0 | 0 | 110.9 | E398 T399 T400 | S396-E398 PolarHBondContact O-N 3.33Å; S396-T399 PolarHBondContact O-N 2.94Å; S396-T399 VanDerWaalsContact OG-CB 3.25Å; S396-T399 WeakPolarHBondContact OG-CB 3.43Å; S396-T399 PolarHBondContact OG-N 3.3Å; S396-T399 PolarHBondContact OG-OG1 3.48Å; S396-T399 VanDerWaalsContact OG-OG1 3.12Å; S396-T400 WeakPolarHBondContact O-CB 3.25Å; S396-T400 PolarHBondContact O-N 2.94Å; S396-T400 PolarHBondContact O-OG1 3.28Å | ||
| 397 | S | 85.9 | Confident | 88.4 | Confident | 107 Ų | 107 | 62.8 Ų | 62.8 | 75% | 0.748 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -60.1 | -36.5 | 173.5 | -165.7 | 0 | 0 | 0 | 0 | 111.4 | T400 A401 | S397-T400 WeakPolarHBondContact O-CB 3.41Å; S397-T400 PolarHBondContact O-N 3.24Å; S397-A401 PolarHBondContact O-N 2.84Å |
| 398 | E | 87.9 | Confident | 88.5 | Confident | 151 Ų | 151 | 65.5 Ų | 65.5 | 71% | 0.706 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -60.8 | -57 | 175.4 | -173.5 | 174.9 | -170 | 0 | 0 | 111.8 | S396 T400 A401 T402 | S396-E398 PolarHBondContact O-N 3.33Å; E398-T400 PolarHBondContact O-N 2.98Å; E398-A401 WeakPolarHBondContact O-CA 3.26Å; E398-A401 WeakPolarHBondContact O-CB 3.44Å; E398-A401 PolarHBondContact O-N 2.26Å; E398-T402 PolarHBondContact O-N 2.47Å; E398-T402 PolarHBondContact O-OG1 2.77Å; E398-T402 VanDerWaalsContact O-OG1 3.11Å |
| 399 | T | 88.3 | Confident | 88.6 | Confident | 22 Ų | 22 | 62.9 Ų | 62.9 | 14% | 0.135 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -59.7 | -33.3 | 175.6 | -67.8 | 0 | 0 | 0 | 0 | 112.2 | S396 V403 E427 L428 | S396-T399 PolarHBondContact O-N 2.94Å; S396-T399 VanDerWaalsContact OG-CB 3.25Å; S396-T399 WeakPolarHBondContact OG-CB 3.43Å; S396-T399 PolarHBondContact OG-N 3.3Å; S396-T399 PolarHBondContact OG-OG1 3.48Å; S396-T399 VanDerWaalsContact OG-OG1 3.12Å; T399-V403 HydrophobicContact CG2-CG2 4.35Å; T399-V403 WeakPolarHBondContact O-CB 3.35Å; T399-V403 VanDerWaalsContact O-CG2 3.3Å; T399-V403 WeakPolarHBondContact O-CG2 3.4Å; T399-V403 PolarHBondContact O-N 3.42Å; T399-E427 VanDerWaalsContact CA-OE1 3.22Å; T399-E427 WeakPolarHBondContact CA-OE1 3.15Å; T399-E427 VanDerWaalsContact CB-OE1 3.25Å; T399-E427 WeakPolarHBondContact CB-OE1 3.43Å; T399-E427 HydrophobicContact CG2-CG 4.08Å; T399-E427 WeakPolarHBondContact CG2-OE1 3.4Å; T399-E427 PolarHBondContact OG1-OE1 3.46Å; T399-L428 HydrophobicContact CG2-CD2 3.9Å |
| 400 | T | 90.7 | Very high | 88.9 | Confident | 19 Ų | 19 | 57.7 Ų | 57.7 | 12% | 0.117 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -63.4 | -40.5 | 173.1 | -55.7 | 0 | 0 | 0 | 0 | 112.1 | A390 S391 S396 S397 E398 K404 | A390-T400 PolarHBondContact O-OG1 3.38Å; S391-T400 WeakPolarHBondContact OG-CG2 3.24Å; S396-T400 WeakPolarHBondContact O-CB 3.25Å; S396-T400 PolarHBondContact O-N 2.94Å; S396-T400 PolarHBondContact O-OG1 3.28Å; S397-T400 WeakPolarHBondContact O-CB 3.41Å; S397-T400 PolarHBondContact O-N 3.24Å; E398-T400 PolarHBondContact O-N 2.98Å; T400-K404 HydrophobicContact CG2-CD 4.43Å; T400-K404 WeakPolarHBondContact O-CD 3.36Å; T400-K404 VanDerWaalsContact O-CG 3.28Å; T400-K404 WeakPolarHBondContact O-CG 3.37Å; T400-K404 PolarHBondContact O-N 3.37Å |
| 401 | A | 91.6 | Very high | 89.2 | Confident | 57 Ų | 57 | 58.1 Ų | 58.1 | 47% | 0.471 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -69.6 | -48.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | S397 E398 V403 K404 E405 | S397-A401 PolarHBondContact O-N 2.84Å; E398-A401 WeakPolarHBondContact O-CA 3.26Å; E398-A401 WeakPolarHBondContact O-CB 3.44Å; E398-A401 PolarHBondContact O-N 2.26Å; A401-V403 VanDerWaalsContact C-N 3.35Å; A401-V403 PolarHBondContact O-N 2.93Å; A401-K404 WeakPolarHBondContact O-CB 3.34Å; A401-K404 PolarHBondContact O-N 2.89Å; A401-K404 VanDerWaalsContact O-N 3.09Å; A401-E405 PolarHBondContact O-N 3.46Å |
| 402 | T | 93.7 | Very high | 89.5 | Confident | 43 Ų | 43 | 59.8 Ų | 59.8 | 26% | 0.264 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -56.9 | -45 | 178.8 | -51.1 | 0 | 0 | 0 | 0 | 111.9 | E398 K404 E405 L406 E427 | E398-T402 PolarHBondContact O-N 2.47Å; E398-T402 PolarHBondContact O-OG1 2.77Å; E398-T402 VanDerWaalsContact O-OG1 3.11Å; T402-K404 PolarHBondContact O-N 2.96Å; T402-E405 PolarHBondContact O-N 2.93Å; T402-L406 HydrophobicContact CG2-CD1 4.08Å; T402-L406 HydrophobicContact CG2-CG 4.37Å; T402-L406 WeakPolarHBondContact O-CB 3.42Å; T402-L406 VanDerWaalsContact O-CG 3.22Å; T402-L406 WeakPolarHBondContact O-CG 3.4Å; T402-L406 PolarHBondContact O-N 3.06Å; T402-E427 HydrophobicContact CG2-CG 3.93Å |
| 403 | V | 94.5 | Very high | 89.8 | Confident | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.2 | -37.3 | 177.6 | 172.4 | 0 | 0 | 0 | 0 | 112 | L386 A390 T399 A401 V407 L424 E427 L428 | L386-V403 HydrophobicContact CB-CG1 4.42Å; A390-V403 HydrophobicContact CB-CB 3.85Å; A390-V403 HydrophobicContact CB-CG1 3.78Å; A390-V403 HydrophobicContact CB-CG2 4.14Å; T399-V403 HydrophobicContact CG2-CG2 4.35Å; T399-V403 WeakPolarHBondContact O-CB 3.35Å; T399-V403 VanDerWaalsContact O-CG2 3.3Å; T399-V403 WeakPolarHBondContact O-CG2 3.4Å; T399-V403 PolarHBondContact O-N 3.42Å; A401-V403 VanDerWaalsContact C-N 3.35Å; A401-V403 PolarHBondContact O-N 2.93Å; V403-V407 WeakPolarHBondContact O-CG2 3.35Å; V403-V407 PolarHBondContact O-N 3.33Å; V403-L424 HydrophobicContact CG2-CD1 4.38Å; V403-E427 HydrophobicContact CG2-CG 4.15Å; V403-L428 HydrophobicContact CG2-CD1 4.5Å; V403-L428 HydrophobicContact CG2-CD2 3.97Å; V403-L428 HydrophobicContact CG2-CG 4.26Å |
| 404 | K | 92.9 | Very high | 90.7 | Very high | 55 Ų | 55 | 59.7 Ų | 59.7 | 24% | 0.239 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -65.3 | -43.7 | 174.3 | -72.5 | 169.4 | -174.6 | 174.7 | 0 | 111.4 | S391 T400 A401 T402 V407 K408 I458 | S391-K404 WeakPolarHBondContact OG-CE 3.48Å; S391-K404 PolarHBondContact OG-NZ 2.64Å; T400-K404 HydrophobicContact CG2-CD 4.43Å; T400-K404 WeakPolarHBondContact O-CD 3.36Å; T400-K404 VanDerWaalsContact O-CG 3.28Å; T400-K404 WeakPolarHBondContact O-CG 3.37Å; T400-K404 PolarHBondContact O-N 3.37Å; A401-K404 WeakPolarHBondContact O-CB 3.34Å; A401-K404 PolarHBondContact O-N 2.89Å; A401-K404 VanDerWaalsContact O-N 3.09Å; T402-K404 PolarHBondContact O-N 2.96Å; K404-V407 PolarHBondContact O-N 3.36Å; K404-K408 WeakPolarHBondContact O-CB 3.4Å; K404-K408 PolarHBondContact O-N 3.32Å; K404-I458 HydrophobicContact CB-CG2 4.4Å; K404-I458 HydrophobicContact CD-CG2 4.19Å; K404-I458 HydrophobicContact CG-CG2 4Å |
| 405 | E | 94.8 | Very high | 91.5 | Very high | 117 Ų | 117 | 52.1 Ų | 52.1 | 55% | 0.547 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.8 | -40.7 | 177.5 | -156 | -154.1 | 137.3 | 0 | 0 | 112.2 | A401 T402 K408 N409 | A401-E405 PolarHBondContact O-N 3.46Å; T402-E405 PolarHBondContact O-N 2.93Å; E405-K408 WeakPolarHBondContact O-CB 3.45Å; E405-K408 PolarHBondContact O-N 2.9Å; E405-N409 WeakPolarHBondContact O-CB 2.99Å; E405-N409 PolarHBondContact O-N 3.14Å; E405-N409 PolarHBondContact O-ND2 3.4Å; E405-N409 VanDerWaalsContact O-ND2 3.12Å; E405-N409 PolarHBondContact OE1-ND2 3.12Å; E405-N409 VanDerWaalsContact OE1-ND2 3.13Å |
| 406 | L | 95.4 | Very high | 92 | Very high | 11 Ų | 11 | 51.9 Ų | 51.9 | 6% | 0.058 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.4 | -44.5 | 174.1 | -72.1 | 171.4 | 0 | 0 | 0 | 111.6 | T402 L410 M415 F420 R423 | T402-L406 HydrophobicContact CG2-CD1 4.08Å; T402-L406 HydrophobicContact CG2-CG 4.37Å; T402-L406 WeakPolarHBondContact O-CB 3.42Å; T402-L406 VanDerWaalsContact O-CG 3.22Å; T402-L406 WeakPolarHBondContact O-CG 3.4Å; T402-L406 PolarHBondContact O-N 3.06Å; L406-L410 WeakPolarHBondContact O-CB 3.42Å; L406-L410 PolarHBondContact O-N 3.3Å; L406-L410 VanDerWaalsContact O-N 3.12Å; L406-M415 HydrophobicContact CD2-CE 3.77Å; L406-M415 HydrophobicContact CD2-SD 4.37Å; L406-M415 VanDerWaalsContact O-SD 3.33Å; L406-F420 HydrophobicContact CB-CD2 3.96Å; L406-F420 HydrophobicContact CB-CE2 3.93Å; L406-F420 WeakPolarHBondContact O-CD2 3.29Å; L406-R423 HydrophobicContact CD1-CB 4.11Å; L406-R423 HydrophobicContact CD2-CB 3.66Å; L406-R423 HydrophobicContact CD2-CG 4.29Å |
| 407 | V | 95.4 | Very high | 92.3 | Very high | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -67.7 | -38.5 | 176.6 | 174.8 | 0 | 0 | 0 | 0 | 111.4 | L383 I387 V403 K404 L410 L411 F420 F457 | L383-V407 HydrophobicContact CB-CG1 4.03Å; L383-V407 HydrophobicContact CD1-CG1 4.32Å; L383-V407 HydrophobicContact CD2-CG1 4.19Å; L383-V407 HydrophobicContact CD2-CG2 4.11Å; L383-V407 HydrophobicContact CG-CG1 4.4Å; I387-V407 HydrophobicContact CD1-CB 4.48Å; I387-V407 HydrophobicContact CD1-CG1 3.95Å; I387-V407 HydrophobicContact CG1-CG1 4.48Å; I387-V407 HydrophobicContact CG1-CG2 4.36Å; V403-V407 WeakPolarHBondContact O-CG2 3.35Å; V403-V407 PolarHBondContact O-N 3.33Å; K404-V407 PolarHBondContact O-N 3.36Å; V407-L410 PolarHBondContact O-N 3.41Å; V407-L411 HydrophobicContact CG1-CD1 4.09Å; V407-L411 WeakPolarHBondContact O-CG 3.4Å; V407-L411 PolarHBondContact O-N 2.77Å; V407-L411 VanDerWaalsContact O-N 3.08Å; V407-F420 HydrophobicContact CG2-CE2 4.01Å; V407-F420 HydrophobicContact CG2-CZ 4.25Å; V407-F457 HydrophobicContact CG1-CE1 4.49Å |
| 408 | K | 94.1 | Very high | 92.7 | Very high | 57 Ų | 57 | 47.7 Ų | 47.7 | 25% | 0.248 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.5 | -56.7 | 174.8 | -174.1 | -170.9 | 179.2 | 161.2 | 0 | 111.5 | K404 E405 L410 L411 E412 P454 E455 I458 | K404-K408 WeakPolarHBondContact O-CB 3.4Å; K404-K408 PolarHBondContact O-N 3.32Å; E405-K408 WeakPolarHBondContact O-CB 3.45Å; E405-K408 PolarHBondContact O-N 2.9Å; K408-L410 PolarHBondContact O-N 2.81Å; K408-L411 PolarHBondContact O-N 2.98Å; K408-E412 VanDerWaalsContact CE-OE2 3.24Å; K408-E412 WeakPolarHBondContact CE-OE2 3.5Å; K408-E412 HydrophobicContact CG-CG 4.25Å; K408-E412 WeakPolarHBondContact CG-OE2 3.39Å; K408-E412 PolarHBondContact O-N 3.23Å; K408-P454 HydrophobicContact CG-CB 4.49Å; K408-P454 HydrophobicContact CG-CG 4.47Å; K408-E455 VanDerWaalsContact CD-OE1 3.29Å; K408-E455 WeakPolarHBondContact CD-OE1 3.15Å; K408-E455 WeakPolarHBondContact CE-OE1 3.05Å; K408-E455 IonicContact NZ-OE1 2.9Å; K408-E455 PolarHBondContact NZ-OE1 3.45Å; K408-I458 HydrophobicContact CB-CD1 3.8Å; K408-I458 HydrophobicContact CG-CD1 4.45Å |
| 409 | N | 94.4 | Very high | 93 | Very high | 31 Ų | 31 | 44.5 Ų | 44.5 | 17% | 0.166 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -59.1 | -33.3 | -179.3 | -77.3 | -46.8 | 0 | 0 | 0 | 112 | E405 G413 K414 M415 | E405-N409 WeakPolarHBondContact O-CB 2.99Å; E405-N409 PolarHBondContact O-N 3.14Å; E405-N409 PolarHBondContact O-ND2 3.4Å; E405-N409 VanDerWaalsContact O-ND2 3.12Å; E405-N409 PolarHBondContact OE1-ND2 3.12Å; E405-N409 VanDerWaalsContact OE1-ND2 3.13Å; N409-G413 PolarHBondContact O-N 3.49Å; N409-G413 VanDerWaalsContact O-N 3.15Å; N409-K414 HydrophobicContact CB-CB 4.27Å; N409-K414 PolarHBondContact O-N 2.77Å; N409-K414 WeakPolarHBondContact OD1-CD 3.43Å; N409-M415 HydrophobicContact CB-CG 4.09Å; N409-M415 HydrophobicContact CB-SD 3.59Å; N409-M415 VanDerWaalsContact CB-SD 3.59Å; N409-M415 PolarHBondContact O-N 3.17Å |
| 410 | L | 95.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -68.7 | -37.2 | 174.5 | -172.2 | 69.7 | 0 | 0 | 0 | 113 | L383 L406 V407 K408 M415 P417 F420 L444 R448 | L383-L410 HydrophobicContact CD2-CD2 4.04Å; L406-L410 WeakPolarHBondContact O-CB 3.42Å; L406-L410 PolarHBondContact O-N 3.3Å; L406-L410 VanDerWaalsContact O-N 3.12Å; V407-L410 PolarHBondContact O-N 3.41Å; K408-L410 PolarHBondContact O-N 2.81Å; L410-M415 HydrophobicContact CB-CG 4.16Å; L410-M415 HydrophobicContact CB-SD 4.21Å; L410-M415 HydrophobicContact CD1-CG 4.15Å; L410-P417 HydrophobicContact CD1-CB 4.38Å; L410-F420 HydrophobicContact CB-CD2 3.98Å; L410-F420 HydrophobicContact CB-CE2 4.43Å; L410-F420 HydrophobicContact CB-CG 4.36Å; L410-F420 HydrophobicContact CD1-CB 3.81Å; L410-F420 HydrophobicContact CD1-CD2 4.5Å; L410-F420 HydrophobicContact CD1-CG 4.04Å; L410-F420 HydrophobicContact CD2-CB 4.43Å; L410-F420 HydrophobicContact CD2-CD1 3.73Å; L410-F420 HydrophobicContact CD2-CD2 3.86Å; L410-F420 HydrophobicContact CD2-CE1 3.87Å; L410-F420 HydrophobicContact CD2-CE2 3.98Å; L410-F420 HydrophobicContact CD2-CG 3.73Å; L410-F420 HydrophobicContact CD2-CZ 3.99Å; L410-F420 HydrophobicContact CG-CD2 4.33Å; L410-F420 HydrophobicContact CG-CG 4.25Å; L410-L444 HydrophobicContact CD1-CD1 3.62Å; L410-L444 HydrophobicContact CD2-CD1 4.14Å; L410-L444 HydrophobicContact CD2-CD2 4.01Å; L410-L444 HydrophobicContact CG-CD1 3.9Å; L410-L444 HydrophobicContact CG-CD2 3.92Å; L410-R448 VanDerWaalsContact O-CZ 3.25Å; L410-R448 PolarHBondContact O-NE 2.86Å; L410-R448 PolarHBondContact O-NH2 2.87Å |
| 411 | L | 93.7 | Very high | 93.6 | Very high | 11 Ų | 11 | 42.7 Ų | 42.7 | 6% | 0.058 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -76.9 | -40.4 | 176.1 | -69.8 | 172.1 | 0 | 0 | 0 | 111.8 | L383 V407 K408 G413 L447 R448 T451 P454 F457 | L383-L411 HydrophobicContact CD1-CD2 3.95Å; L383-L411 HydrophobicContact CD1-CG 4.31Å; V407-L411 HydrophobicContact CG1-CD1 4.09Å; V407-L411 WeakPolarHBondContact O-CG 3.4Å; V407-L411 PolarHBondContact O-N 2.77Å; V407-L411 VanDerWaalsContact O-N 3.08Å; K408-L411 PolarHBondContact O-N 2.98Å; L411-G413 PolarHBondContact O-N 3.38Å; L411-L447 HydrophobicContact CD2-CD2 3.96Å; L411-L447 HydrophobicContact CD2-CG 4.14Å; L411-R448 WeakPolarHBondContact O-CD 3.47Å; L411-R448 VanDerWaalsContact O-CG 3.31Å; L411-R448 WeakPolarHBondContact O-CG 3.32Å; L411-T451 HydrophobicContact CD1-CG2 4.49Å; L411-P454 HydrophobicContact CB-CB 3.76Å; L411-P454 HydrophobicContact CD1-CB 4.06Å; L411-F457 HydrophobicContact CD1-CB 4.41Å; L411-F457 HydrophobicContact CD1-CD1 3.58Å; L411-F457 HydrophobicContact CD1-CE1 4.1Å; L411-F457 HydrophobicContact CD1-CG 4.07Å |
| 412 | E | 92.6 | Very high | 93.6 | Very high | 76 Ų | 76 | 43.5 Ų | 43.5 | 36% | 0.355 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -66.1 | -16.2 | 174.7 | -71.2 | -171.3 | 100.1 | 0 | 0 | 113.8 | K408 K414 P454 | K408-E412 VanDerWaalsContact CE-OE2 3.24Å; K408-E412 WeakPolarHBondContact CE-OE2 3.5Å; K408-E412 HydrophobicContact CG-CG 4.25Å; K408-E412 WeakPolarHBondContact CG-OE2 3.39Å; K408-E412 PolarHBondContact O-N 3.23Å; E412-K414 VanDerWaalsContact C-N 3.35Å; E412-K414 HydrophobicContact CB-CD 4.11Å; E412-K414 HydrophobicContact CB-CG 4.09Å; E412-K414 VanDerWaalsContact CD-CE 3.49Å; E412-K414 WeakPolarHBondContact OE1-CE 3.49Å; E412-K414 IonicContact OE1-NZ 3.16Å; E412-K414 PolarHBondContact OE1-NZ 2.85Å; E412-K414 WeakPolarHBondContact OE2-CE 3.49Å; E412-K414 IonicContact OE2-NZ 2.67Å; E412-K414 PolarHBondContact OE2-NZ 3.5Å; E412-P454 HydrophobicContact CG-CG 3.73Å |
| 413 | G | 89.8 | Confident | 93.6 | Very high | 37 Ų | 37 | 48.8 Ų | 48.8 | 38% | 0.381 | 24% | 0.241 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 81.1 | 12.3 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115 | N409 L411 M415 R448 | N409-G413 PolarHBondContact O-N 3.49Å; N409-G413 VanDerWaalsContact O-N 3.15Å; L411-G413 PolarHBondContact O-N 3.38Å; G413-M415 PolarHBondContact O-N 3.22Å; G413-R448 VanDerWaalsContact CA-CZ 3.47Å |
| 414 | K | 89.6 | Confident | 93.6 | Very high | 133 Ų | 133 | 49.1 Ų | 49.1 | 58% | 0.578 | 24% | 0.242 | S | C | * | . | S | Bend | trans | -77 | -8.3 | 175.9 | -64.7 | 172.6 | -174.9 | 164.7 | 0 | 113.4 | N409 E412 | N409-K414 HydrophobicContact CB-CB 4.27Å; N409-K414 PolarHBondContact O-N 2.77Å; N409-K414 WeakPolarHBondContact OD1-CD 3.43Å; E412-K414 VanDerWaalsContact C-N 3.35Å; E412-K414 HydrophobicContact CB-CD 4.11Å; E412-K414 HydrophobicContact CB-CG 4.09Å; E412-K414 VanDerWaalsContact CD-CE 3.49Å; E412-K414 WeakPolarHBondContact OE1-CE 3.49Å; E412-K414 IonicContact OE1-NZ 3.16Å; E412-K414 PolarHBondContact OE1-NZ 2.85Å; E412-K414 WeakPolarHBondContact OE2-CE 3.49Å; E412-K414 IonicContact OE2-NZ 2.67Å; E412-K414 PolarHBondContact OE2-NZ 3.5Å |
| 415 | M | 91.4 | Very high | 93.7 | Very high | 21 Ų | 21 | 48 Ų | 48 | 10% | 0.103 | 24% | 0.237 | C | C | . | . | S | Bend | trans | -144.6 | 151.4 | 175.2 | 74.6 | -168 | -44.1 | 0 | 0 | 112.8 | L406 N409 L410 G413 D419 F420 R448 | L406-M415 HydrophobicContact CD2-CE 3.77Å; L406-M415 HydrophobicContact CD2-SD 4.37Å; L406-M415 VanDerWaalsContact O-SD 3.33Å; N409-M415 HydrophobicContact CB-CG 4.09Å; N409-M415 HydrophobicContact CB-SD 3.59Å; N409-M415 VanDerWaalsContact CB-SD 3.59Å; N409-M415 PolarHBondContact O-N 3.17Å; L410-M415 HydrophobicContact CB-CG 4.16Å; L410-M415 HydrophobicContact CB-SD 4.21Å; L410-M415 HydrophobicContact CD1-CG 4.15Å; G413-M415 PolarHBondContact O-N 3.22Å; M415-D419 HydrophobicContact CE-CB 4.26Å; M415-F420 HydrophobicContact CE-CB 3.88Å; M415-F420 HydrophobicContact CG-CB 4.33Å; M415-F420 HydrophobicContact SD-CB 3.96Å; M415-F420 HydrophobicContact SD-CD2 4.11Å; M415-R448 PolarHBondContact O-NH2 2.86Å |
| 416 | E | 93.7 | Very high | 93.5 | Very high | 85 Ų | 85 | 50.7 Ų | 50.7 | 40% | 0.397 | 25% | 0.247 | S | C | . | . | trans | -83.8 | 156.4 | 172 | -79.9 | -64.4 | 99.8 | 0 | 0 | 111.8 | E418 D419 F420 K441 | E416-E418 VanDerWaalsContact C-N 3.27Å; E416-E418 PolarHBondContact O-N 2.85Å; E416-D419 PolarHBondContact O-N 3.1Å; E416-F420 PolarHBondContact O-N 3.44Å; E416-K441 WeakPolarHBondContact OE2-CE 3.43Å; E416-K441 IonicContact OE2-NZ 3.29Å; E416-K441 PolarHBondContact OE2-NZ 3.02Å | ||
| 417 | P | 92.7 | Very high | 93.3 | Very high | 3 Ų | 3 | 52.6 Ų | 52.6 | 2% | 0.019 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -67.8 | -24.1 | -177.6 | 24.8 | -30.8 | 0 | 0 | 0 | 113.7 | L410 T421 L440 K441 L444 | L410-P417 HydrophobicContact CD1-CB 4.38Å; P417-T421 WeakPolarHBondContact O-CB 3.43Å; P417-T421 VanDerWaalsContact O-CG2 3.32Å; P417-T421 WeakPolarHBondContact O-CG2 3.27Å; P417-T421 PolarHBondContact O-N 3.24Å; P417-T421 PolarHBondContact O-OG1 3.01Å; P417-L440 HydrophobicContact CB-CB 3.63Å; P417-L440 HydrophobicContact CB-CD1 3.9Å; P417-L440 HydrophobicContact CB-CG 4.43Å; P417-L440 HydrophobicContact CG-CB 4.39Å; P417-K441 HydrophobicContact CG-CD 4.11Å; P417-K441 HydrophobicContact CG-CG 3.36Å; P417-L444 HydrophobicContact CB-CD1 4.1Å; P417-L444 HydrophobicContact CG-CD1 4.33Å |
| 418 | E | 94.1 | Very high | 93 | Very high | 73 Ų | 73 | 54.8 Ų | 54.8 | 34% | 0.341 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -59.2 | -50.3 | 168.5 | -75 | 77.2 | 179.1 | 0 | 0 | 111.6 | E416 T421 S422 V437 K441 | E416-E418 VanDerWaalsContact C-N 3.27Å; E416-E418 PolarHBondContact O-N 2.85Å; E418-T421 PolarHBondContact O-OG1 3.33Å; E418-S422 VanDerWaalsContact O-CB 3.3Å; E418-S422 WeakPolarHBondContact O-CB 3.46Å; E418-S422 PolarHBondContact O-N 3.29Å; E418-S422 PolarHBondContact O-OG 2.82Å; E418-V437 VanDerWaalsContact CD-CG1 3.42Å; E418-V437 HydrophobicContact CG-CG1 3.87Å; E418-V437 WeakPolarHBondContact OE1-CG1 3.36Å; E418-K441 WeakPolarHBondContact OE1-CE 3.35Å; E418-K441 IonicContact OE1-NZ 3.46Å; E418-K441 PolarHBondContact OE1-NZ 3.21Å; E418-K441 WeakPolarHBondContact OE2-CE 3.29Å; E418-K441 IonicContact OE2-NZ 2.64Å; E418-K441 PolarHBondContact OE2-NZ 2.82Å |
| 419 | D | 94 | Very high | 92.7 | Very high | 83 Ų | 83 | 59.3 Ų | 59.3 | 44% | 0.444 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -67.1 | -42.5 | 178.1 | -71.2 | -55.9 | 0 | 0 | 0 | 111.8 | M415 E416 S422 R423 | M415-D419 HydrophobicContact CE-CB 4.26Å; E416-D419 PolarHBondContact O-N 3.1Å; D419-S422 PolarHBondContact O-N 3.21Å; D419-R423 WeakPolarHBondContact O-CB 3.09Å; D419-R423 VanDerWaalsContact O-CG 3.29Å; D419-R423 WeakPolarHBondContact O-CG 3.34Å; D419-R423 PolarHBondContact O-N 2.87Å |
| 420 | F | 96.2 | Very high | 92.3 | Very high | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59.3 | -50.8 | 177.5 | 168.1 | -96 | 0 | 0 | 0 | 111.4 | F382 L383 L386 L406 V407 L410 M415 E416 R423 L424 L440 | F382-F420 HydrophobicContact CE1-CE1 4.34Å; L383-F420 HydrophobicContact CD2-CE1 4.49Å; L383-F420 HydrophobicContact CD2-CZ 3.99Å; L386-F420 HydrophobicContact CD1-CZ 3.92Å; L406-F420 HydrophobicContact CB-CD2 3.96Å; L406-F420 HydrophobicContact CB-CE2 3.93Å; L406-F420 WeakPolarHBondContact O-CD2 3.29Å; V407-F420 HydrophobicContact CG2-CE2 4.01Å; V407-F420 HydrophobicContact CG2-CZ 4.25Å; L410-F420 HydrophobicContact CB-CD2 3.98Å; L410-F420 HydrophobicContact CB-CE2 4.43Å; L410-F420 HydrophobicContact CB-CG 4.36Å; L410-F420 HydrophobicContact CD1-CB 3.81Å; L410-F420 HydrophobicContact CD1-CD2 4.5Å; L410-F420 HydrophobicContact CD1-CG 4.04Å; L410-F420 HydrophobicContact CD2-CB 4.43Å; L410-F420 HydrophobicContact CD2-CD1 3.73Å; L410-F420 HydrophobicContact CD2-CD2 3.86Å; L410-F420 HydrophobicContact CD2-CE1 3.87Å; L410-F420 HydrophobicContact CD2-CE2 3.98Å; L410-F420 HydrophobicContact CD2-CG 3.73Å; L410-F420 HydrophobicContact CD2-CZ 3.99Å; L410-F420 HydrophobicContact CG-CD2 4.33Å; L410-F420 HydrophobicContact CG-CG 4.25Å; M415-F420 HydrophobicContact CE-CB 3.88Å; M415-F420 HydrophobicContact CG-CB 4.33Å; M415-F420 HydrophobicContact SD-CB 3.96Å; M415-F420 HydrophobicContact SD-CD2 4.11Å; E416-F420 PolarHBondContact O-N 3.44Å; F420-R423 PolarHBondContact O-N 3.33Å; F420-L424 HydrophobicContact CE1-CD2 3.88Å; F420-L424 HydrophobicContact CZ-CD2 3.97Å; F420-L424 WeakPolarHBondContact O-CB 3.48Å; F420-L424 PolarHBondContact O-N 3.27Å; F420-L440 HydrophobicContact CD1-CD1 3.87Å; F420-L440 HydrophobicContact CE1-CD1 4.08Å |
| 421 | T | 95 | Very high | 92 | Very high | 3 Ų | 3 | 64.5 Ų | 64.5 | 2% | 0.018 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -65.6 | -41.7 | 179.9 | 52.9 | 0 | 0 | 0 | 0 | 111.5 | P417 E418 R423 L424 Y425 L436 V437 L440 | P417-T421 WeakPolarHBondContact O-CB 3.43Å; P417-T421 VanDerWaalsContact O-CG2 3.32Å; P417-T421 WeakPolarHBondContact O-CG2 3.27Å; P417-T421 PolarHBondContact O-N 3.24Å; P417-T421 PolarHBondContact O-OG1 3.01Å; E418-T421 PolarHBondContact O-OG1 3.33Å; T421-R423 PolarHBondContact O-N 2.83Å; T421-L424 PolarHBondContact O-N 2.96Å; T421-Y425 WeakPolarHBondContact O-CB 3.48Å; T421-Y425 WeakPolarHBondContact O-CD2 3.38Å; T421-Y425 PolarHBondContact O-N 2.79Å; T421-L436 HydrophobicContact CG2-CB 4.48Å; T421-L436 HydrophobicContact CG2-CD2 3.63Å; T421-L436 HydrophobicContact CG2-CG 3.75Å; T421-V437 HydrophobicContact CG2-CG2 3.85Å; T421-V437 WeakPolarHBondContact OG1-CG2 3.28Å; T421-L440 HydrophobicContact CG2-CD1 3.74Å |
| 422 | S | 92.8 | Very high | 91.6 | Very high | 74 Ų | 74 | 68.4 Ų | 68.4 | 52% | 0.517 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -59.7 | -42.9 | 176.9 | -58.7 | 0 | 0 | 0 | 0 | 112.7 | E418 D419 K426 | E418-S422 VanDerWaalsContact O-CB 3.3Å; E418-S422 WeakPolarHBondContact O-CB 3.46Å; E418-S422 PolarHBondContact O-N 3.29Å; E418-S422 PolarHBondContact O-OG 2.82Å; D419-S422 PolarHBondContact O-N 3.21Å; S422-K426 PolarHBondContact O-N 2.89Å |
| 423 | R | 93.1 | Very high | 91.5 | Very high | 154 Ų | 154 | 69.9 Ų | 69.9 | 58% | 0.581 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -69.7 | -42.8 | 175 | -68.6 | 175.3 | -171.6 | -131.2 | 3.8 | 111.8 | L406 D419 F420 T421 Y425 K426 E427 | L406-R423 HydrophobicContact CD1-CB 4.11Å; L406-R423 HydrophobicContact CD2-CB 3.66Å; L406-R423 HydrophobicContact CD2-CG 4.29Å; D419-R423 WeakPolarHBondContact O-CB 3.09Å; D419-R423 VanDerWaalsContact O-CG 3.29Å; D419-R423 WeakPolarHBondContact O-CG 3.34Å; D419-R423 PolarHBondContact O-N 2.87Å; F420-R423 PolarHBondContact O-N 3.33Å; T421-R423 PolarHBondContact O-N 2.83Å; R423-Y425 PolarHBondContact O-N 2.88Å; R423-K426 PolarHBondContact O-N 2.71Å; R423-E427 WeakPolarHBondContact O-CB 3.4Å; R423-E427 PolarHBondContact O-N 2.73Å |
| 424 | L | 94.7 | Very high | 91.2 | Very high | 7 Ų | 7 | 73.2 Ų | 73.2 | 4% | 0.037 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -62.1 | -40.1 | 178.3 | -173.8 | 72.5 | 0 | 0 | 0 | 112.6 | F382 L386 V403 F420 T421 E427 L428 | F382-L424 HydrophobicContact CZ-CD2 4.47Å; L386-L424 HydrophobicContact CD1-CD1 4.21Å; L386-L424 HydrophobicContact CD1-CD2 3.69Å; L386-L424 HydrophobicContact CD2-CD1 4.49Å; L386-L424 HydrophobicContact CD2-CD2 4.24Å; V403-L424 HydrophobicContact CG2-CD1 4.38Å; F420-L424 HydrophobicContact CE1-CD2 3.88Å; F420-L424 HydrophobicContact CZ-CD2 3.97Å; F420-L424 WeakPolarHBondContact O-CB 3.48Å; F420-L424 PolarHBondContact O-N 3.27Å; T421-L424 PolarHBondContact O-N 2.96Å; L424-E427 PolarHBondContact O-N 3.5Å; L424-L428 HydrophobicContact CD1-CD1 3.6Å; L424-L428 HydrophobicContact CD1-CG 4.14Å; L424-L428 HydrophobicContact CG-CD1 4.15Å; L424-L428 WeakPolarHBondContact O-CB 3.26Å; L424-L428 PolarHBondContact O-N 3.36Å |
| 425 | Y | 94 | Very high | 91.3 | Very high | 33 Ų | 33 | 76.1 Ų | 76.1 | 13% | 0.129 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -63.3 | -41.4 | 176 | -62.4 | -38.2 | 0 | 0 | 0 | 111.6 | T421 R423 N429 S430 P432 Q433 L436 | T421-Y425 WeakPolarHBondContact O-CB 3.48Å; T421-Y425 WeakPolarHBondContact O-CD2 3.38Å; T421-Y425 PolarHBondContact O-N 2.79Å; R423-Y425 PolarHBondContact O-N 2.88Å; Y425-N429 CarbonylContact O-C 3.53Å; Y425-N429 WeakPolarHBondContact O-CA 3.44Å; Y425-N429 PolarHBondContact O-N 3.1Å; Y425-N429 VanDerWaalsContact O-N 3.12Å; Y425-S430 WeakPolarHBondContact CB-O 3.38Å; Y425-S430 PolarHBondContact O-N 3.4Å; Y425-P432 HydrophobicContact CD2-CB 3.99Å; Y425-P432 HydrophobicContact CE2-CB 3.81Å; Y425-Q433 HydrophobicContact CE1-CG 4.38Å; Y425-Q433 PolarHBondContact OH-N 3.32Å; Y425-Q433 PolarHBondContact OH-O 3.09Å; Y425-L436 HydrophobicContact CE1-CD2 4.33Å |
| 426 | K | 91.7 | Very high | 91.4 | Very high | 172 Ų | 172 | 75.6 Ų | 75.6 | 75% | 0.748 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -66 | -49.3 | 175 | -173.3 | -173.6 | 177 | -169.3 | 0 | 111.7 | S422 R423 N429 | S422-K426 PolarHBondContact O-N 2.89Å; R423-K426 PolarHBondContact O-N 2.71Å; K426-N429 PolarHBondContact O-N 3.43Å |
| 427 | E | 91.4 | Very high | 91.5 | Very high | 51 Ų | 51 | 72.9 Ų | 72.9 | 24% | 0.238 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -64.9 | -43.3 | -174.8 | -170.9 | 57.9 | -144.3 | 0 | 0 | 112.3 | T399 T402 V403 R423 L424 | T399-E427 VanDerWaalsContact CA-OE1 3.22Å; T399-E427 WeakPolarHBondContact CA-OE1 3.15Å; T399-E427 VanDerWaalsContact CB-OE1 3.25Å; T399-E427 WeakPolarHBondContact CB-OE1 3.43Å; T399-E427 HydrophobicContact CG2-CG 4.08Å; T399-E427 WeakPolarHBondContact CG2-OE1 3.4Å; T399-E427 PolarHBondContact OG1-OE1 3.46Å; T402-E427 HydrophobicContact CG2-CG 3.93Å; V403-E427 HydrophobicContact CG2-CG 4.15Å; R423-E427 WeakPolarHBondContact O-CB 3.4Å; R423-E427 PolarHBondContact O-N 2.73Å; L424-E427 PolarHBondContact O-N 3.5Å |
| 428 | L | 89.8 | Confident | 91.5 | Very high | 46 Ų | 46 | 76.6 Ų | 76.6 | 24% | 0.241 | 40% | 0.4 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94 | 10.6 | 179.2 | -62.1 | -178.6 | 0 | 0 | 0 | 113.7 | L386 T399 V403 L424 S430 | L386-L428 HydrophobicContact CD2-CD1 4.27Å; T399-L428 HydrophobicContact CG2-CD2 3.9Å; V403-L428 HydrophobicContact CG2-CD1 4.5Å; V403-L428 HydrophobicContact CG2-CD2 3.97Å; V403-L428 HydrophobicContact CG2-CG 4.26Å; L424-L428 HydrophobicContact CD1-CD1 3.6Å; L424-L428 HydrophobicContact CD1-CG 4.14Å; L424-L428 HydrophobicContact CG-CD1 4.15Å; L424-L428 WeakPolarHBondContact O-CB 3.26Å; L424-L428 PolarHBondContact O-N 3.36Å; L428-S430 PolarHBondContact O-N 3.05Å; L428-S430 VanDerWaalsContact O-N 3.13Å |
| 429 | N | 86.1 | Confident | 91.6 | Very high | 152 Ų | 152 | 75.5 Ų | 75.5 | 81% | 0.813 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 44.5 | 43.5 | -175.5 | -70.1 | -80.5 | 0 | 0 | 0 | 113.3 | Y425 K426 | Y425-N429 CarbonylContact O-C 3.53Å; Y425-N429 WeakPolarHBondContact O-CA 3.44Å; Y425-N429 PolarHBondContact O-N 3.1Å; Y425-N429 VanDerWaalsContact O-N 3.12Å; K426-N429 PolarHBondContact O-N 3.43Å |
| 430 | S | 87.2 | Confident | 91.7 | Very high | 43 Ų | 43 | 71.5 Ų | 71.5 | 30% | 0.301 | 37% | 0.373 | S | S | . | . | trans | -111.4 | 146.1 | -167.9 | 60 | 0 | 0 | 0 | 0 | 113 | Y425 L428 | Y425-S430 WeakPolarHBondContact CB-O 3.38Å; Y425-S430 PolarHBondContact O-N 3.4Å; L428-S430 PolarHBondContact O-N 3.05Å; L428-S430 VanDerWaalsContact O-N 3.13Å | ||
| 431 | S | 87.8 | Confident | 91.6 | Very high | 98 Ų | 98 | 75.9 Ų | 75.9 | 69% | 0.685 | 39% | 0.392 | S | S | * | . | trans | -70.4 | 137.5 | -176 | -170.5 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 432 | P | 87 | Confident | 91.5 | Very high | 93 Ų | 93 | 82.4 Ų | 82.4 | 60% | 0.604 | 42% | 0.416 | S | S | * | . | trans | -65.1 | 135.2 | -174.9 | 25.5 | -35.1 | 0 | 0 | 0 | 113 | Y425 | Y425-P432 HydrophobicContact CD2-CB 3.99Å; Y425-P432 HydrophobicContact CE2-CB 3.81Å | ||
| 433 | Q | 88.7 | Confident | 91.6 | Very high | 107 Ų | 107 | 78.9 Ų | 78.9 | 50% | 0.5 | 39% | 0.391 | S | S | . | . | trans | -104.9 | 113.5 | -176.7 | -59.6 | -176.9 | 18.9 | 0 | 0 | 111 | Y425 Y435 L436 | Y425-Q433 HydrophobicContact CE1-CG 4.38Å; Y425-Q433 PolarHBondContact OH-N 3.32Å; Y425-Q433 PolarHBondContact OH-O 3.09Å; Q433-Y435 PolarHBondContact O-N 2.63Å; Q433-Y435 VanDerWaalsContact O-N 3.15Å; Q433-L436 HydrophobicContact CB-CB 3.91Å; Q433-L436 PolarHBondContact O-N 2.67Å | ||
| 434 | P | 84.7 | Confident | 91.7 | Very high | 106 Ų | 106 | 71.7 Ų | 71.7 | 69% | 0.688 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.2 | -20.8 | -170 | 25.3 | -34.8 | 0 | 0 | 0 | 114.4 | ||
| 435 | Y | 92.1 | Very high | 91.7 | Very high | 194 Ų | 194 | 75.1 Ų | 75.1 | 76% | 0.761 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.6 | -5.9 | -179.5 | -60.7 | -68.1 | 0 | 0 | 0 | 114.2 | Q433 F439 | Q433-Y435 PolarHBondContact O-N 2.63Å; Q433-Y435 VanDerWaalsContact O-N 3.15Å; Y435-F439 VanDerWaalsContact O-CB 3.27Å; Y435-F439 WeakPolarHBondContact O-CB 3.38Å; Y435-F439 PolarHBondContact O-N 2.64Å; Y435-F439 VanDerWaalsContact O-N 3.16Å |
| 436 | L | 93.8 | Very high | 91.6 | Very high | 10 Ų | 10 | 74 Ų | 74 | 5% | 0.052 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -71.7 | -44.9 | -174.1 | -178.2 | 57.1 | 0 | 0 | 0 | 112.3 | F382 T421 Y425 Q433 F439 L440 | F382-L436 HydrophobicContact CE1-CD1 3.95Å; F382-L436 HydrophobicContact CE2-CD1 4.13Å; F382-L436 HydrophobicContact CZ-CD1 3.67Å; F382-L436 HydrophobicContact CZ-CD2 3.92Å; F382-L436 HydrophobicContact CZ-CG 4.43Å; T421-L436 HydrophobicContact CG2-CB 4.48Å; T421-L436 HydrophobicContact CG2-CD2 3.63Å; T421-L436 HydrophobicContact CG2-CG 3.75Å; Y425-L436 HydrophobicContact CE1-CD2 4.33Å; Q433-L436 HydrophobicContact CB-CB 3.91Å; Q433-L436 PolarHBondContact O-N 2.67Å; L436-F439 HydrophobicContact CD1-CD1 4.23Å; L436-F439 PolarHBondContact O-N 3.31Å; L436-L440 HydrophobicContact CD1-CD1 4.15Å; L436-L440 HydrophobicContact CD1-CG 4.08Å; L436-L440 HydrophobicContact CG-CD1 4.08Å; L436-L440 HydrophobicContact CG-CG 4.43Å; L436-L440 WeakPolarHBondContact O-CG 3.3Å; L436-L440 PolarHBondContact O-N 2.85Å |
| 437 | V | 94.5 | Very high | 91.6 | Very high | 29 Ų | 29 | 66.2 Ų | 66.2 | 18% | 0.176 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -63 | -48.8 | 178.4 | 172.7 | 0 | 0 | 0 | 0 | 112.3 | E418 T421 F439 L440 K441 | E418-V437 VanDerWaalsContact CD-CG1 3.42Å; E418-V437 HydrophobicContact CG-CG1 3.87Å; E418-V437 WeakPolarHBondContact OE1-CG1 3.36Å; T421-V437 HydrophobicContact CG2-CG2 3.85Å; T421-V437 WeakPolarHBondContact OG1-CG2 3.28Å; V437-F439 VanDerWaalsContact C-N 3.29Å; V437-F439 PolarHBondContact O-N 2.9Å; V437-L440 PolarHBondContact O-N 3.05Å; V437-K441 PolarHBondContact O-N 3.19Å |
| 438 | P | 92.8 | Very high | 91.8 | Very high | 80 Ų | 80 | 67.2 Ų | 67.2 | 52% | 0.519 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -59.4 | -35.8 | 173.6 | -26.2 | 35.2 | 0 | 0 | 0 | 114 | R442 | P438-R442 PolarHBondContact O-N 3.44Å |
| 439 | F | 96.2 | Very high | 91.8 | Very high | 50 Ų | 50 | 72.4 Ų | 72.4 | 22% | 0.219 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -66.2 | -46.5 | 175.7 | 168.4 | -107.9 | 0 | 0 | 0 | 112 | N375 K378 C379 Y435 L436 V437 R442 S443 | N375-F439 HydrophobicContact CB-CE2 4.27Å; K378-F439 HydrophobicContact CB-CE2 4.04Å; K378-F439 HydrophobicContact CB-CZ 3.69Å; C379-F439 HydrophobicContact CB-CE1 4.11Å; C379-F439 HydrophobicContact CB-CZ 3.87Å; Y435-F439 VanDerWaalsContact O-CB 3.27Å; Y435-F439 WeakPolarHBondContact O-CB 3.38Å; Y435-F439 PolarHBondContact O-N 2.64Å; Y435-F439 VanDerWaalsContact O-N 3.16Å; L436-F439 HydrophobicContact CD1-CD1 4.23Å; L436-F439 PolarHBondContact O-N 3.31Å; V437-F439 VanDerWaalsContact C-N 3.29Å; V437-F439 PolarHBondContact O-N 2.9Å; F439-R442 PolarHBondContact O-N 3.49Å; F439-S443 WeakPolarHBondContact O-CB 3.22Å; F439-S443 PolarHBondContact O-N 2.76Å; F439-S443 VanDerWaalsContact O-N 3.14Å; F439-S443 PolarHBondContact O-OG 2.8Å |
| 440 | L | 95.6 | Very high | 91.8 | Very high | 0 Ų | 0 | 70.3 Ų | 70.3 | 0% | 0 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -62.7 | -46.4 | 176.5 | -70.6 | 175.2 | 0 | 0 | 0 | 111.2 | F382 P417 F420 T421 L436 V437 R442 S443 L444 | F382-L440 HydrophobicContact CD1-CD2 4.36Å; F382-L440 HydrophobicContact CE1-CD2 4.24Å; P417-L440 HydrophobicContact CB-CB 3.63Å; P417-L440 HydrophobicContact CB-CD1 3.9Å; P417-L440 HydrophobicContact CB-CG 4.43Å; P417-L440 HydrophobicContact CG-CB 4.39Å; F420-L440 HydrophobicContact CD1-CD1 3.87Å; F420-L440 HydrophobicContact CE1-CD1 4.08Å; T421-L440 HydrophobicContact CG2-CD1 3.74Å; L436-L440 HydrophobicContact CD1-CD1 4.15Å; L436-L440 HydrophobicContact CD1-CG 4.08Å; L436-L440 HydrophobicContact CG-CD1 4.08Å; L436-L440 HydrophobicContact CG-CG 4.43Å; L436-L440 WeakPolarHBondContact O-CG 3.3Å; L436-L440 PolarHBondContact O-N 2.85Å; V437-L440 PolarHBondContact O-N 3.05Å; L440-R442 VanDerWaalsContact C-N 3.28Å; L440-R442 PolarHBondContact O-N 3.22Å; L440-S443 PolarHBondContact O-N 3.18Å; L440-L444 HydrophobicContact CB-CD1 3.93Å; L440-L444 HydrophobicContact CB-CG 4.43Å; L440-L444 WeakPolarHBondContact O-CB 3.1Å; L440-L444 VanDerWaalsContact O-CG 3.3Å; L440-L444 WeakPolarHBondContact O-CG 3.41Å; L440-L444 PolarHBondContact O-N 2.78Å |
| 441 | K | 94.9 | Very high | 91.8 | Very high | 92 Ų | 92 | 69.3 Ų | 69.3 | 40% | 0.4 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -58.5 | -35.1 | 177.6 | -78.6 | -164 | 152.2 | 164.1 | 0 | 113.7 | E416 P417 E418 V437 P445 | E416-K441 WeakPolarHBondContact OE2-CE 3.43Å; E416-K441 IonicContact OE2-NZ 3.29Å; E416-K441 PolarHBondContact OE2-NZ 3.02Å; P417-K441 HydrophobicContact CG-CD 4.11Å; P417-K441 HydrophobicContact CG-CG 3.36Å; E418-K441 WeakPolarHBondContact OE1-CE 3.35Å; E418-K441 IonicContact OE1-NZ 3.46Å; E418-K441 PolarHBondContact OE1-NZ 3.21Å; E418-K441 WeakPolarHBondContact OE2-CE 3.29Å; E418-K441 IonicContact OE2-NZ 2.64Å; E418-K441 PolarHBondContact OE2-NZ 2.82Å; V437-K441 PolarHBondContact O-N 3.19Å; K441-P445 VanDerWaalsContact O-CD 3.29Å; K441-P445 WeakPolarHBondContact O-CD 3.5Å |
| 442 | R | 93.3 | Very high | 91.4 | Very high | 139 Ų | 139 | 70.8 Ų | 70.8 | 53% | 0.525 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -81.2 | -15.2 | 176.3 | -168.3 | 158.5 | 66.9 | 121.2 | -5.2 | 114.2 | E371 P438 F439 L440 | E371-R442 IonicContact OE2-NH1 3.65Å; E371-R442 PolarHBondContact OE2-NH1 2.92Å; P438-R442 PolarHBondContact O-N 3.44Å; F439-R442 PolarHBondContact O-N 3.49Å; L440-R442 VanDerWaalsContact C-N 3.28Å; L440-R442 PolarHBondContact O-N 3.22Å |
| 443 | S | 94.8 | Very high | 91.4 | Very high | 0 Ų | 0 | 70 Ų | 70 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -107.1 | -37.4 | -174 | -51.2 | 0 | 0 | 0 | 0 | 113.7 | C379 F439 L440 A446 L447 | C379-S443 VanDerWaalsContact CB-CB 3.49Å; F439-S443 WeakPolarHBondContact O-CB 3.22Å; F439-S443 PolarHBondContact O-N 2.76Å; F439-S443 VanDerWaalsContact O-N 3.14Å; F439-S443 PolarHBondContact O-OG 2.8Å; L440-S443 PolarHBondContact O-N 3.18Å; S443-A446 PolarHBondContact O-N 3.07Å; S443-L447 WeakPolarHBondContact O-CB 3.35Å; S443-L447 PolarHBondContact O-N 3.21Å |
| 444 | L | 95.3 | Very high | 91.3 | Very high | 4 Ų | 4 | 65.9 Ų | 65.9 | 2% | 0.021 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61.2 | -42.3 | -174.5 | -72.9 | 167.3 | 0 | 0 | 0 | 114.5 | L410 P417 L440 A446 L447 R448 | L410-L444 HydrophobicContact CD1-CD1 3.62Å; L410-L444 HydrophobicContact CD2-CD1 4.14Å; L410-L444 HydrophobicContact CD2-CD2 4.01Å; L410-L444 HydrophobicContact CG-CD1 3.9Å; L410-L444 HydrophobicContact CG-CD2 3.92Å; P417-L444 HydrophobicContact CB-CD1 4.1Å; P417-L444 HydrophobicContact CG-CD1 4.33Å; L440-L444 HydrophobicContact CB-CD1 3.93Å; L440-L444 HydrophobicContact CB-CG 4.43Å; L440-L444 WeakPolarHBondContact O-CB 3.1Å; L440-L444 VanDerWaalsContact O-CG 3.3Å; L440-L444 WeakPolarHBondContact O-CG 3.41Å; L440-L444 PolarHBondContact O-N 2.78Å; L444-A446 PolarHBondContact O-N 3.29Å; L444-A446 VanDerWaalsContact O-N 3.16Å; L444-L447 HydrophobicContact CD2-CD2 4.46Å; L444-L447 PolarHBondContact O-N 3.11Å; L444-L447 VanDerWaalsContact O-N 3.14Å; L444-R448 WeakPolarHBondContact O-CB 3.22Å; L444-R448 WeakPolarHBondContact O-CG 3.11Å; L444-R448 PolarHBondContact O-N 3.32Å |
| 445 | P | 93.3 | Very high | 91.4 | Very high | 79 Ų | 79 | 64.2 Ų | 64.2 | 51% | 0.513 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -60 | -30.3 | -177.7 | -26.3 | 36.1 | 0 | 0 | 0 | 114.1 | K441 Q449 | K441-P445 VanDerWaalsContact O-CD 3.29Å; K441-P445 WeakPolarHBondContact O-CD 3.5Å; P445-Q449 PolarHBondContact O-NE2 3.39Å |
| 446 | A | 92.5 | Very high | 91.2 | Very high | 9 Ų | 9 | 57 Ų | 57 | 7% | 0.074 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -89.9 | -35.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | T372 V376 S443 L444 R448 Q449 M450 | T372-A446 HydrophobicContact CG2-CB 3.81Å; V376-A446 HydrophobicContact CG2-CB 3.49Å; V376-A446 VanDerWaalsContact CG2-CB 3.49Å; S443-A446 PolarHBondContact O-N 3.07Å; L444-A446 PolarHBondContact O-N 3.29Å; L444-A446 VanDerWaalsContact O-N 3.16Å; A446-R448 PolarHBondContact O-N 3.29Å; A446-Q449 PolarHBondContact O-N 2.73Å; A446-M450 WeakPolarHBondContact O-CG 3.43Å; A446-M450 PolarHBondContact O-N 2.62Å; A446-M450 VanDerWaalsContact O-N 3.1Å |
| 447 | L | 92.9 | Very high | 91.1 | Very high | 8 Ų | 8 | 58.2 Ų | 58.2 | 4% | 0.042 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -63.3 | -39.3 | 175.9 | -178.4 | 62.8 | 0 | 0 | 0 | 112.4 | V376 C379 L383 L411 S443 L444 Q449 M450 T451 | V376-L447 HydrophobicContact CG1-CB 4.1Å; V376-L447 HydrophobicContact CG1-CD1 3.84Å; C379-L447 HydrophobicContact CB-CD2 4.06Å; L383-L447 HydrophobicContact CD1-CD2 3.86Å; L411-L447 HydrophobicContact CD2-CD2 3.96Å; L411-L447 HydrophobicContact CD2-CG 4.14Å; S443-L447 WeakPolarHBondContact O-CB 3.35Å; S443-L447 PolarHBondContact O-N 3.21Å; L444-L447 HydrophobicContact CD2-CD2 4.46Å; L444-L447 PolarHBondContact O-N 3.11Å; L444-L447 VanDerWaalsContact O-N 3.14Å; L447-Q449 VanDerWaalsContact C-N 3.32Å; L447-Q449 PolarHBondContact O-N 2.85Å; L447-M450 CarbonylContact O-C 3.19Å; L447-M450 PolarHBondContact O-N 3.07Å; L447-M450 VanDerWaalsContact O-N 3.14Å; L447-T451 WeakPolarHBondContact CD1-OG1 3.16Å; L447-T451 VanDerWaalsContact O-CB 3.29Å; L447-T451 WeakPolarHBondContact O-CB 3.23Å; L447-T451 PolarHBondContact O-N 3.07Å; L447-T451 PolarHBondContact O-OG1 3.03Å |
| 448 | R | 94.3 | Very high | 90.9 | Very high | 72 Ų | 72 | 57.2 Ų | 57.2 | 27% | 0.272 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -62 | -37.2 | 175.4 | -68 | -174.6 | -176.3 | 152.7 | 1.3 | 112 | L410 L411 G413 M415 L444 A446 M450 T451 | L410-R448 VanDerWaalsContact O-CZ 3.25Å; L410-R448 PolarHBondContact O-NE 2.86Å; L410-R448 PolarHBondContact O-NH2 2.87Å; L411-R448 WeakPolarHBondContact O-CD 3.47Å; L411-R448 VanDerWaalsContact O-CG 3.31Å; L411-R448 WeakPolarHBondContact O-CG 3.32Å; G413-R448 VanDerWaalsContact CA-CZ 3.47Å; M415-R448 PolarHBondContact O-NH2 2.86Å; L444-R448 WeakPolarHBondContact O-CB 3.22Å; L444-R448 WeakPolarHBondContact O-CG 3.11Å; L444-R448 PolarHBondContact O-N 3.32Å; A446-R448 PolarHBondContact O-N 3.29Å; R448-M450 VanDerWaalsContact C-N 3.34Å; R448-T451 PolarHBondContact O-N 3.27Å |
| 449 | Q | 90.1 | Very high | 90.6 | Very high | 156 Ų | 156 | 59.1 Ų | 59.1 | 73% | 0.729 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -71.4 | -26.6 | 174.3 | -72 | 174.9 | 85.8 | 0 | 0 | 113.3 | P445 A446 L447 | P445-Q449 PolarHBondContact O-NE2 3.39Å; A446-Q449 PolarHBondContact O-N 2.73Å; L447-Q449 VanDerWaalsContact C-N 3.32Å; L447-Q449 PolarHBondContact O-N 2.85Å |
| 450 | M | 85.7 | Confident | 90.1 | Very high | 107 Ų | 107 | 62 Ų | 62 | 53% | 0.527 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -91.5 | -4.6 | 176.8 | -66.5 | -174.4 | 69.3 | 0 | 0 | 114 | L373 V376 A446 L447 R448 | L373-M450 HydrophobicContact CD1-CE 4.07Å; L373-M450 HydrophobicContact CD1-SD 4Å; V376-M450 HydrophobicContact CG1-SD 3.82Å; A446-M450 WeakPolarHBondContact O-CG 3.43Å; A446-M450 PolarHBondContact O-N 2.62Å; A446-M450 VanDerWaalsContact O-N 3.1Å; L447-M450 CarbonylContact O-C 3.19Å; L447-M450 PolarHBondContact O-N 3.07Å; L447-M450 VanDerWaalsContact O-N 3.14Å; R448-M450 VanDerWaalsContact C-N 3.34Å |
| 451 | T | 86.8 | Confident | 89.7 | Confident | 23 Ų | 23 | 62.2 Ų | 62.2 | 14% | 0.141 | 32% | 0.315 | C | S | . | . | trans | -127.1 | 75.8 | -175.5 | -44.8 | 0 | 0 | 0 | 0 | 109.5 | L411 L447 R448 D453 F457 | L411-T451 HydrophobicContact CD1-CG2 4.49Å; L447-T451 WeakPolarHBondContact CD1-OG1 3.16Å; L447-T451 VanDerWaalsContact O-CB 3.29Å; L447-T451 WeakPolarHBondContact O-CB 3.23Å; L447-T451 PolarHBondContact O-N 3.07Å; L447-T451 PolarHBondContact O-OG1 3.03Å; R448-T451 PolarHBondContact O-N 3.27Å; T451-D453 VanDerWaalsContact C-N 3.25Å; T451-D453 PolarHBondContact O-N 3.29Å; T451-F457 HydrophobicContact CG2-CB 3.69Å; T451-F457 HydrophobicContact CG2-CD2 3.96Å; T451-F457 HydrophobicContact CG2-CG 3.98Å | ||
| 452 | P | 79.5 | Confident | 89 | Confident | 129 Ų | 129 | 61.3 Ų | 61.3 | 84% | 0.838 | 31% | 0.314 | S | S | * | . | S | Bend | trans | -69 | -21.2 | -173.4 | 28.1 | -35.7 | 0 | 0 | 0 | 113.8 | ||
| 453 | D | 87.5 | Confident | 88.1 | Confident | 76 Ų | 76 | 59.7 Ų | 59.7 | 41% | 0.406 | 32% | 0.315 | S | S | . | . | trans | -126.5 | 114.7 | 170.8 | 178 | 13.9 | 0 | 0 | 0 | 111 | T451 E455 A456 F457 | T451-D453 VanDerWaalsContact C-N 3.25Å; T451-D453 PolarHBondContact O-N 3.29Å; D453-E455 WeakPolarHBondContact OD1-CB 3.26Å; D453-E455 PolarHBondContact OD1-N 2.84Å; D453-A456 HydrophobicContact CB-CB 4.01Å; D453-A456 PolarHBondContact OD1-N 3.17Å; D453-A456 WeakPolarHBondContact OD2-CB 3.39Å; D453-A456 PolarHBondContact OD2-N 3.43Å; D453-F457 PolarHBondContact O-N 2.71Å | ||
| 454 | P | 87.4 | Confident | 85.8 | Confident | 20 Ų | 20 | 65.4 Ų | 65.4 | 13% | 0.13 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -74.9 | -23.7 | 175.7 | 31.7 | -35 | 0 | 0 | 0 | 113.7 | K408 L411 E412 F457 I458 | K408-P454 HydrophobicContact CG-CB 4.49Å; K408-P454 HydrophobicContact CG-CG 4.47Å; L411-P454 HydrophobicContact CB-CB 3.76Å; L411-P454 HydrophobicContact CD1-CB 4.06Å; E412-P454 HydrophobicContact CG-CG 3.73Å; P454-F457 PolarHBondContact O-N 3.46Å; P454-I458 VanDerWaalsContact O-CG1 3.31Å; P454-I458 WeakPolarHBondContact O-CG1 3.48Å; P454-I458 PolarHBondContact O-N 3.3Å |
| 455 | E | 87.1 | Confident | 83 | Confident | 71 Ų | 71 | 71.8 Ų | 71.8 | 33% | 0.332 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -72.2 | -47.4 | 176 | -73.9 | -68.2 | 166 | 0 | 0 | 110.6 | K408 D453 F457 I458 Q459 | K408-E455 VanDerWaalsContact CD-OE1 3.29Å; K408-E455 WeakPolarHBondContact CD-OE1 3.15Å; K408-E455 WeakPolarHBondContact CE-OE1 3.05Å; K408-E455 IonicContact NZ-OE1 2.9Å; K408-E455 PolarHBondContact NZ-OE1 3.45Å; D453-E455 WeakPolarHBondContact OD1-CB 3.26Å; D453-E455 PolarHBondContact OD1-N 2.84Å; E455-F457 PolarHBondContact O-N 3.44Å; E455-I458 PolarHBondContact O-N 2.83Å; E455-I458 VanDerWaalsContact O-N 3.1Å; E455-Q459 WeakPolarHBondContact O-CG 3.42Å; E455-Q459 PolarHBondContact O-N 2.87Å |
| 456 | A | 87.8 | Confident | 80.1 | Confident | 44 Ų | 44 | 73.7 Ų | 73.7 | 36% | 0.364 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -56.8 | -38.4 | 170 | 0 | 0 | 0 | 0 | 0 | 112.1 | D453 I458 Q459 Q460 | D453-A456 HydrophobicContact CB-CB 4.01Å; D453-A456 PolarHBondContact OD1-N 3.17Å; D453-A456 WeakPolarHBondContact OD2-CB 3.39Å; D453-A456 PolarHBondContact OD2-N 3.43Å; A456-I458 PolarHBondContact O-N 2.99Å; A456-Q459 PolarHBondContact O-N 2.79Å; A456-Q460 WeakPolarHBondContact O-CB 3.48Å; A456-Q460 PolarHBondContact O-N 3.33Å |
| 457 | F | 90.8 | Very high | 77.2 | Confident | 34 Ų | 34 | 78.2 Ų | 78.2 | 15% | 0.149 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -62.3 | -41 | 174.6 | 179.7 | -90.3 | 0 | 0 | 0 | 112.6 | L383 S384 I387 V407 L411 T451 D453 P454 E455 S461 | L383-F457 HydrophobicContact CB-CE1 3.87Å; L383-F457 HydrophobicContact CB-CZ 4.05Å; S384-F457 VanDerWaalsContact OG-CZ 3.28Å; S384-F457 WeakPolarHBondContact OG-CZ 2.99Å; I387-F457 HydrophobicContact CD1-CD1 4.35Å; I387-F457 HydrophobicContact CD1-CE1 4.07Å; V407-F457 HydrophobicContact CG1-CE1 4.49Å; L411-F457 HydrophobicContact CD1-CB 4.41Å; L411-F457 HydrophobicContact CD1-CD1 3.58Å; L411-F457 HydrophobicContact CD1-CE1 4.1Å; L411-F457 HydrophobicContact CD1-CG 4.07Å; T451-F457 HydrophobicContact CG2-CB 3.69Å; T451-F457 HydrophobicContact CG2-CD2 3.96Å; T451-F457 HydrophobicContact CG2-CG 3.98Å; D453-F457 PolarHBondContact O-N 2.71Å; P454-F457 PolarHBondContact O-N 3.46Å; E455-F457 PolarHBondContact O-N 3.44Å; F457-S461 WeakPolarHBondContact O-CB 3.26Å; F457-S461 PolarHBondContact O-N 3.02Å; F457-S461 PolarHBondContact O-OG 3.18Å |
| 458 | I | 90.1 | Very high | 74.3 | Confident | 8 Ų | 8 | 83.7 Ų | 83.7 | 4% | 0.041 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -67.3 | -46 | 176.7 | -70.1 | 163.6 | 0 | 0 | 0 | 110.7 | I387 K404 K408 P454 E455 A456 S461 L462 | I387-I458 HydrophobicContact CD1-CB 4.39Å; I387-I458 HydrophobicContact CD1-CG1 3.86Å; I387-I458 HydrophobicContact CG2-CG2 4.47Å; K404-I458 HydrophobicContact CB-CG2 4.4Å; K404-I458 HydrophobicContact CD-CG2 4.19Å; K404-I458 HydrophobicContact CG-CG2 4Å; K408-I458 HydrophobicContact CB-CD1 3.8Å; K408-I458 HydrophobicContact CG-CD1 4.45Å; P454-I458 VanDerWaalsContact O-CG1 3.31Å; P454-I458 WeakPolarHBondContact O-CG1 3.48Å; P454-I458 PolarHBondContact O-N 3.3Å; E455-I458 PolarHBondContact O-N 2.83Å; E455-I458 VanDerWaalsContact O-N 3.1Å; A456-I458 PolarHBondContact O-N 2.99Å; I458-S461 WeakPolarHBondContact O-CB 3.44Å; I458-S461 PolarHBondContact O-N 2.81Å; I458-L462 HydrophobicContact CG2-CD1 4.42Å; I458-L462 WeakPolarHBondContact O-CG 3.49Å; I458-L462 PolarHBondContact O-N 2.76Å |
| 459 | Q | 86.7 | Confident | 71.3 | Confident | 121 Ų | 121 | 88 Ų | 88 | 57% | 0.565 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.1 | -45.6 | 177.3 | -68.4 | 178.6 | 58.4 | 0 | 0 | 112.1 | E455 A456 S461 L462 L463 | E455-Q459 WeakPolarHBondContact O-CG 3.42Å; E455-Q459 PolarHBondContact O-N 2.87Å; A456-Q459 PolarHBondContact O-N 2.79Å; Q459-S461 PolarHBondContact O-N 3.45Å; Q459-L462 WeakPolarHBondContact O-CB 3.43Å; Q459-L462 PolarHBondContact O-N 2.8Å; Q459-L463 PolarHBondContact O-N 3.44Å |
| 460 | Q | 86.5 | Confident | 68.5 | Low | 110 Ų | 110 | 87.2 Ų | 87.2 | 51% | 0.514 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.4 | -28.9 | 176.3 | -177.4 | 59.6 | 97.5 | 0 | 0 | 112.3 | A456 L462 | A456-Q460 WeakPolarHBondContact O-CB 3.48Å; A456-Q460 PolarHBondContact O-N 3.33Å; Q460-L462 VanDerWaalsContact C-N 3.32Å |
| 461 | S | 86.3 | Confident | 65.7 | Low | 4 Ų | 4 | 86.4 Ų | 86.4 | 3% | 0.028 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -73 | -21.3 | 173.1 | -62.5 | 0 | 0 | 0 | 0 | 113.3 | S384 K388 F457 I458 Q459 | S384-S461 WeakPolarHBondContact CA-OG 3.5Å; S384-S461 WeakPolarHBondContact CB-OG 3.21Å; S384-S461 PolarHBondContact OG-OG 2.98Å; K388-S461 WeakPolarHBondContact CE-O 3.3Å; K388-S461 WeakPolarHBondContact CG-O 3.38Å; F457-S461 WeakPolarHBondContact O-CB 3.26Å; F457-S461 PolarHBondContact O-N 3.02Å; F457-S461 PolarHBondContact O-OG 3.18Å; I458-S461 WeakPolarHBondContact O-CB 3.44Å; I458-S461 PolarHBondContact O-N 2.81Å; Q459-S461 PolarHBondContact O-N 3.45Å |
| 462 | L | 81.4 | Confident | 63 | Low | 73 Ų | 73 | 90.3 Ų | 90.3 | 38% | 0.382 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -87.5 | -24.3 | 176.6 | -65.2 | 167 | 0 | 0 | 0 | 112.9 | I387 S391 I458 Q459 Q460 | I387-L462 HydrophobicContact CG2-CD2 3.69Å; I387-L462 HydrophobicContact CG2-CG 3.98Å; S391-L462 WeakPolarHBondContact OG-CD2 3.37Å; I458-L462 HydrophobicContact CG2-CD1 4.42Å; I458-L462 WeakPolarHBondContact O-CG 3.49Å; I458-L462 PolarHBondContact O-N 2.76Å; Q459-L462 WeakPolarHBondContact O-CB 3.43Å; Q459-L462 PolarHBondContact O-N 2.8Å; Q460-L462 VanDerWaalsContact C-N 3.32Å |
| 463 | L | 73.5 | Confident | 60.6 | Low | 105 Ų | 105 | 88.9 Ų | 88.9 | 55% | 0.55 | 54% | 0.54 | S | S | . | . | S | Bend | trans | -66.9 | 136.5 | -177.9 | -138.6 | 72.7 | 0 | 0 | 0 | 111.7 | Q459 Q465 | Q459-L463 PolarHBondContact O-N 3.44Å; L463-Q465 PolarHBondContact O-N 3.24Å |
| 464 | P | 46.5 | Very low | 57.7 | Low | 121 Ų | 121 | 91.9 Ų | 91.9 | 79% | 0.786 | 56% | 0.561 | S | S | * | * | trans | -63.5 | 108.5 | 170.9 | -21.1 | 33.2 | 0 | 0 | 0 | 110.5 | ||||
| 465 | Q | 37.2 | Very low | 54.7 | Low | 138 Ų | 138 | 96.5 Ų | 96.5 | 65% | 0.645 | 59% | 0.594 | S | S | * | * | trans | -71.5 | 128.2 | 169.5 | -81.2 | -179.5 | -41.2 | 0 | 0 | 109.3 | L463 S467 | L463-Q465 PolarHBondContact O-N 3.24Å; Q465-S467 PolarHBondContact O-N 2.8Å | ||
| 466 | P | 31.3 | Very low | 52.3 | Low | 119 Ų | 119 | 99.1 Ų | 99.1 | 77% | 0.773 | 62% | 0.617 | S | S | * | * | trans | -62.8 | 136.7 | 167.8 | 27.6 | -33.3 | 0 | 0 | 0 | 109.2 | S468 | P466-S468 PolarHBondContact O-N 2.97Å; P466-S468 VanDerWaalsContact O-N 3.14Å | ||
| 467 | S | 31.8 | Very low | 49.3 | Very low | 104 Ų | 104 | 101.6 Ų | 101.6 | 73% | 0.727 | 64% | 0.638 | S | S | * | * | trans | -68.6 | 110.3 | 177.6 | 51.9 | 0 | 0 | 0 | 0 | 110.2 | Q465 Q469 | Q465-S467 PolarHBondContact O-N 2.8Å; S467-Q469 VanDerWaalsContact C-N 3.26Å; S467-Q469 PolarHBondContact O-N 3.19Å | ||
| 468 | S | 31.5 | Very low | 46.3 | Very low | 123 Ų | 123 | 108.7 Ų | 108.7 | 86% | 0.86 | 68% | 0.676 | S | S | * | * | trans | -73 | 74.9 | 179.2 | 42.6 | 0 | 0 | 0 | 0 | 112.6 | P466 | P466-S468 PolarHBondContact O-N 2.97Å; P466-S468 VanDerWaalsContact O-N 3.14Å | ||
| 469 | Q | 31.9 | Very low | 43.3 | Very low | 163 Ų | 163 | 112.2 Ų | 112.2 | 76% | 0.762 | 71% | 0.714 | S | S | * | * | trans | -65 | 141.3 | 146.7 | -67.5 | -176.5 | -92 | 0 | 0 | 108.5 | S467 A471 | S467-Q469 VanDerWaalsContact C-N 3.26Å; S467-Q469 PolarHBondContact O-N 3.19Å; Q469-A471 PolarHBondContact O-N 3.4Å; Q469-A471 VanDerWaalsContact O-N 3.16Å | ||
| 470 | P | 32 | Very low | 40.5 | Very low | 138 Ų | 138 | 110.9 Ų | 110.9 | 90% | 0.896 | 72% | 0.724 | S | S | * | * | trans | -72.9 | 105.3 | 166.9 | 29.9 | -31.5 | 0 | 0 | 0 | 109 | ||||
| 471 | A | 27.2 | Very low | 37.6 | Very low | 90 Ų | 90 | 111.8 Ų | 111.8 | 74% | 0.744 | 74% | 0.737 | S | S | * | * | trans | -122.6 | 134.1 | 168.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | Q469 | Q469-A471 PolarHBondContact O-N 3.4Å; Q469-A471 VanDerWaalsContact O-N 3.16Å | ||
| 472 | A | 29.6 | Very low | 34.8 | Very low | 105 Ų | 105 | 117.4 Ų | 117.4 | 87% | 0.868 | 77% | 0.771 | S | S | * | * | trans | -69 | 147.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 473 | A | 28.7 | Very low | 32.2 | Very low | 99 Ų | 99 | 121.9 Ų | 121.9 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -86 | 119.1 | -179 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 474 | T | 25.7 | Very low | 29.9 | Very low | 139 Ų | 139 | 127.9 Ų | 127.9 | 85% | 0.853 | 81% | 0.809 | S | S | * | * | trans | -147.8 | 95.3 | 145.9 | 50.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 475 | S | 24.2 | Very low | 29 | Very low | 117 Ų | 117 | 128.6 Ų | 128.6 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | -85.9 | 168.5 | 151.7 | -67.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 476 | P | 38.1 | Very low | 28.4 | Very low | 127 Ų | 127 | 127 Ų | 127 | 83% | 0.825 | 82% | 0.818 | S | S | * | * | cis | -112.4 | -170 | 5.9 | 39.1 | -22.7 | 0 | 0 | 0 | 111.6 | ||||
| 477 | A | 24.8 | Very low | 28.1 | Very low | 95 Ų | 95 | 129.3 Ų | 129.3 | 79% | 0.785 | 82% | 0.823 | S | S | * | * | cis | -150.2 | -173.4 | 22.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 478 | L | 26.5 | Very low | 27.8 | Very low | 184 Ų | 184 | 129.5 Ų | 129.5 | 96% | 0.963 | 82% | 0.824 | S | S | * | * | trans | -90.4 | 146.9 | -167.2 | -53.7 | 168.3 | 0 | 0 | 0 | 112.3 | ||||
| 479 | G | 28.2 | Very low | 28.1 | Very low | 81 Ų | 81 | 129.3 Ų | 129.3 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | -168.7 | 112.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 480 | A | 27.3 | Very low | 28 | Very low | 94 Ų | 94 | 125.7 Ų | 125.7 | 78% | 0.777 | 82% | 0.818 | S | S | * | * | trans | -66.3 | 153.4 | -163.8 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 481 | V | 26.6 | Very low | 27.8 | Very low | 129 Ų | 129 | 125.9 Ų | 125.9 | 78% | 0.782 | 82% | 0.816 | S | S | * | * | trans | 60.7 | 106.5 | 136.6 | 178.4 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 482 | V | 27.6 | Very low | 27.9 | Very low | 121 Ų | 121 | 126.9 Ų | 126.9 | 73% | 0.733 | 82% | 0.818 | S | S | * | * | trans | 13.8 | 117.5 | 133.2 | -153.7 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 483 | L | 25.9 | Very low | 28.1 | Very low | 167 Ų | 167 | 126.8 Ų | 126.8 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | 177.4 | 158.6 | 111.9 | -93.5 | 172.4 | 0 | 0 | 0 | 112.4 | |||||
| 484 | R | 25.2 | Very low | 28.2 | Very low | 232 Ų | 232 | 126.5 Ų | 126.5 | 88% | 0.875 | 82% | 0.815 | S | S | * | * | trans | -87.7 | 155.6 | 171.8 | -70.4 | 176.1 | 170.9 | 154.4 | -5.2 | 110.5 | ||||
| 485 | P | 27.7 | Very low | 28.2 | Very low | 136 Ų | 136 | 126.8 Ų | 126.8 | 88% | 0.883 | 82% | 0.817 | S | S | * | * | -130.4 | -175.8 | 101.6 | 7.6 | 14.6 | 0 | 0 | 0 | 114.2 | |||||
| 486 | S | 23.9 | Very low | 28.6 | Very low | 103 Ų | 103 | 124.1 Ų | 124.1 | 72% | 0.72 | 81% | 0.808 | S | S | * | * | trans | -130.8 | 153.7 | 175.8 | 176.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 487 | L | 25.7 | Very low | 28.2 | Very low | 168 Ų | 168 | 123.5 Ų | 123.5 | 88% | 0.88 | 81% | 0.806 | S | S | * | * | 165.1 | 155.2 | 126.9 | -85.6 | 164.7 | 0 | 0 | 0 | 113.6 | |||||
| 488 | S | 26.4 | Very low | 28.5 | Very low | 108 Ų | 108 | 125 Ų | 125 | 76% | 0.755 | 81% | 0.806 | S | S | * | * | trans | -89 | 172.9 | 174.7 | -33.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 489 | P | 36.8 | Very low | 28.6 | Very low | 120 Ų | 120 | 121.7 Ų | 121.7 | 78% | 0.779 | 79% | 0.794 | S | S | * | * | -134.2 | 172.3 | 63.8 | 17.6 | 8.5 | 0 | 0 | 0 | 113.8 | |||||
| 490 | A | 29.3 | Very low | 28.6 | Very low | 87 Ų | 87 | 123 Ų | 123 | 72% | 0.719 | 79% | 0.786 | S | S | * | * | cis | 74.3 | 146.3 | 43.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 491 | V | 28.1 | Very low | 28.7 | Very low | 141 Ų | 141 | 128 Ų | 128 | 86% | 0.855 | 79% | 0.79 | S | S | * | * | cis | -129.8 | -133 | 19.3 | -70 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 492 | S | 30.2 | Very low | 29.1 | Very low | 111 Ų | 111 | 126.1 Ų | 126.1 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | trans | -156.8 | 175.7 | -146.3 | -46.9 | 0 | 0 | 0 | 0 | 117 | ||||
| 493 | A | 32.5 | Very low | 29 | Very low | 103 Ų | 103 | 126.9 Ų | 126.9 | 85% | 0.851 | 79% | 0.793 | S | S | * | * | trans | 93.6 | 160.7 | 159 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 494 | A | 30.9 | Very low | 29.5 | Very low | 94 Ų | 94 | 124.9 Ų | 124.9 | 78% | 0.777 | 79% | 0.787 | S | S | * | * | cis | -154.8 | 178.7 | 17.1 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 495 | T | 27.5 | Very low | 29.8 | Very low | 145 Ų | 145 | 121.3 Ų | 121.3 | 89% | 0.89 | 78% | 0.784 | S | S | * | * | trans | -34.3 | 156.2 | 167.1 | -39.2 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 496 | G | 31.6 | Very low | 29.6 | Very low | 61 Ų | 61 | 120.5 Ų | 120.5 | 63% | 0.629 | 78% | 0.776 | S | S | * | * | cis | 144 | 168.4 | -3.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 497 | S | 30.7 | Very low | 29.7 | Very low | 113 Ų | 113 | 123.3 Ų | 123.3 | 79% | 0.79 | 78% | 0.782 | S | S | * | * | trans | 144.2 | 146.5 | 148.4 | 68.3 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 498 | T | 29.3 | Very low | 29.8 | Very low | 126 Ų | 126 | 120.7 Ų | 120.7 | 77% | 0.773 | 78% | 0.778 | S | S | * | * | trans | 68.5 | 123.1 | 159.9 | 71.8 | 0 | 0 | 0 | 0 | 123 | ||||
| 499 | T | 28.7 | Very low | 29.8 | Very low | 116 Ų | 116 | 124.3 Ų | 124.3 | 71% | 0.712 | 78% | 0.783 | S | S | * | * | 155.6 | 117.1 | 108.9 | -67.5 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 500 | T | 28.1 | Very low | 29.3 | Very low | 109 Ų | 109 | 128.7 Ų | 128.7 | 67% | 0.669 | 79% | 0.79 | S | S | * | * | trans | 60.8 | 124.5 | 157.7 | 55.4 | 0 | 0 | 0 | 0 | 126.3 | ||||
| 501 | K | 29.5 | Very low | 29.3 | Very low | 199 Ų | 199 | 129.1 Ų | 129.1 | 87% | 0.865 | 79% | 0.794 | S | S | * | * | trans | 65.2 | 151.5 | 130.6 | -63.1 | 173.6 | -177.9 | 179.4 | 0 | 121.1 | ||||
| 502 | A | 35.2 | Very low | 29.2 | Very low | 88 Ų | 88 | 129.5 Ų | 129.5 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | cis | -175.9 | 149.1 | -26.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 503 | T | 26.9 | Very low | 29.1 | Very low | 138 Ų | 138 | 128.7 Ų | 128.7 | 85% | 0.847 | 79% | 0.785 | S | S | * | * | trans | 166.7 | 154 | 133.9 | -69.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 504 | V | 34.6 | Very low | 28.9 | Very low | 124 Ų | 124 | 132.9 Ų | 132.9 | 75% | 0.752 | 78% | 0.784 | S | S | * | * | trans | -97.6 | -176.9 | -171.1 | -63.4 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 505 | I | 31.5 | Very low | 29.3 | Very low | 158 Ų | 158 | 134.3 Ų | 134.3 | 81% | 0.81 | 79% | 0.785 | S | S | * | * | -117.6 | -150.4 | 50.5 | -29.8 | -176.5 | 0 | 0 | 0 | 112.4 | |||||
| 506 | T | 25.1 | Very low | 29.2 | Very low | 119 Ų | 119 | 130.4 Ų | 130.4 | 73% | 0.73 | 77% | 0.774 | S | S | * | * | trans | -169 | 159.4 | -174.1 | -71.3 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 507 | L | 25.9 | Very low | 29.1 | Very low | 161 Ų | 161 | 135.3 Ų | 135.3 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | trans | 161.1 | 149.6 | 150.8 | -103.5 | 83.1 | 0 | 0 | 0 | 109.2 | ||||
| 508 | S | 27.5 | Very low | 29 | Very low | 113 Ų | 113 | 136.5 Ų | 136.5 | 79% | 0.79 | 79% | 0.787 | S | S | * | * | cis | -161.9 | -162.8 | -25.4 | 61.3 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 509 | Q | 27 | Very low | 29.1 | Very low | 185 Ų | 185 | 135.8 Ų | 135.8 | 86% | 0.864 | 78% | 0.783 | S | S | * | * | trans | -152.1 | 151.4 | -135.9 | -178.1 | -169.5 | 77.1 | 0 | 0 | 113.7 | ||||
| 510 | K | 25.5 | Very low | 29.1 | Very low | 211 Ų | 211 | 136.2 Ų | 136.2 | 92% | 0.917 | 79% | 0.785 | S | S | * | * | trans | -164.2 | 160.7 | 162 | -115.6 | 170.6 | -175.9 | 176.6 | 0 | 112.1 | ||||
| 511 | A | 28.6 | Very low | 29.3 | Very low | 97 Ų | 97 | 139.3 Ų | 139.3 | 80% | 0.802 | 79% | 0.792 | S | S | * | * | trans | -163.7 | -176.4 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 512 | N | 26.5 | Very low | 29.5 | Very low | 148 Ų | 148 | 138.5 Ų | 138.5 | 79% | 0.791 | 79% | 0.792 | S | S | * | * | trans | 75.3 | 152.8 | 172.4 | -126.2 | 11.3 | 0 | 0 | 0 | 115 | ||||
| 513 | S | 28 | Very low | 29.1 | Very low | 94 Ų | 94 | 143.2 Ų | 143.2 | 66% | 0.657 | 80% | 0.799 | S | S | * | * | cis | -153.1 | 150.6 | 13.7 | -41.2 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 514 | K | 27.6 | Very low | 30 | Very low | 191 Ų | 191 | 142.2 Ų | 142.2 | 83% | 0.83 | 79% | 0.794 | S | S | * | * | trans | 18.4 | 166.4 | 135.1 | -76.9 | -177.1 | 179.5 | -178.8 | 0 | 123.1 | ||||
| 515 | P | 40.2 | Very low | 29.7 | Very low | 124 Ų | 124 | 142.8 Ų | 142.8 | 81% | 0.805 | 80% | 0.798 | S | S | * | * | cis | -143.2 | -178.3 | -24.5 | 39 | -20.3 | 0 | 0 | 0 | 116.3 | ||||
| 516 | G | 25.9 | Very low | 29.5 | Very low | 64 Ų | 64 | 144.9 Ų | 144.9 | 66% | 0.66 | 80% | 0.796 | S | S | * | * | trans | 137.4 | 94.6 | 132.2 | 0 | 0 | 0 | 0 | 0 | 123 | ||||
| 517 | L | 29.1 | Very low | 30.6 | Very low | 163 Ų | 163 | 144.2 Ų | 144.2 | 85% | 0.853 | 79% | 0.793 | S | S | * | * | trans | 59.9 | 166 | 149.4 | -66.9 | 119.3 | 0 | 0 | 0 | 118.8 | ||||
| 518 | V | 29.5 | Very low | 30.7 | Very low | 138 Ų | 138 | 142.9 Ų | 142.9 | 84% | 0.836 | 78% | 0.783 | S | S | * | * | cis | -134.2 | 153.7 | 21.9 | 177.2 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 519 | V | 30.4 | Very low | 30.7 | Very low | 112 Ų | 112 | 144 Ų | 144 | 68% | 0.679 | 78% | 0.784 | S | S | * | * | trans | -68.6 | 164.9 | -170.9 | 172.6 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 520 | T | 29.6 | Very low | 30.7 | Very low | 124 Ų | 124 | 140.8 Ų | 140.8 | 76% | 0.761 | 78% | 0.777 | S | S | * | * | -173.3 | 152.8 | -56 | 58 | 0 | 0 | 0 | 0 | 107.9 | |||||
| 521 | Q | 31.5 | Very low | 30.8 | Very low | 175 Ų | 175 | 137.3 Ų | 137.3 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | trans | -149.2 | 102.4 | 165.9 | -167.8 | 162 | 96.3 | 0 | 0 | 117.4 | ||||
| 522 | Q | 32.9 | Very low | 30.9 | Very low | 182 Ų | 182 | 137 Ų | 137 | 85% | 0.85 | 77% | 0.765 | S | S | * | * | trans | 63.4 | 146.6 | 134.8 | -63.2 | 172.3 | -3.7 | 0 | 0 | 124.4 | ||||
| 523 | Q | 28.5 | Very low | 31.1 | Very low | 187 Ų | 187 | 138.5 Ų | 138.5 | 87% | 0.874 | 77% | 0.768 | S | S | * | * | trans | -89.4 | 176.6 | -176 | -91.1 | 171.9 | -29.4 | 0 | 0 | 112.7 | ||||
| 524 | P | 45.1 | Very low | 30.9 | Very low | 116 Ų | 116 | 139.2 Ų | 139.2 | 75% | 0.753 | 77% | 0.772 | S | S | * | * | cis | -124.6 | -155 | 31.1 | 19.7 | 9 | 0 | 0 | 0 | 114.1 | ||||
| 525 | V | 27.8 | Very low | 32 | Very low | 136 Ų | 136 | 135.5 Ų | 135.5 | 82% | 0.824 | 77% | 0.768 | S | S | * | * | cis | -149.1 | -149.1 | 20.8 | -146 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 526 | R | 28.1 | Very low | 31.5 | Very low | 203 Ų | 203 | 137.2 Ų | 137.2 | 77% | 0.766 | 77% | 0.77 | S | S | * | * | trans | -161 | 179.3 | -172.8 | -109 | -178.3 | 102 | 163.3 | 7.8 | 109.2 | ||||
| 527 | P | 47.4 | Very low | 31.8 | Very low | 104 Ų | 104 | 140.5 Ų | 140.5 | 68% | 0.675 | 78% | 0.776 | S | S | * | * | cis | -127.7 | -161 | 2.2 | 43.3 | -25.7 | 0 | 0 | 0 | 112.9 | ||||
| 528 | Q | 27.4 | Very low | 31.7 | Very low | 134 Ų | 134 | 138.9 Ų | 138.9 | 63% | 0.626 | 77% | 0.774 | S | S | * | * | cis | -130.2 | -126.4 | -10.5 | -153.6 | 73.1 | -82.7 | 0 | 0 | 109.8 | ||||
| 529 | V | 28.3 | Very low | 31.6 | Very low | 137 Ų | 137 | 138.6 Ų | 138.6 | 83% | 0.83 | 77% | 0.772 | S | S | * | * | cis | -146.9 | 177 | -4 | 82.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 530 | T | 27.6 | Very low | 31.4 | Very low | 116 Ų | 116 | 145.1 Ų | 145.1 | 71% | 0.712 | 78% | 0.784 | S | S | * | * | trans | -144.8 | 162.3 | -161.4 | -8.7 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 531 | L | 27.7 | Very low | 31.3 | Very low | 139 Ų | 139 | 142.7 Ų | 142.7 | 73% | 0.728 | 78% | 0.784 | S | S | * | * | trans | 74.3 | 138.8 | 167 | -95.4 | 56.8 | 0 | 0 | 0 | 118.4 | ||||
| 532 | A | 29.1 | Very low | 31 | Very low | 90 Ų | 90 | 139.7 Ų | 139.7 | 74% | 0.744 | 79% | 0.789 | S | S | * | * | cis | 99.3 | 144 | -1.9 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 533 | Q | 31.7 | Very low | 30.9 | Very low | 180 Ų | 180 | 135.4 Ų | 135.4 | 84% | 0.841 | 79% | 0.785 | S | S | * | * | trans | 115.6 | 166.6 | 163.5 | -60.7 | -168.2 | 61.2 | 0 | 0 | 119.4 | ||||
| 534 | S | 24.4 | Very low | 31.6 | Very low | 108 Ų | 108 | 131.8 Ų | 131.8 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | trans | -131.2 | -148.8 | -146.4 | 46.9 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 535 | P | 49.2 | Very low | 31 | Very low | 113 Ų | 113 | 131.8 Ų | 131.8 | 73% | 0.734 | 78% | 0.781 | S | S | * | * | -124.2 | -156.5 | -84.3 | 39.9 | -21.8 | 0 | 0 | 0 | 114.6 | |||||
| 536 | L | 29.8 | Very low | 31 | Very low | 161 Ų | 161 | 135.5 Ų | 135.5 | 84% | 0.843 | 78% | 0.78 | S | S | * | * | trans | 112.6 | 151.2 | 144.6 | -160.5 | 66.6 | 0 | 0 | 0 | 120.9 | ||||
| 537 | V | 32.2 | Very low | 31.3 | Very low | 132 Ų | 132 | 132.2 Ų | 132.2 | 80% | 0.8 | 78% | 0.776 | S | S | * | * | trans | 92.9 | 148.4 | 155.6 | 110.3 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 538 | T | 28.5 | Very low | 30.4 | Very low | 130 Ų | 130 | 134.3 Ų | 134.3 | 80% | 0.798 | 78% | 0.78 | S | S | * | * | trans | -175.9 | 172.1 | -171.9 | -89.3 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 539 | V | 27.6 | Very low | 30.5 | Very low | 131 Ų | 131 | 134.3 Ų | 134.3 | 79% | 0.794 | 79% | 0.789 | S | S | * | * | trans | 103.1 | 152.1 | 157.3 | 126.8 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 540 | R | 25.4 | Very low | 30.5 | Very low | 249 Ų | 249 | 131.1 Ų | 131.1 | 94% | 0.94 | 78% | 0.783 | S | S | * | * | trans | 75.8 | 142.2 | 177.5 | -86.2 | 171.6 | 172.7 | 173.4 | -2.6 | 117.2 | ||||
| 541 | G | 26.5 | Very low | 30.6 | Very low | 74 Ų | 74 | 134.7 Ų | 134.7 | 76% | 0.763 | 79% | 0.792 | S | S | * | * | cis | -151.6 | -155.5 | -0.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 542 | A | 25.8 | Very low | 31.4 | Very low | 111 Ų | 111 | 133.6 Ų | 133.6 | 92% | 0.917 | 79% | 0.793 | S | S | * | * | cis | -153.3 | -120.2 | 0.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 543 | A | 30.6 | Very low | 31.2 | Very low | 93 Ų | 93 | 138.2 Ų | 138.2 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | trans | -159.5 | -179.7 | -173.6 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 544 | P | 43.1 | Very low | 30.9 | Very low | 110 Ų | 110 | 138.6 Ų | 138.6 | 71% | 0.714 | 80% | 0.803 | S | S | * | * | cis | -146.6 | 166.9 | 12 | 44 | -24.3 | 0 | 0 | 0 | 120.3 | ||||
| 545 | S | 32.4 | Very low | 30.9 | Very low | 117 Ų | 117 | 139.4 Ų | 139.4 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | 66.7 | 154.1 | 148.5 | -63.4 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 546 | R | 28.1 | Very low | 29.8 | Very low | 213 Ų | 213 | 144.3 Ų | 144.3 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | cis | -157.5 | 139.5 | 10.5 | -152.5 | -175.3 | 168.8 | -179.7 | -7.1 | 112.8 | ||||
| 547 | I | 34.4 | Very low | 29.5 | Very low | 135 Ų | 135 | 144.4 Ų | 144.4 | 69% | 0.692 | 80% | 0.803 | S | S | * | * | trans | 67.9 | 145.5 | 148.6 | -87.1 | 174.8 | 0 | 0 | 0 | 118.3 | ||||
| 548 | I | 28.6 | Very low | 29.3 | Very low | 148 Ų | 148 | 145.5 Ų | 145.5 | 76% | 0.759 | 80% | 0.803 | S | S | * | * | cis | -142.8 | 166 | 6.5 | -137.3 | 167.6 | 0 | 0 | 0 | 114.6 | ||||
| 549 | V | 30.4 | Very low | 30.2 | Very low | 134 Ų | 134 | 144.4 Ų | 144.4 | 81% | 0.812 | 80% | 0.798 | S | S | * | * | trans | -37.8 | 152.9 | 170.6 | -179.6 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 550 | G | 28.1 | Very low | 30.1 | Very low | 69 Ų | 69 | 147.7 Ų | 147.7 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | cis | 150.6 | 168.8 | -11.1 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 551 | Q | 29.7 | Very low | 30.1 | Very low | 192 Ų | 192 | 139.1 Ų | 139.1 | 90% | 0.897 | 79% | 0.794 | S | S | * | * | trans | 85.5 | 159.7 | 156 | -101.8 | -168.3 | 19.3 | 0 | 0 | 121.4 | ||||
| 552 | P | 43.2 | Very low | 30.3 | Very low | 116 Ų | 116 | 140.9 Ų | 140.9 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | -134.3 | -162.2 | -93.9 | 46 | -28.9 | 0 | 0 | 0 | 117.5 | |||||
| 553 | Q | 25.5 | Very low | 30.3 | Very low | 187 Ų | 187 | 141.6 Ų | 141.6 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | trans | -68.5 | 162.1 | -176.9 | -48.8 | 172.9 | -7.4 | 0 | 0 | 115.9 | ||||
| 554 | M | 25.9 | Very low | 30.2 | Very low | 187 Ų | 187 | 142.9 Ų | 142.9 | 92% | 0.921 | 79% | 0.785 | S | S | * | * | -176.7 | 164.8 | 105.9 | -163.3 | 159.7 | -172.8 | 0 | 0 | 113.9 | |||||
| 555 | V | 24.9 | Very low | 29.4 | Very low | 126 Ų | 126 | 145.8 Ų | 145.8 | 76% | 0.764 | 79% | 0.786 | S | S | * | * | trans | -87.1 | 141.4 | -177.5 | 173.6 | 0 | 0 | 0 | 0 | 114 | ||||
| 556 | R | 25 | Very low | 29.3 | Very low | 216 Ų | 216 | 147.3 Ų | 147.3 | 82% | 0.815 | 78% | 0.781 | S | S | * | * | trans | -173.7 | 132.9 | 137.5 | -114.4 | -172.4 | 165.1 | 144 | 1.4 | 118.8 | ||||
| 557 | H | 24 | Very low | 29.1 | Very low | 163 Ų | 163 | 143.9 Ų | 143.9 | 76% | 0.755 | 78% | 0.778 | S | S | * | * | trans | 62.2 | 165.5 | 139.4 | -84.5 | -131 | 0 | 0 | 0 | 123.6 | ||||
| 558 | I | 27.8 | Very low | 28.8 | Very low | 155 Ų | 155 | 142.8 Ų | 142.8 | 80% | 0.795 | 78% | 0.778 | S | S | * | * | trans | -126.9 | 176.7 | -171 | 5.5 | 173.1 | 0 | 0 | 0 | 108.6 | ||||
| 559 | P | 47.5 | Very low | 28.7 | Very low | 107 Ų | 107 | 140 Ų | 140 | 70% | 0.695 | 78% | 0.777 | S | S | * | * | cis | -138.2 | -155.4 | -3.4 | 37.3 | -13.3 | 0 | 0 | 0 | 115.3 | ||||
| 560 | Q | 24.5 | Very low | 29.2 | Very low | 200 Ų | 200 | 139.6 Ų | 139.6 | 94% | 0.935 | 78% | 0.777 | S | S | * | * | trans | 82.6 | 154.6 | 174.6 | -54.7 | -175.9 | -13.2 | 0 | 0 | 116.5 | ||||
| 561 | G | 26.1 | Very low | 29.2 | Very low | 68 Ų | 68 | 139.5 Ų | 139.5 | 70% | 0.701 | 78% | 0.776 | S | S | * | * | cis | 167.5 | 171.6 | -6.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 562 | S | 30.9 | Very low | 29.5 | Very low | 111 Ų | 111 | 136.2 Ų | 136.2 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | trans | 73.6 | 134.6 | 177.8 | -157.4 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 563 | V | 26.8 | Very low | 28.9 | Very low | 126 Ų | 126 | 142.5 Ų | 142.5 | 76% | 0.764 | 78% | 0.778 | S | S | * | * | cis | 72.1 | 122.8 | 43.3 | -174.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 564 | V | 27.5 | Very low | 29.1 | Very low | 120 Ų | 120 | 136.9 Ų | 136.9 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | -155.2 | 138.1 | 82.6 | -172.7 | 0 | 0 | 0 | 0 | 109 | |||||
| 565 | K | 26.6 | Very low | 29.2 | Very low | 172 Ų | 172 | 134.4 Ų | 134.4 | 75% | 0.748 | 77% | 0.765 | S | S | * | * | 53.1 | 163.2 | 78.2 | -123.7 | -169.5 | 176 | -163.1 | 0 | 113.3 | |||||
| 566 | Q | 30.8 | Very low | 29.3 | Very low | 149 Ų | 149 | 137.3 Ų | 137.3 | 70% | 0.696 | 77% | 0.771 | S | S | * | * | cis | -174.9 | 152.4 | 10.1 | -175.8 | 174.3 | -97.5 | 0 | 0 | 106 | ||||
| 567 | N | 23.6 | Very low | 29.5 | Very low | 140 Ų | 140 | 134.5 Ų | 134.5 | 75% | 0.749 | 77% | 0.771 | S | S | * | * | cis | -174 | -173.2 | -18.9 | 179.9 | 31.5 | 0 | 0 | 0 | 107.3 | ||||
| 568 | V | 27.4 | Very low | 29.6 | Very low | 113 Ų | 113 | 134.4 Ų | 134.4 | 69% | 0.685 | 78% | 0.775 | S | S | * | * | trans | 80.9 | 126.6 | 166.8 | -164.1 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 569 | A | 27.3 | Very low | 29.6 | Very low | 90 Ų | 90 | 133.7 Ų | 133.7 | 74% | 0.744 | 77% | 0.773 | S | S | * | * | cis | 81.5 | 167.9 | 36 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 570 | P | 40.5 | Very low | 28.8 | Very low | 124 Ų | 124 | 136.6 Ų | 136.6 | 81% | 0.805 | 78% | 0.777 | S | S | * | * | cis | -134.8 | 171 | -2.4 | 42.4 | -26.1 | 0 | 0 | 0 | 117.1 | ||||
| 571 | G | 28.7 | Very low | 29 | Very low | 68 Ų | 68 | 131.3 Ų | 131.3 | 70% | 0.701 | 77% | 0.768 | S | S | * | * | trans | 98.8 | 157.3 | 147.9 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 572 | T | 34.9 | Very low | 29.2 | Very low | 122 Ų | 122 | 133.1 Ų | 133.1 | 75% | 0.748 | 77% | 0.77 | S | S | * | * | cis | -158.5 | 117.2 | -3.9 | -52.6 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 573 | R | 30.7 | Very low | 29.1 | Very low | 248 Ų | 248 | 135 Ų | 135 | 94% | 0.936 | 77% | 0.77 | S | S | * | * | trans | 58.6 | 156.3 | 149.7 | -60.8 | 174.6 | -169.3 | -163 | 3.3 | 122.7 | ||||
| 574 | G | 29.5 | Very low | 29.4 | Very low | 69 Ų | 69 | 134.9 Ų | 134.9 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | trans | 100.5 | 114.8 | 168.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 575 | V | 28.3 | Very low | 29.6 | Very low | 135 Ų | 135 | 136.6 Ų | 136.6 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | cis | 79 | 75.1 | 9 | -164.3 | 0 | 0 | 0 | 0 | 117 | ||||
| 576 | Q | 28.1 | Very low | 30.1 | Very low | 188 Ų | 188 | 132.4 Ų | 132.4 | 88% | 0.879 | 77% | 0.772 | S | S | * | * | trans | 179.1 | 143.4 | 141.2 | -93.3 | 143.1 | 5.3 | 0 | 0 | 107.6 | ||||
| 577 | L | 28 | Very low | 30.2 | Very low | 157 Ų | 157 | 134.1 Ų | 134.1 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | cis | 95.5 | 65.8 | 27.8 | -163.7 | 93.7 | 0 | 0 | 0 | 115.3 | ||||
| 578 | L | 26.6 | Very low | 30.7 | Very low | 161 Ų | 161 | 137.1 Ų | 137.1 | 84% | 0.843 | 78% | 0.781 | S | S | * | * | trans | -165.5 | 133.8 | 147.6 | -126.8 | 62.3 | 0 | 0 | 0 | 104.8 | ||||
| 579 | N | 27.6 | Very low | 31 | Very low | 139 Ų | 139 | 139.4 Ų | 139.4 | 74% | 0.743 | 79% | 0.789 | S | S | * | * | cis | 71.6 | 129.9 | 41.2 | -159.6 | 23.9 | 0 | 0 | 0 | 114.7 | ||||
| 580 | Q | 29.8 | Very low | 31.7 | Very low | 168 Ų | 168 | 143.3 Ų | 143.3 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | 87.7 | 85.6 | 164.7 | -150.2 | 153.8 | 108.1 | 0 | 0 | 121.1 | ||||
| 581 | A | 29.4 | Very low | 31.4 | Very low | 90 Ų | 90 | 145.8 Ų | 145.8 | 74% | 0.744 | 80% | 0.795 | S | S | * | * | 63.4 | 132.7 | 120.5 | 0 | 0 | 0 | 0 | 0 | 124.8 | |||||
| 582 | S | 30.2 | Very low | 31.8 | Very low | 106 Ų | 106 | 151 Ų | 151 | 74% | 0.741 | 80% | 0.798 | S | S | * | * | trans | 89 | 129.1 | 132.6 | -104.7 | 0 | 0 | 0 | 0 | 123 | ||||
| 583 | L | 29.8 | Very low | 31.7 | Very low | 151 Ų | 151 | 152.7 Ų | 152.7 | 79% | 0.791 | 80% | 0.798 | S | S | * | * | trans | 64.4 | 133.7 | 157.6 | -45.8 | -179 | 0 | 0 | 0 | 116.1 | ||||
| 584 | V | 32.4 | Very low | 31.9 | Very low | 123 Ų | 123 | 144.9 Ų | 144.9 | 75% | 0.745 | 79% | 0.786 | S | S | * | * | cis | 63.1 | 116.8 | 45.1 | -171 | 0 | 0 | 0 | 0 | 110 | ||||
| 585 | D | 30.8 | Very low | 32.1 | Very low | 156 Ų | 156 | 145.5 Ų | 145.5 | 83% | 0.834 | 79% | 0.792 | S | S | * | * | cis | -145.7 | -170.4 | 30.2 | -143.9 | -45.1 | 0 | 0 | 0 | 112.7 | ||||
| 586 | A | 37.2 | Very low | 32.4 | Very low | 84 Ų | 84 | 142.9 Ų | 142.9 | 69% | 0.694 | 79% | 0.793 | S | S | * | * | trans | -94.3 | 152.6 | -164.1 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 587 | Q | 32.5 | Very low | 33.1 | Very low | 184 Ų | 184 | 137.6 Ų | 137.6 | 86% | 0.86 | 79% | 0.789 | S | S | * | * | trans | -132.6 | 110.6 | 150.3 | -96.3 | -172.4 | -145.4 | 0 | 0 | 109.2 | ||||
| 588 | R | 35.6 | Very low | 34.1 | Very low | 204 Ų | 204 | 136.2 Ų | 136.2 | 77% | 0.77 | 79% | 0.787 | S | S | * | * | 82 | 102.6 | 68.9 | -177.2 | -169.4 | -178 | 172.7 | 3.5 | 112.7 | |||||
| 589 | N | 33.3 | Very low | 35.1 | Very low | 160 Ų | 160 | 138 Ų | 138 | 86% | 0.856 | 79% | 0.788 | S | S | * | * | -147.7 | 162.9 | 126.1 | -131.8 | -23 | 0 | 0 | 0 | 112.3 | |||||
| 590 | K | 42 | Very low | 36.4 | Very low | 173 Ų | 173 | 139.8 Ų | 139.8 | 75% | 0.752 | 79% | 0.79 | S | S | * | * | trans | -118.1 | 135.8 | -177.1 | -66.4 | 170.5 | 173.8 | -75.3 | 0 | 110 | ||||
| 591 | L | 34.3 | Very low | 37.5 | Very low | 176 Ų | 176 | 138.5 Ų | 138.5 | 92% | 0.921 | 79% | 0.788 | S | S | * | * | -157 | 159 | 121.4 | -142.6 | 57 | 0 | 0 | 0 | 113.4 | |||||
| 592 | K | 36.1 | Very low | 38.8 | Very low | 178 Ų | 178 | 140.2 Ų | 140.2 | 77% | 0.774 | 78% | 0.784 | S | S | * | * | trans | -96.1 | 150.4 | 179 | 177.5 | 177.2 | 175.5 | -177.1 | 0 | 106.6 | ||||
| 593 | E | 33.3 | Very low | 40.1 | Very low | 156 Ų | 156 | 140.9 Ų | 140.9 | 73% | 0.729 | 78% | 0.78 | S | S | * | * | cis | -160.5 | 172.2 | 33.5 | -130.3 | -92.3 | 106 | 0 | 0 | 111 | ||||
| 594 | A | 34.8 | Very low | 41.6 | Very low | 85 Ų | 85 | 137.4 Ų | 137.4 | 70% | 0.702 | 76% | 0.762 | S | S | * | * | trans | 52.1 | 129 | 154.5 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 595 | G | 34.5 | Very low | 43.1 | Very low | 81 Ų | 81 | 137.3 Ų | 137.3 | 84% | 0.835 | 76% | 0.756 | S | S | * | * | 116.5 | 76.9 | 127.2 | 0 | 0 | 0 | 0 | 0 | 121.9 | |||||
| 596 | G | 35.1 | Very low | 44.4 | Very low | 81 Ų | 81 | 136.4 Ų | 136.4 | 84% | 0.835 | 75% | 0.751 | S | S | * | * | trans | 71.5 | 114 | 136.2 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 597 | G | 42.4 | Very low | 46.2 | Very low | 76 Ų | 76 | 135.1 Ų | 135.1 | 78% | 0.784 | 73% | 0.733 | S | S | * | * | trans | 80.8 | 161.7 | 166.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 598 | T | 48.1 | Very low | 47.9 | Very low | 128 Ų | 128 | 131.7 Ų | 131.7 | 79% | 0.785 | 72% | 0.724 | S | S | * | * | cis | -150.6 | -177.9 | 2.8 | 55.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 599 | F | 47.8 | Very low | 49.3 | Very low | 198 Ų | 198 | 123.8 Ų | 123.8 | 87% | 0.868 | 70% | 0.698 | S | S | * | * | S | Bend | trans | 66.2 | 71.8 | 163.4 | -89.4 | -87.8 | 0 | 0 | 0 | 118.9 | ||
| 600 | K | 54.3 | Low | 50.9 | Low | 178 Ų | 178 | 118.6 Ų | 118.6 | 77% | 0.774 | 68% | 0.675 | S | S | * | * | -177 | 81.5 | 121 | -104.8 | 177.5 | 166.8 | -80.4 | 0 | 109.8 | |||||
| 601 | D | 54.4 | Low | 52.2 | Low | 140 Ų | 140 | 117.9 Ų | 117.9 | 75% | 0.749 | 68% | 0.676 | S | S | * | * | trans | -150.6 | 57.9 | -177.6 | -159.4 | -87.4 | 0 | 0 | 0 | 107 | ||||
| 602 | D | 55.6 | Low | 53.8 | Low | 126 Ų | 126 | 112.8 Ų | 112.8 | 67% | 0.674 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -144.6 | -13.7 | -171.1 | -156.6 | 26.7 | 0 | 0 | 0 | 112.6 | ||
| 603 | D | 58.4 | Low | 55.2 | Low | 121 Ų | 121 | 107.7 Ų | 107.7 | 65% | 0.647 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -77.9 | -34.8 | 163.6 | -71 | -65 | 0 | 0 | 0 | 110.5 | I605 N606 D607 | D603-I605 PolarHBondContact O-N 2.9Å; D603-N606 PolarHBondContact O-N 3.15Å; D603-D607 PolarHBondContact O-N 3.25Å |
| 604 | D | 61.4 | Low | 56.7 | Low | 77 Ų | 77 | 102.7 Ų | 102.7 | 41% | 0.412 | 64% | 0.637 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70 | -25.2 | -174.9 | -62.7 | -87.6 | 0 | 0 | 0 | 115 | N606 S610 | D604-N606 VanDerWaalsContact C-N 3.26Å; D604-N606 PolarHBondContact O-N 3.07Å; D604-S610 PolarHBondContact OD1-OG 3.24Å |
| 605 | I | 62.4 | Low | 58.7 | Low | 121 Ų | 121 | 102.7 Ų | 102.7 | 62% | 0.621 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | -17.5 | -177.4 | -159.5 | 64.3 | 0 | 0 | 0 | 113 | D603 | D603-I605 PolarHBondContact O-N 2.9Š|
| 606 | N | 59.8 | Low | 60.6 | Low | 137 Ų | 137 | 103.5 Ų | 103.5 | 73% | 0.733 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115 | -13.1 | 177.2 | -75.6 | -67.3 | 0 | 0 | 0 | 113.6 | D603 D604 V608 | D603-N606 PolarHBondContact O-N 3.15Å; D604-N606 VanDerWaalsContact C-N 3.26Å; D604-N606 PolarHBondContact O-N 3.07Å; N606-V608 PolarHBondContact O-N 3.44Å; N606-V608 VanDerWaalsContact O-N 3.09Å |
| 607 | D | 73.9 | Confident | 62.3 | Low | 57 Ų | 57 | 103.7 Ų | 103.7 | 31% | 0.305 | 60% | 0.599 | S | S | . | * | trans | -76.4 | 99 | 173.8 | -170 | 3.8 | 0 | 0 | 0 | 111.2 | D603 T609 S610 M611 | D603-D607 PolarHBondContact O-N 3.25Å; D607-T609 PolarHBondContact O-N 3.4Å; D607-T609 WeakPolarHBondContact OD1-CA 3.48Å; D607-T609 WeakPolarHBondContact OD1-CB 3.39Å; D607-T609 PolarHBondContact OD1-N 2.89Å; D607-T609 PolarHBondContact OD1-OG1 2.84Å; D607-S610 WeakPolarHBondContact O-CA 3.48Å; D607-S610 WeakPolarHBondContact O-CB 3.49Å; D607-S610 PolarHBondContact O-N 2.93Å; D607-M611 PolarHBondContact O-N 2.85Å | ||
| 608 | V | 68.2 | Low | 64 | Low | 113 Ų | 113 | 104.5 Ų | 104.5 | 69% | 0.685 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -53.1 | -22.1 | 171.2 | -75.2 | 0 | 0 | 0 | 0 | 113.5 | N606 A612 | N606-V608 PolarHBondContact O-N 3.44Å; N606-V608 VanDerWaalsContact O-N 3.09Å; V608-A612 WeakPolarHBondContact O-CB 3.27Å; V608-A612 PolarHBondContact O-N 3.42Å; V608-A612 VanDerWaalsContact O-N 3.08Å |
| 609 | T | 65.6 | Low | 65.2 | Low | 37 Ų | 37 | 103 Ų | 103 | 23% | 0.227 | 57% | 0.566 | C | S | . | * | H | α-helix | trans | -76.1 | -39.7 | 175.9 | -25 | 0 | 0 | 0 | 0 | 111.2 | D607 A612 G613 V614 L616 | D607-T609 PolarHBondContact O-N 3.4Å; D607-T609 WeakPolarHBondContact OD1-CA 3.48Å; D607-T609 WeakPolarHBondContact OD1-CB 3.39Å; D607-T609 PolarHBondContact OD1-N 2.89Å; D607-T609 PolarHBondContact OD1-OG1 2.84Å; T609-A612 PolarHBondContact O-N 3.06Å; T609-G613 PolarHBondContact O-N 3.29Å; T609-V614 HydrophobicContact CG2-CB 3.82Å; T609-V614 HydrophobicContact CG2-CG1 3.87Å; T609-V614 PolarHBondContact O-N 3Å; T609-L616 HydrophobicContact CG2-CD1 3.94Å; T609-L616 HydrophobicContact CG2-CD2 3.85Å; T609-L616 HydrophobicContact CG2-CG 3.65Å |
| 610 | S | 66.5 | Low | 66.2 | Low | 51 Ų | 51 | 97.9 Ų | 97.9 | 36% | 0.357 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65.4 | -44.4 | 170.8 | -160.8 | 0 | 0 | 0 | 0 | 111.1 | D604 D607 A612 G613 | D604-S610 PolarHBondContact OD1-OG 3.24Å; D607-S610 WeakPolarHBondContact O-CA 3.48Å; D607-S610 WeakPolarHBondContact O-CB 3.49Å; D607-S610 PolarHBondContact O-N 2.93Å; S610-A612 PolarHBondContact O-N 3.23Å; S610-G613 PolarHBondContact O-N 3.16Å |
| 611 | M | 68.6 | Low | 67.3 | Low | 158 Ų | 158 | 92 Ų | 92 | 78% | 0.778 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -58.1 | -30.3 | 171.2 | -87.3 | -165.1 | 68 | 0 | 0 | 114.1 | D607 G613 | D607-M611 PolarHBondContact O-N 2.85Å; M611-G613 VanDerWaalsContact C-N 3.26Å; M611-G613 PolarHBondContact O-N 3.34Å |
| 612 | A | 68 | Low | 68.1 | Low | 70 Ų | 70 | 91.7 Ų | 91.7 | 58% | 0.579 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.5 | -3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | V608 T609 S610 V614 | V608-A612 WeakPolarHBondContact O-CB 3.27Å; V608-A612 PolarHBondContact O-N 3.42Å; V608-A612 VanDerWaalsContact O-N 3.08Å; T609-A612 PolarHBondContact O-N 3.06Å; S610-A612 PolarHBondContact O-N 3.23Å; A612-V614 VanDerWaalsContact C-N 3.25Å; A612-V614 HydrophobicContact CB-CG2 4.08Å; A612-V614 PolarHBondContact O-N 3.29Å |
| 613 | G | 65.6 | Low | 68.7 | Low | 70 Ų | 70 | 90.1 Ų | 90.1 | 72% | 0.722 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.6 | 15.2 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | T609 S610 M611 | T609-G613 PolarHBondContact O-N 3.29Å; S610-G613 PolarHBondContact O-N 3.16Å; M611-G613 VanDerWaalsContact C-N 3.26Å; M611-G613 PolarHBondContact O-N 3.34Å |
| 614 | V | 65.4 | Low | 69.1 | Low | 52 Ų | 52 | 90 Ų | 90 | 32% | 0.315 | 51% | 0.509 | S | S | . | . | trans | -98.2 | 94.3 | -176.1 | 179.4 | 0 | 0 | 0 | 0 | 108.9 | T609 A612 L616 | T609-V614 HydrophobicContact CG2-CB 3.82Å; T609-V614 HydrophobicContact CG2-CG1 3.87Å; T609-V614 PolarHBondContact O-N 3Å; A612-V614 VanDerWaalsContact C-N 3.25Å; A612-V614 HydrophobicContact CB-CG2 4.08Å; A612-V614 PolarHBondContact O-N 3.29Å; V614-L616 PolarHBondContact O-N 3.33Å | ||
| 615 | N | 77.4 | Confident | 69.3 | Low | 85 Ų | 85 | 89.2 Ų | 89.2 | 46% | 0.455 | 51% | 0.513 | S | S | . | . | trans | -71.3 | 99.4 | 175.6 | -177 | -22.5 | 0 | 0 | 0 | 110.1 | S617 E618 E619 | N615-S617 PolarHBondContact O-N 3.16Å; N615-S617 VanDerWaalsContact O-N 3.16Å; N615-S617 WeakPolarHBondContact OD1-CB 3.36Å; N615-S617 PolarHBondContact OD1-N 3.2Å; N615-S617 PolarHBondContact OD1-OG 2.71Å; N615-E618 HydrophobicContact CB-CB 3.9Å; N615-E618 PolarHBondContact O-N 3.14Å; N615-E618 PolarHBondContact OD1-N 3.02Å; N615-E618 VanDerWaalsContact OD1-N 3.12Å; N615-E619 PolarHBondContact O-N 3.14Å | ||
| 616 | L | 73.1 | Confident | 69.2 | Low | 98 Ų | 98 | 87 Ų | 87 | 51% | 0.513 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -54.9 | -31.2 | 178.7 | -75.8 | 171.3 | 0 | 0 | 0 | 113.6 | T609 V614 N620 | T609-L616 HydrophobicContact CG2-CD1 3.94Å; T609-L616 HydrophobicContact CG2-CD2 3.85Å; T609-L616 HydrophobicContact CG2-CG 3.65Å; V614-L616 PolarHBondContact O-N 3.33Å; L616-N620 WeakPolarHBondContact O-CB 3.34Å; L616-N620 PolarHBondContact O-N 3.16Å |
| 617 | S | 72.3 | Confident | 69 | Low | 85 Ų | 85 | 83.1 Ų | 83.1 | 59% | 0.594 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -74.5 | -37.8 | 177.1 | 75.5 | 0 | 0 | 0 | 0 | 112.1 | N615 A621 | N615-S617 PolarHBondContact O-N 3.16Å; N615-S617 VanDerWaalsContact O-N 3.16Å; N615-S617 WeakPolarHBondContact OD1-CB 3.36Å; N615-S617 PolarHBondContact OD1-N 3.2Å; N615-S617 PolarHBondContact OD1-OG 2.71Å; S617-A621 WeakPolarHBondContact O-CB 3.49Å; S617-A621 PolarHBondContact O-N 2.86Å |
| 618 | E | 78 | Confident | 68.2 | Low | 93 Ų | 93 | 84.2 Ų | 84.2 | 44% | 0.435 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -72.7 | -39.5 | 175.7 | -161.5 | -164.7 | -179.1 | 0 | 0 | 111.3 | N615 A621 R622 | N615-E618 HydrophobicContact CB-CB 3.9Å; N615-E618 PolarHBondContact O-N 3.14Å; N615-E618 PolarHBondContact OD1-N 3.02Å; N615-E618 VanDerWaalsContact OD1-N 3.12Å; E618-A621 PolarHBondContact O-N 2.86Å; E618-R622 VanDerWaalsContact CD-CZ 3.41Å; E618-R622 VanDerWaalsContact CD-NH1 3.28Å; E618-R622 WeakPolarHBondContact O-CB 3.43Å; E618-R622 WeakPolarHBondContact O-CG 3.29Å; E618-R622 PolarHBondContact O-N 3.1Å; E618-R622 IonicContact OE1-CZ 2.71Å; E618-R622 VanDerWaalsContact OE1-CZ 3.26Å; E618-R622 IonicContact OE1-NH1 3.02Å; E618-R622 PolarHBondContact OE1-NH1 3.38Å; E618-R622 IonicContact OE1-NH2 3.83Å; E618-R622 PolarHBondContact OE1-NH2 3.26Å; E618-R622 VanDerWaalsContact OE1-NH2 3.16Å; E618-R622 IonicContact OE2-CZ 2.68Å; E618-R622 IonicContact OE2-NH1 3.22Å; E618-R622 IonicContact OE2-NH2 3.32Å; E618-R622 PolarHBondContact OE2-NH2 3.45Å |
| 619 | E | 73.6 | Confident | 67.7 | Low | 95 Ų | 95 | 85.5 Ų | 85.5 | 44% | 0.444 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -72.3 | -40.2 | 176.9 | -170.9 | 154.8 | 152.3 | 0 | 0 | 111.9 | N615 A621 R622 I623 | N615-E619 PolarHBondContact O-N 3.14Å; E619-A621 VanDerWaalsContact C-N 3.31Å; E619-A621 PolarHBondContact O-N 3.14Å; E619-R622 CarbonylContact O-C 3.53Å; E619-R622 PolarHBondContact O-N 2.99Å; E619-R622 VanDerWaalsContact O-N 3.16Å; E619-I623 HydrophobicContact CG-CD1 4.03Å; E619-I623 HydrophobicContact CG-CG1 4.45Å; E619-I623 WeakPolarHBondContact O-CB 3.47Å; E619-I623 VanDerWaalsContact O-CG1 3.27Å; E619-I623 WeakPolarHBondContact O-CG1 3.3Å; E619-I623 PolarHBondContact O-N 3.25Å |
| 620 | N | 68.7 | Low | 67 | Low | 91 Ų | 91 | 89.3 Ų | 89.3 | 49% | 0.487 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.7 | -38.2 | 170.1 | -172.2 | 31.5 | 0 | 0 | 0 | 111.2 | L616 I623 M624 | L616-N620 WeakPolarHBondContact O-CB 3.34Å; L616-N620 PolarHBondContact O-N 3.16Å; N620-I623 PolarHBondContact O-N 3.43Å; N620-M624 WeakPolarHBondContact O-CB 3.4Å; N620-M624 WeakPolarHBondContact O-CG 3.15Å; N620-M624 PolarHBondContact O-N 3.47Å |
| 621 | A | 75.6 | Confident | 66.4 | Low | 55 Ų | 55 | 90.7 Ų | 90.7 | 46% | 0.455 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64 | -39.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S617 E618 E619 M624 A625 | S617-A621 WeakPolarHBondContact O-CB 3.49Å; S617-A621 PolarHBondContact O-N 2.86Å; E618-A621 PolarHBondContact O-N 2.86Å; E619-A621 VanDerWaalsContact C-N 3.31Å; E619-A621 PolarHBondContact O-N 3.14Å; A621-M624 PolarHBondContact O-N 2.76Å; A621-A625 WeakPolarHBondContact O-CB 3.41Å; A621-A625 PolarHBondContact O-N 3.26Å |
| 622 | R | 71.2 | Confident | 65.7 | Low | 133 Ų | 133 | 84.2 Ų | 84.2 | 50% | 0.502 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.8 | -38.2 | 173 | -79.8 | -164.3 | -95.6 | -93.3 | 1 | 112.3 | E618 E619 S626 | E618-R622 VanDerWaalsContact CD-CZ 3.41Å; E618-R622 VanDerWaalsContact CD-NH1 3.28Å; E618-R622 WeakPolarHBondContact O-CB 3.43Å; E618-R622 WeakPolarHBondContact O-CG 3.29Å; E618-R622 PolarHBondContact O-N 3.1Å; E618-R622 IonicContact OE1-CZ 2.71Å; E618-R622 VanDerWaalsContact OE1-CZ 3.26Å; E618-R622 IonicContact OE1-NH1 3.02Å; E618-R622 PolarHBondContact OE1-NH1 3.38Å; E618-R622 IonicContact OE1-NH2 3.83Å; E618-R622 PolarHBondContact OE1-NH2 3.26Å; E618-R622 VanDerWaalsContact OE1-NH2 3.16Å; E618-R622 IonicContact OE2-CZ 2.68Å; E618-R622 IonicContact OE2-NH1 3.22Å; E618-R622 IonicContact OE2-NH2 3.32Å; E618-R622 PolarHBondContact OE2-NH2 3.45Å; E619-R622 CarbonylContact O-C 3.53Å; E619-R622 PolarHBondContact O-N 2.99Å; E619-R622 VanDerWaalsContact O-N 3.16Å; R622-S626 VanDerWaalsContact O-CB 3.24Å; R622-S626 WeakPolarHBondContact O-CB 3.37Å; R622-S626 PolarHBondContact O-N 2.9Å; R622-S626 PolarHBondContact O-OG 2.91Å |
| 623 | I | 68.1 | Low | 65.1 | Low | 94 Ų | 94 | 85.9 Ų | 85.9 | 48% | 0.482 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.5 | -45.6 | 174.9 | -70.7 | 165.1 | 0 | 0 | 0 | 110 | E619 N620 S627 | E619-I623 HydrophobicContact CG-CD1 4.03Å; E619-I623 HydrophobicContact CG-CG1 4.45Å; E619-I623 WeakPolarHBondContact O-CB 3.47Å; E619-I623 VanDerWaalsContact O-CG1 3.27Å; E619-I623 WeakPolarHBondContact O-CG1 3.3Å; E619-I623 PolarHBondContact O-N 3.25Å; N620-I623 PolarHBondContact O-N 3.43Å; I623-S627 WeakPolarHBondContact O-CB 3.39Å; I623-S627 PolarHBondContact O-N 3.45Å; I623-S627 PolarHBondContact O-OG 3.34Å |
| 624 | M | 67.6 | Low | 64.1 | Low | 119 Ų | 119 | 87.9 Ų | 87.9 | 59% | 0.586 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -65.5 | -36.7 | 175.5 | -72.4 | -171.4 | 73 | 0 | 0 | 112.1 | N620 A621 S627 S628 | N620-M624 WeakPolarHBondContact O-CB 3.4Å; N620-M624 WeakPolarHBondContact O-CG 3.15Å; N620-M624 PolarHBondContact O-N 3.47Å; A621-M624 PolarHBondContact O-N 2.76Å; M624-S627 WeakPolarHBondContact CA-OG 3.38Å; M624-S627 PolarHBondContact O-OG 2.98Å; M624-S628 WeakPolarHBondContact O-CA 3.38Å; M624-S628 WeakPolarHBondContact O-CB 3.31Å; M624-S628 PolarHBondContact O-N 3.21Å |
| 625 | A | 64.8 | Low | 63.2 | Low | 60 Ų | 60 | 90 Ų | 90 | 50% | 0.496 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -69.4 | -47.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A621 S628 E629 | A621-A625 WeakPolarHBondContact O-CB 3.41Å; A621-A625 PolarHBondContact O-N 3.26Å; A625-S628 CarbonylContact O-C 3.58Å; A625-S628 PolarHBondContact O-N 3.01Å; A625-E629 PolarHBondContact O-N 3.2Å |
| 626 | S | 61.5 | Low | 61.9 | Low | 75 Ų | 75 | 95.7 Ų | 95.7 | 52% | 0.524 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -68.6 | -37.4 | -179.6 | -52.1 | 0 | 0 | 0 | 0 | 112 | R622 E629 L630 | R622-S626 VanDerWaalsContact O-CB 3.24Å; R622-S626 WeakPolarHBondContact O-CB 3.37Å; R622-S626 PolarHBondContact O-N 2.9Å; R622-S626 PolarHBondContact O-OG 2.91Å; S626-E629 PolarHBondContact O-N 3.4Å; S626-L630 PolarHBondContact O-N 2.77Å |
| 627 | S | 54.9 | Low | 60.9 | Low | 54 Ų | 54 | 95.5 Ų | 95.5 | 38% | 0.378 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -71.4 | -33.4 | 170.6 | 63.9 | 0 | 0 | 0 | 0 | 111.7 | I623 M624 E629 L630 V631 | I623-S627 WeakPolarHBondContact O-CB 3.39Å; I623-S627 PolarHBondContact O-N 3.45Å; I623-S627 PolarHBondContact O-OG 3.34Å; M624-S627 WeakPolarHBondContact CA-OG 3.38Å; M624-S627 PolarHBondContact O-OG 2.98Å; S627-E629 VanDerWaalsContact C-N 3.34Å; S627-L630 PolarHBondContact O-N 2.92Å; S627-V631 WeakPolarHBondContact O-CA 3.45Å; S627-V631 WeakPolarHBondContact O-CB 3.23Å; S627-V631 WeakPolarHBondContact O-CG2 3.44Å; S627-V631 PolarHBondContact O-N 3.23Å |
| 628 | S | 57.8 | Low | 59.9 | Low | 81 Ų | 81 | 97.2 Ų | 97.2 | 57% | 0.566 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -70.6 | -26.6 | 171.8 | -171.7 | 0 | 0 | 0 | 0 | 112.9 | M624 A625 G632 | M624-S628 WeakPolarHBondContact O-CA 3.38Å; M624-S628 WeakPolarHBondContact O-CB 3.31Å; M624-S628 PolarHBondContact O-N 3.21Å; A625-S628 CarbonylContact O-C 3.58Å; A625-S628 PolarHBondContact O-N 3.01Å; S628-G632 WeakPolarHBondContact O-CA 3.24Å; S628-G632 PolarHBondContact O-N 3.07Å |
| 629 | E | 57.3 | Low | 58.8 | Low | 140 Ų | 140 | 100.5 Ų | 100.5 | 65% | 0.654 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -71 | -50.5 | 168.7 | -173.7 | 172.1 | -163.9 | 0 | 0 | 110.8 | A625 S626 S627 G632 I633 | A625-E629 PolarHBondContact O-N 3.2Å; S626-E629 PolarHBondContact O-N 3.4Å; S627-E629 VanDerWaalsContact C-N 3.34Å; E629-G632 CarbonylContact O-C 3.56Å; E629-G632 PolarHBondContact O-N 2.98Å; E629-I633 HydrophobicContact CG-CD1 4.16Å; E629-I633 WeakPolarHBondContact O-CD1 3.5Å; E629-I633 VanDerWaalsContact O-CG1 3.26Å; E629-I633 WeakPolarHBondContact O-CG1 3.43Å; E629-I633 PolarHBondContact O-N 2.88Å |
| 630 | L | 51.6 | Low | 58.6 | Low | 117 Ų | 117 | 101.2 Ų | 101.2 | 61% | 0.613 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67.4 | -47.4 | -179.7 | -176 | 61.5 | 0 | 0 | 0 | 112.7 | S626 S627 G632 I633 V634 | S626-L630 PolarHBondContact O-N 2.77Å; S627-L630 PolarHBondContact O-N 2.92Å; L630-G632 VanDerWaalsContact C-N 3.28Å; L630-G632 PolarHBondContact O-N 3.18Å; L630-I633 PolarHBondContact O-N 3.27Å; L630-V634 WeakPolarHBondContact O-CG2 3.49Å; L630-V634 PolarHBondContact O-N 2.87Å |
| 631 | V | 53 | Low | 59 | Low | 80 Ų | 80 | 102.6 Ų | 102.6 | 49% | 0.485 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65 | -34.1 | 171.1 | 177 | 0 | 0 | 0 | 0 | 109.7 | S627 I633 V634 T635 | S627-V631 WeakPolarHBondContact O-CA 3.45Å; S627-V631 WeakPolarHBondContact O-CB 3.23Å; S627-V631 WeakPolarHBondContact O-CG2 3.44Å; S627-V631 PolarHBondContact O-N 3.23Å; V631-I633 VanDerWaalsContact C-N 3.3Å; V631-I633 PolarHBondContact O-N 3.43Å; V631-V634 CarbonylContact O-C 3.6Å; V631-V634 PolarHBondContact O-N 3.15Å; V631-T635 HydrophobicContact CG1-CG2 3.72Å; V631-T635 WeakPolarHBondContact O-CA 3.43Å; V631-T635 VanDerWaalsContact O-CB 3.26Å; V631-T635 WeakPolarHBondContact O-CB 3.42Å; V631-T635 WeakPolarHBondContact O-CG2 3.49Å; V631-T635 PolarHBondContact O-N 3.16Å; V631-T635 PolarHBondContact O-OG1 2.9Å |
| 632 | G | 53.3 | Low | 59.3 | Low | 21 Ų | 21 | 101.3 Ų | 101.3 | 22% | 0.216 | 55% | 0.554 | C | S | . | * | H | α-helix | trans | -68.4 | -24.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | S628 E629 L630 R636 | S628-G632 WeakPolarHBondContact O-CA 3.24Å; S628-G632 PolarHBondContact O-N 3.07Å; E629-G632 CarbonylContact O-C 3.56Å; E629-G632 PolarHBondContact O-N 2.98Å; L630-G632 VanDerWaalsContact C-N 3.28Å; L630-G632 PolarHBondContact O-N 3.18Å; G632-R636 WeakPolarHBondContact O-CB 3.39Å; G632-R636 VanDerWaalsContact O-CD 3.28Å; G632-R636 WeakPolarHBondContact O-CD 3.24Å; G632-R636 WeakPolarHBondContact O-CG 3.44Å; G632-R636 PolarHBondContact O-N 3.14Å |
| 633 | I | 55.4 | Low | 60.3 | Low | 106 Ų | 106 | 100.2 Ų | 100.2 | 54% | 0.544 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -78.5 | -36.2 | 169.3 | -69.9 | 160.2 | 0 | 0 | 0 | 110.7 | E629 L630 V631 | E629-I633 HydrophobicContact CG-CD1 4.16Å; E629-I633 WeakPolarHBondContact O-CD1 3.5Å; E629-I633 VanDerWaalsContact O-CG1 3.26Å; E629-I633 WeakPolarHBondContact O-CG1 3.43Å; E629-I633 PolarHBondContact O-N 2.88Å; L630-I633 PolarHBondContact O-N 3.27Å; V631-I633 VanDerWaalsContact C-N 3.3Å; V631-I633 PolarHBondContact O-N 3.43Å |
| 634 | V | 46.3 | Very low | 61.4 | Low | 112 Ų | 112 | 98.2 Ų | 98.2 | 68% | 0.679 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -79 | -29.9 | 177.6 | 173.2 | 0 | 0 | 0 | 0 | 113 | L630 V631 | L630-V634 WeakPolarHBondContact O-CG2 3.49Å; L630-V634 PolarHBondContact O-N 2.87Å; V631-V634 CarbonylContact O-C 3.6Å; V631-V634 PolarHBondContact O-N 3.15Å |
| 635 | T | 46.3 | Very low | 62.6 | Low | 95 Ų | 95 | 96.1 Ų | 96.1 | 58% | 0.583 | 54% | 0.54 | S | S | * | . | S | Bend | trans | -102.4 | 2.1 | 178.6 | 63 | 0 | 0 | 0 | 0 | 113.4 | V631 S637 | V631-T635 HydrophobicContact CG1-CG2 3.72Å; V631-T635 WeakPolarHBondContact O-CA 3.43Å; V631-T635 VanDerWaalsContact O-CB 3.26Å; V631-T635 WeakPolarHBondContact O-CB 3.42Å; V631-T635 WeakPolarHBondContact O-CG2 3.49Å; V631-T635 PolarHBondContact O-N 3.16Å; V631-T635 PolarHBondContact O-OG1 2.9Å; T635-S637 PolarHBondContact O-N 2.79Å |
| 636 | R | 48.7 | Very low | 63.9 | Low | 206 Ų | 206 | 96.1 Ų | 96.1 | 78% | 0.777 | 53% | 0.531 | S | S | * | . | S | Bend | trans | -65.5 | 69.6 | 138 | -79.5 | 165.5 | -162.2 | -82.2 | 0.9 | 107.8 | G632 | G632-R636 WeakPolarHBondContact O-CB 3.39Å; G632-R636 VanDerWaalsContact O-CD 3.28Å; G632-R636 WeakPolarHBondContact O-CD 3.24Å; G632-R636 WeakPolarHBondContact O-CG 3.44Å; G632-R636 PolarHBondContact O-N 3.14Å |
| 637 | S | 52.9 | Low | 65.3 | Low | 93 Ų | 93 | 96.5 Ų | 96.5 | 65% | 0.65 | 53% | 0.534 | S | S | * | . | trans | -35.7 | 136.9 | 175.1 | 178.4 | 0 | 0 | 0 | 0 | 109.4 | T635 K639 | T635-S637 PolarHBondContact O-N 2.79Å; S637-K639 PolarHBondContact O-N 3.07Å | ||
| 638 | C | 51.3 | Low | 67.1 | Low | 121 Ų | 121 | 96.1 Ų | 96.1 | 82% | 0.818 | 53% | 0.531 | S | S | * | . | trans | -41.2 | 115.1 | 173.7 | -58.2 | 0 | 0 | 0 | 0 | 108.6 | D640 | C638-D640 PolarHBondContact O-N 3.31Š| ||
| 639 | K | 55.4 | Low | 68.8 | Low | 162 Ų | 162 | 93.6 Ų | 93.6 | 70% | 0.704 | 51% | 0.511 | S | S | * | . | trans | -57.3 | 138.9 | 167.8 | -73.2 | -170.7 | 179.2 | -173.5 | 0 | 106.9 | S637 E641 | S637-K639 PolarHBondContact O-N 3.07Å; K639-E641 HydrophobicContact CB-CG 3.64Å; K639-E641 HydrophobicContact CD-CG 4.33Å; K639-E641 WeakPolarHBondContact CD-OE1 3.49Å; K639-E641 IonicContact NZ-OE1 3.51Å; K639-E641 PolarHBondContact NZ-OE1 2.83Å; K639-E641 PolarHBondContact O-N 3.28Å | ||
| 640 | D | 67.8 | Low | 70.5 | Confident | 110 Ų | 110 | 88.7 Ų | 88.7 | 59% | 0.588 | 49% | 0.491 | S | S | * | . | trans | -75.7 | 58.2 | 178.4 | -155.7 | 60.1 | 0 | 0 | 0 | 110.3 | C638 A642 N671 H675 | C638-D640 PolarHBondContact O-N 3.31Å; D640-A642 PolarHBondContact O-N 2.99Å; D640-N671 PolarHBondContact O-ND2 2.85Å; D640-N671 PolarHBondContact OD2-ND2 2.8Å; D640-H675 IonicContact OD1-CD2 3.87Å | ||
| 641 | E | 78.2 | Confident | 72.5 | Confident | 121 Ų | 121 | 91.2 Ų | 91.2 | 57% | 0.565 | 49% | 0.492 | S | S | * | . | trans | -77.6 | 109.7 | -179.5 | -60.3 | -74.5 | 177.2 | 0 | 0 | 107.9 | K639 F643 H675 | K639-E641 HydrophobicContact CB-CG 3.64Å; K639-E641 HydrophobicContact CD-CG 4.33Å; K639-E641 WeakPolarHBondContact CD-OE1 3.49Å; K639-E641 IonicContact NZ-OE1 3.51Å; K639-E641 PolarHBondContact NZ-OE1 2.83Å; K639-E641 PolarHBondContact O-N 3.28Å; E641-F643 PolarHBondContact O-N 3.25Å; E641-F643 VanDerWaalsContact O-N 3.08Å; E641-H675 PolarHBondContact O-NE2 3.37Å | ||
| 642 | A | 82.2 | Confident | 74.4 | Confident | 27 Ų | 27 | 91.8 Ų | 91.8 | 22% | 0.223 | 49% | 0.492 | C | S | . | . | trans | -60.6 | 115.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | D640 L644 I646 | D640-A642 PolarHBondContact O-N 2.99Å; A642-L644 PolarHBondContact O-N 3.24Å; A642-L644 VanDerWaalsContact O-N 3.16Å; A642-I646 HydrophobicContact CB-CD1 3.65Å; A642-I646 HydrophobicContact CB-CG1 3.39Å | ||
| 643 | F | 90.8 | Very high | 76.4 | Confident | 111 Ų | 111 | 92.8 Ų | 92.8 | 49% | 0.487 | 49% | 0.493 | S | S | . | . | S | Bend | trans | -51.4 | -30.9 | 171.3 | 178.1 | -97.6 | 0 | 0 | 0 | 113.9 | E641 S674 Q678 L681 | E641-F643 PolarHBondContact O-N 3.25Å; E641-F643 VanDerWaalsContact O-N 3.08Å; F643-S674 PolarHBondContact N-OG 3.04Å; F643-Q678 HydrophobicContact CB-CB 3.94Å; F643-Q678 HydrophobicContact CB-CG 4.25Å; F643-Q678 HydrophobicContact CD1-CB 4Å; F643-Q678 HydrophobicContact CD2-CB 4.26Å; F643-Q678 HydrophobicContact CD2-CG 3.94Å; F643-Q678 HydrophobicContact CE2-CG 4.47Å; F643-Q678 HydrophobicContact CG-CB 3.79Å; F643-Q678 HydrophobicContact CG-CG 3.99Å; F643-L681 HydrophobicContact CE1-CD1 3.5Å; F643-L681 HydrophobicContact CZ-CD1 3.78Å |
| 644 | L | 92.8 | Very high | 78.2 | Confident | 51 Ų | 51 | 89.6 Ų | 89.6 | 27% | 0.267 | 48% | 0.477 | S | S | . | . | S | Bend | trans | -102.5 | 152.1 | 174.8 | -58.5 | -176.9 | 0 | 0 | 0 | 112.1 | A642 I646 L649 S674 T677 | A642-L644 PolarHBondContact O-N 3.24Å; A642-L644 VanDerWaalsContact O-N 3.16Å; L644-I646 PolarHBondContact O-N 2.85Å; L644-L649 HydrophobicContact CB-CD2 4.33Å; L644-L649 HydrophobicContact CD1-CD2 4.01Å; L644-S674 PolarHBondContact N-OG 2.88Å; L644-T677 HydrophobicContact CD1-CG2 4.08Å; L644-T677 HydrophobicContact CD2-CG2 4.4Å |
| 645 | S | 92.5 | Very high | 80.5 | Confident | 75 Ų | 75 | 91.1 Ų | 91.1 | 52% | 0.524 | 48% | 0.477 | S | S | . | . | trans | -62 | 96.9 | 171.6 | 177.4 | 0 | 0 | 0 | 0 | 111.1 | S647 S648 L649 | S645-S647 VanDerWaalsContact C-N 3.34Å; S645-S647 PolarHBondContact O-N 2.93Å; S645-S648 WeakPolarHBondContact O-CB 3.45Å; S645-S648 PolarHBondContact O-N 3.2Å; S645-S648 PolarHBondContact OG-OG 2.89Å; S645-L649 PolarHBondContact O-N 3.43Å | ||
| 646 | I | 91.4 | Very high | 82.8 | Confident | 60 Ų | 60 | 91.1 Ų | 91.1 | 31% | 0.308 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -47.4 | -56.5 | -179.9 | -53.4 | 174.1 | 0 | 0 | 0 | 109.9 | A642 L644 S648 L649 T650 I670 N671 | A642-I646 HydrophobicContact CB-CD1 3.65Å; A642-I646 HydrophobicContact CB-CG1 3.39Å; L644-I646 PolarHBondContact O-N 2.85Å; I646-S648 PolarHBondContact O-N 3.43Å; I646-L649 CarbonylContact O-C 3.53Å; I646-L649 PolarHBondContact O-N 2.89Å; I646-T650 WeakPolarHBondContact O-CB 3.37Å; I646-T650 PolarHBondContact O-N 3.26Å; I646-T650 PolarHBondContact O-OG1 3.48Å; I646-I670 HydrophobicContact CG2-CG2 3.93Å; I646-N671 WeakPolarHBondContact CD1-OD1 2.81Å |
| 647 | S | 91.2 | Very high | 84.9 | Confident | 83 Ų | 83 | 81.9 Ų | 81.9 | 58% | 0.58 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -60.4 | -16.2 | -177 | -33 | 0 | 0 | 0 | 0 | 115 | S645 R651 | S645-S647 VanDerWaalsContact C-N 3.34Å; S645-S647 PolarHBondContact O-N 2.93Å; S647-R651 PolarHBondContact O-NE 3.11Å; S647-R651 PolarHBondContact O-NH2 3.32Å |
| 648 | S | 93.6 | Very high | 86.9 | Confident | 46 Ų | 46 | 83.8 Ų | 83.8 | 32% | 0.322 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -94.6 | -43.9 | 173.7 | -52.9 | 0 | 0 | 0 | 0 | 110.7 | S645 I646 R651 I652 | S645-S648 WeakPolarHBondContact O-CB 3.45Å; S645-S648 PolarHBondContact O-N 3.2Å; S645-S648 PolarHBondContact OG-OG 2.89Å; I646-S648 PolarHBondContact O-N 3.43Å; S648-R651 PolarHBondContact O-N 3.2Å; S648-I652 WeakPolarHBondContact O-CG1 3.43Å; S648-I652 PolarHBondContact O-N 3Å; S648-I652 VanDerWaalsContact O-N 3.07Å |
| 649 | L | 93.1 | Very high | 89 | Confident | 29 Ų | 29 | 86.5 Ų | 86.5 | 15% | 0.152 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -61.2 | -47.4 | 176.1 | -174.4 | 60.4 | 0 | 0 | 0 | 111.7 | L644 S645 I646 R651 I652 V653 I670 I673 | L644-L649 HydrophobicContact CB-CD2 4.33Å; L644-L649 HydrophobicContact CD1-CD2 4.01Å; S645-L649 PolarHBondContact O-N 3.43Å; I646-L649 CarbonylContact O-C 3.53Å; I646-L649 PolarHBondContact O-N 2.89Å; L649-R651 VanDerWaalsContact C-N 3.32Å; L649-R651 PolarHBondContact O-N 3.25Å; L649-I652 PolarHBondContact O-N 2.87Å; L649-V653 HydrophobicContact CD1-CG2 3.88Å; L649-V653 HydrophobicContact CG-CG2 4.23Å; L649-V653 WeakPolarHBondContact O-CB 3.17Å; L649-V653 VanDerWaalsContact O-CG2 3.28Å; L649-V653 WeakPolarHBondContact O-CG2 3.33Å; L649-V653 PolarHBondContact O-N 2.81Å; L649-I670 HydrophobicContact CB-CG2 4.14Å; L649-I670 HydrophobicContact CD2-CG2 3.69Å; L649-I670 HydrophobicContact CG-CG2 3.9Å; L649-I673 HydrophobicContact CD1-CG2 4.41Å; L649-I673 HydrophobicContact CD2-CB 4.41Å; L649-I673 HydrophobicContact CD2-CG2 4.01Å |
| 650 | T | 93.1 | Very high | 90.8 | Very high | 37 Ų | 37 | 86.6 Ų | 86.6 | 23% | 0.227 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -53.1 | -47.2 | 174 | -50.5 | 0 | 0 | 0 | 0 | 111.6 | I646 L654 I670 | I646-T650 WeakPolarHBondContact O-CB 3.37Å; I646-T650 PolarHBondContact O-N 3.26Å; I646-T650 PolarHBondContact O-OG1 3.48Å; T650-L654 HydrophobicContact CG2-CD1 3.79Å; T650-L654 HydrophobicContact CG2-CG 4.32Å; T650-L654 VanDerWaalsContact O-CB 3.3Å; T650-L654 WeakPolarHBondContact O-CB 3.36Å; T650-L654 VanDerWaalsContact O-CG 3.27Å; T650-L654 WeakPolarHBondContact O-CG 3.39Å; T650-L654 PolarHBondContact O-N 2.78Å; T650-I670 HydrophobicContact CG2-CD1 3.76Å; T650-I670 VanDerWaalsContact OG1-CD1 3.29Å; T650-I670 WeakPolarHBondContact OG1-CD1 3.35Å |
| 651 | R | 93.4 | Very high | 92.1 | Very high | 169 Ų | 169 | 84.3 Ų | 84.3 | 64% | 0.638 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -65.3 | -43.8 | -179.3 | -79.2 | -175.3 | -73 | 169.2 | -0.9 | 111.9 | S647 S648 L649 Q655 | S647-R651 PolarHBondContact O-NE 3.11Å; S647-R651 PolarHBondContact O-NH2 3.32Å; S648-R651 PolarHBondContact O-N 3.2Å; L649-R651 VanDerWaalsContact C-N 3.32Å; L649-R651 PolarHBondContact O-N 3.25Å; R651-Q655 WeakPolarHBondContact O-CB 3.21Å; R651-Q655 PolarHBondContact O-N 3.47Å |
| 652 | I | 93.6 | Very high | 92.7 | Very high | 93 Ų | 93 | 82 Ų | 82 | 48% | 0.477 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -65.8 | -47.4 | 177.9 | -66.7 | 165.8 | 0 | 0 | 0 | 110.9 | S648 L649 Q655 I656 | S648-I652 WeakPolarHBondContact O-CG1 3.43Å; S648-I652 PolarHBondContact O-N 3Å; S648-I652 VanDerWaalsContact O-N 3.07Å; L649-I652 PolarHBondContact O-N 2.87Å; I652-Q655 PolarHBondContact O-N 2.66Å; I652-I656 HydrophobicContact CG2-CD1 3.82Å; I652-I656 WeakPolarHBondContact O-CG1 3.47Å; I652-I656 PolarHBondContact O-N 3.44Å |
| 653 | V | 93.8 | Very high | 92.9 | Very high | 41 Ų | 41 | 84.9 Ų | 84.9 | 25% | 0.248 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -66.3 | -40.4 | -178 | 175.5 | 0 | 0 | 0 | 0 | 111.4 | L649 G657 L665 | L649-V653 HydrophobicContact CD1-CG2 3.88Å; L649-V653 HydrophobicContact CG-CG2 4.23Å; L649-V653 WeakPolarHBondContact O-CB 3.17Å; L649-V653 VanDerWaalsContact O-CG2 3.28Å; L649-V653 WeakPolarHBondContact O-CG2 3.33Å; L649-V653 PolarHBondContact O-N 2.81Å; V653-G657 WeakPolarHBondContact O-CA 3.49Å; V653-G657 PolarHBondContact O-N 3.38Å; V653-L665 HydrophobicContact CB-CD2 4.47Å; V653-L665 HydrophobicContact CG1-CD2 3.5Å |
| 654 | L | 93.7 | Very high | 92.8 | Very high | 39 Ų | 39 | 87.6 Ų | 87.6 | 20% | 0.204 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -71.2 | -34.9 | 173.5 | -67.2 | 177.9 | 0 | 0 | 0 | 112.8 | T650 I656 G657 K658 L665 | T650-L654 HydrophobicContact CG2-CD1 3.79Å; T650-L654 HydrophobicContact CG2-CG 4.32Å; T650-L654 VanDerWaalsContact O-CB 3.3Å; T650-L654 WeakPolarHBondContact O-CB 3.36Å; T650-L654 VanDerWaalsContact O-CG 3.27Å; T650-L654 WeakPolarHBondContact O-CG 3.39Å; T650-L654 PolarHBondContact O-N 2.78Å; L654-I656 VanDerWaalsContact C-N 3.34Å; L654-G657 PolarHBondContact O-N 3.32Å; L654-K658 WeakPolarHBondContact O-CB 3.26Å; L654-K658 VanDerWaalsContact O-CG 3.25Å; L654-K658 WeakPolarHBondContact O-CG 3.41Å; L654-K658 PolarHBondContact O-N 2.9Å; L654-L665 HydrophobicContact CD2-CB 3.95Å |
| 655 | Q | 94.4 | Very high | 92.5 | Very high | 145 Ų | 145 | 87.5 Ų | 87.5 | 68% | 0.678 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -64.7 | -38.7 | 175.6 | -179.3 | 178.8 | 0.7 | 0 | 0 | 111.8 | R651 I652 | R651-Q655 WeakPolarHBondContact O-CB 3.21Å; R651-Q655 PolarHBondContact O-N 3.47Å; I652-Q655 PolarHBondContact O-N 2.66Å |
| 656 | I | 94.5 | Very high | 92.3 | Very high | 95 Ų | 95 | 86 Ų | 86 | 49% | 0.487 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -72.4 | -50.2 | 173 | -65.3 | 168.2 | 0 | 0 | 0 | 109.7 | I652 L654 K658 K659 F660 | I652-I656 HydrophobicContact CG2-CD1 3.82Å; I652-I656 WeakPolarHBondContact O-CG1 3.47Å; I652-I656 PolarHBondContact O-N 3.44Å; L654-I656 VanDerWaalsContact C-N 3.34Å; I656-K658 VanDerWaalsContact C-N 3.31Å; I656-K658 PolarHBondContact O-N 2.93Å; I656-K659 VanDerWaalsContact O-CB 3.31Å; I656-K659 WeakPolarHBondContact O-CB 3.45Å; I656-K659 PolarHBondContact O-N 3.26Å; I656-F660 HydrophobicContact CG2-CD2 4.34Å; I656-F660 HydrophobicContact CG2-CE2 3.94Å; I656-F660 VanDerWaalsContact O-CD2 3.32Å; I656-F660 WeakPolarHBondContact O-CD2 3.31Å |
| 657 | G | 93.9 | Very high | 92.2 | Very high | 11 Ų | 11 | 87.6 Ų | 87.6 | 11% | 0.113 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -56.2 | -39.2 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | V653 L654 K659 F660 G661 V662 | V653-G657 WeakPolarHBondContact O-CA 3.49Å; V653-G657 PolarHBondContact O-N 3.38Å; L654-G657 PolarHBondContact O-N 3.32Å; G657-K659 PolarHBondContact O-N 3.38Å; G657-F660 CarbonylContact O-C 3.59Å; G657-F660 VanDerWaalsContact O-C 3.32Å; G657-F660 WeakPolarHBondContact O-CA 3.31Å; G657-F660 PolarHBondContact O-N 3.37Å; G657-G661 PolarHBondContact O-N 2.91Å; G657-G661 VanDerWaalsContact O-N 3.15Å; G657-V662 CarbonylContact C-O 3.32Å; G657-V662 PolarHBondContact O-N 2.94Å |
| 658 | K | 95.1 | Very high | 92.1 | Very high | 133 Ų | 133 | 89.7 Ų | 89.7 | 58% | 0.578 | 48% | 0.479 | S | S | * | . | G | 310 helix | trans | -59.9 | -27.3 | 176.1 | -79.2 | 176.6 | 178.4 | -172.9 | 0 | 113.5 | L654 I656 F660 G661 V662 | L654-K658 WeakPolarHBondContact O-CB 3.26Å; L654-K658 VanDerWaalsContact O-CG 3.25Å; L654-K658 WeakPolarHBondContact O-CG 3.41Å; L654-K658 PolarHBondContact O-N 2.9Å; I656-K658 VanDerWaalsContact C-N 3.31Å; I656-K658 PolarHBondContact O-N 2.93Å; K658-F660 PolarHBondContact O-N 2.94Å; K658-G661 PolarHBondContact O-N 3.21Å; K658-V662 WeakPolarHBondContact CA-O 3.49Å; K658-V662 PolarHBondContact N-O 3.44Å; K658-V662 VanDerWaalsContact N-O 3.11Å |
| 659 | K | 94.8 | Very high | 92 | Very high | 179 Ų | 179 | 90.9 Ų | 90.9 | 78% | 0.778 | 48% | 0.484 | S | S | * | . | G | 310 helix | trans | -70.4 | -14.6 | 172.5 | -59.2 | -168.2 | 70.1 | -173.5 | 0 | 113.6 | I656 G657 | I656-K659 VanDerWaalsContact O-CB 3.31Å; I656-K659 WeakPolarHBondContact O-CB 3.45Å; I656-K659 PolarHBondContact O-N 3.26Å; G657-K659 PolarHBondContact O-N 3.38Å |
| 660 | F | 94.1 | Very high | 92 | Very high | 164 Ų | 164 | 89.6 Ų | 89.6 | 72% | 0.719 | 48% | 0.477 | S | S | * | . | G | 310 helix | trans | -119.1 | 17.1 | 179.3 | -55.6 | -79.2 | 0 | 0 | 0 | 112 | I656 G657 K658 V662 | I656-F660 HydrophobicContact CG2-CD2 4.34Å; I656-F660 HydrophobicContact CG2-CE2 3.94Å; I656-F660 VanDerWaalsContact O-CD2 3.32Å; I656-F660 WeakPolarHBondContact O-CD2 3.31Å; G657-F660 CarbonylContact O-C 3.59Å; G657-F660 VanDerWaalsContact O-C 3.32Å; G657-F660 WeakPolarHBondContact O-CA 3.31Å; G657-F660 PolarHBondContact O-N 3.37Å; K658-F660 PolarHBondContact O-N 2.94Å; F660-V662 VanDerWaalsContact C-N 3.34Å; F660-V662 PolarHBondContact O-N 3.13Å |
| 661 | G | 93.5 | Very high | 92 | Very high | 62 Ų | 62 | 88.9 Ų | 88.9 | 64% | 0.639 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 83 | -6.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | G657 K658 S663 | G657-G661 PolarHBondContact O-N 2.91Å; G657-G661 VanDerWaalsContact O-N 3.15Å; K658-G661 PolarHBondContact O-N 3.21Å; G661-S663 PolarHBondContact O-N 3.41Å |
| 662 | V | 91.1 | Very high | 91.9 | Very high | 72 Ų | 72 | 89.2 Ų | 89.2 | 44% | 0.436 | 48% | 0.475 | S | S | . | . | trans | -78.3 | 104.9 | 178.9 | -176.2 | 0 | 0 | 0 | 0 | 109.9 | G657 K658 F660 E664 | G657-V662 CarbonylContact C-O 3.32Å; G657-V662 PolarHBondContact O-N 2.94Å; K658-V662 WeakPolarHBondContact CA-O 3.49Å; K658-V662 PolarHBondContact N-O 3.44Å; K658-V662 VanDerWaalsContact N-O 3.11Å; F660-V662 VanDerWaalsContact C-N 3.34Å; F660-V662 PolarHBondContact O-N 3.13Å; V662-E664 WeakPolarHBondContact CG1-O 3.4Å | ||
| 663 | S | 86.7 | Confident | 91.9 | Very high | 87 Ų | 87 | 87.7 Ų | 87.7 | 61% | 0.608 | 47% | 0.466 | S | S | * | . | trans | -93.4 | -23.6 | -173.7 | -65.1 | 0 | 0 | 0 | 0 | 114.6 | G661 | G661-S663 PolarHBondContact O-N 3.41Š| ||
| 664 | E | 88.6 | Confident | 91.9 | Very high | 169 Ų | 169 | 85.8 Ų | 85.8 | 79% | 0.79 | 46% | 0.455 | S | S | * | . | trans | -141.5 | 155.6 | -176.1 | -176.6 | 168.7 | -167.8 | 0 | 0 | 110.1 | V662 | V662-E664 WeakPolarHBondContact CG1-O 3.4Š| ||
| 665 | L | 87.1 | Confident | 91.9 | Very high | 49 Ų | 49 | 86.2 Ų | 86.2 | 26% | 0.257 | 46% | 0.456 | S | S | . | . | trans | -151.9 | 128.2 | 177 | -177.1 | 63.5 | 0 | 0 | 0 | 109.9 | V653 L654 V669 I670 | V653-L665 HydrophobicContact CB-CD2 4.47Å; V653-L665 HydrophobicContact CG1-CD2 3.5Å; L654-L665 HydrophobicContact CD2-CB 3.95Å; L665-V669 HydrophobicContact CD1-CB 3.92Å; L665-V669 HydrophobicContact CD1-CG1 3.97Å; L665-V669 HydrophobicContact CD1-CG2 4.13Å; L665-V669 HydrophobicContact CG-CB 4.28Å; L665-I670 HydrophobicContact CD2-CD1 4.09Å; L665-I670 HydrophobicContact CD2-CG1 3.71Å; L665-I670 HydrophobicContact CG-CD1 4.26Å; L665-I670 HydrophobicContact CG-CG1 4.05Å | ||
| 666 | G | 88.8 | Confident | 91.9 | Very high | 44 Ų | 44 | 81.6 Ų | 81.6 | 45% | 0.454 | 44% | 0.443 | S | S | . | . | trans | -63.7 | 144.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113 | D668 V669 | G666-D668 PolarHBondContact O-N 2.97Å; G666-V669 PolarHBondContact O-N 2.84Å | ||
| 667 | T | 88.2 | Confident | 91.9 | Very high | 93 Ų | 93 | 79.5 Ų | 79.5 | 57% | 0.571 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -50.6 | -39.8 | 179.7 | 36.9 | 0 | 0 | 0 | 0 | 113.2 | V669 I670 N671 | T667-V669 VanDerWaalsContact C-N 3.29Å; T667-V669 PolarHBondContact O-N 3.06Å; T667-I670 CarbonylContact O-C 3.47Å; T667-I670 WeakPolarHBondContact O-CA 3.24Å; T667-I670 VanDerWaalsContact O-CB 3.32Å; T667-I670 WeakPolarHBondContact O-CB 3.21Å; T667-I670 PolarHBondContact O-N 3.34Å; T667-N671 PolarHBondContact O-N 2.7Å |
| 668 | D | 90.1 | Very high | 91.9 | Very high | 127 Ų | 127 | 81.9 Ų | 81.9 | 68% | 0.679 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -69.3 | -32.6 | -169.7 | -41.7 | -13 | 0 | 0 | 0 | 110.8 | G666 I670 Y672 | G666-D668 PolarHBondContact O-N 2.97Å; D668-I670 VanDerWaalsContact C-N 3.28Å; D668-I670 PolarHBondContact O-N 3.38Å; D668-Y672 WeakPolarHBondContact O-CB 3.24Å; D668-Y672 PolarHBondContact O-N 2.81Å |
| 669 | V | 91.6 | Very high | 91.8 | Very high | 70 Ų | 70 | 80.6 Ų | 80.6 | 42% | 0.424 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -68.4 | -31.4 | 172.5 | -170.1 | 0 | 0 | 0 | 0 | 110.8 | L665 G666 T667 Y672 I673 | L665-V669 HydrophobicContact CD1-CB 3.92Å; L665-V669 HydrophobicContact CD1-CG1 3.97Å; L665-V669 HydrophobicContact CD1-CG2 4.13Å; L665-V669 HydrophobicContact CG-CB 4.28Å; G666-V669 PolarHBondContact O-N 2.84Å; T667-V669 VanDerWaalsContact C-N 3.29Å; T667-V669 PolarHBondContact O-N 3.06Å; V669-Y672 PolarHBondContact O-N 3.45Å; V669-I673 HydrophobicContact CG1-CD1 4.16Å; V669-I673 WeakPolarHBondContact O-CD1 3.01Å; V669-I673 WeakPolarHBondContact O-CG1 3.43Å; V669-I673 PolarHBondContact O-N 3.4Å |
| 670 | I | 92 | Very high | 91.7 | Very high | 2 Ų | 2 | 77.8 Ų | 77.8 | 1% | 0.01 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -77 | -38.9 | -179.7 | -54.5 | 177.8 | 0 | 0 | 0 | 110.2 | I646 L649 T650 L665 T667 D668 S674 | I646-I670 HydrophobicContact CG2-CG2 3.93Å; L649-I670 HydrophobicContact CB-CG2 4.14Å; L649-I670 HydrophobicContact CD2-CG2 3.69Å; L649-I670 HydrophobicContact CG-CG2 3.9Å; T650-I670 HydrophobicContact CG2-CD1 3.76Å; T650-I670 VanDerWaalsContact OG1-CD1 3.29Å; T650-I670 WeakPolarHBondContact OG1-CD1 3.35Å; L665-I670 HydrophobicContact CD2-CD1 4.09Å; L665-I670 HydrophobicContact CD2-CG1 3.71Å; L665-I670 HydrophobicContact CG-CD1 4.26Å; L665-I670 HydrophobicContact CG-CG1 4.05Å; T667-I670 CarbonylContact O-C 3.47Å; T667-I670 WeakPolarHBondContact O-CA 3.24Å; T667-I670 VanDerWaalsContact O-CB 3.32Å; T667-I670 WeakPolarHBondContact O-CB 3.21Å; T667-I670 PolarHBondContact O-N 3.34Å; D668-I670 VanDerWaalsContact C-N 3.28Å; D668-I670 PolarHBondContact O-N 3.38Å; I670-S674 WeakPolarHBondContact O-CB 3.36Å; I670-S674 PolarHBondContact O-N 3.38Å |
| 671 | N | 92.2 | Very high | 91.7 | Very high | 23 Ų | 23 | 73.9 Ų | 73.9 | 12% | 0.123 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -60 | -46.8 | 165.1 | -85.8 | 25.3 | 0 | 0 | 0 | 110.8 | D640 I646 T667 I673 S674 H675 | D640-N671 PolarHBondContact O-ND2 2.85Å; D640-N671 PolarHBondContact OD2-ND2 2.8Å; I646-N671 WeakPolarHBondContact CD1-OD1 2.81Å; T667-N671 PolarHBondContact O-N 2.7Å; N671-I673 PolarHBondContact O-N 2.96Å; N671-S674 CarbonylContact O-C 3.52Å; N671-S674 WeakPolarHBondContact O-CA 3.35Å; N671-S674 VanDerWaalsContact O-CB 3.25Å; N671-S674 WeakPolarHBondContact O-CB 3.31Å; N671-S674 PolarHBondContact O-N 2.91Å; N671-H675 PolarHBondContact O-CD2 3.41Å; N671-H675 PolarHBondContact O-N 3.02Å |
| 672 | Y | 93.1 | Very high | 91.7 | Very high | 176 Ų | 176 | 75.6 Ų | 75.6 | 69% | 0.69 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -60.8 | -42.4 | 179.1 | -167.8 | -95.2 | 0 | 0 | 0 | 113 | D668 V669 S674 H675 A676 | D668-Y672 WeakPolarHBondContact O-CB 3.24Å; D668-Y672 PolarHBondContact O-N 2.81Å; V669-Y672 PolarHBondContact O-N 3.45Å; Y672-S674 VanDerWaalsContact C-N 3.3Å; Y672-S674 PolarHBondContact O-N 2.98Å; Y672-H675 PolarHBondContact O-N 3.29Å; Y672-A676 VanDerWaalsContact O-CB 3.3Å; Y672-A676 WeakPolarHBondContact O-CB 3.34Å; Y672-A676 PolarHBondContact O-N 3.22Å |
| 673 | I | 93.6 | Very high | 91.8 | Very high | 60 Ų | 60 | 76.4 Ų | 76.4 | 31% | 0.308 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -61.6 | -39.7 | 172.9 | -69.6 | 161.5 | 0 | 0 | 0 | 111 | L649 V669 N671 T677 | L649-I673 HydrophobicContact CD1-CG2 4.41Å; L649-I673 HydrophobicContact CD2-CB 4.41Å; L649-I673 HydrophobicContact CD2-CG2 4.01Å; V669-I673 HydrophobicContact CG1-CD1 4.16Å; V669-I673 WeakPolarHBondContact O-CD1 3.01Å; V669-I673 WeakPolarHBondContact O-CG1 3.43Å; V669-I673 PolarHBondContact O-N 3.4Å; N671-I673 PolarHBondContact O-N 2.96Å; I673-T677 WeakPolarHBondContact O-CB 3.43Å; I673-T677 PolarHBondContact O-N 3.33Å; I673-T677 PolarHBondContact O-OG1 2.8Å |
| 674 | S | 93.8 | Very high | 92.1 | Very high | 1 Ų | 1 | 74 Ų | 74 | 1% | 0.007 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -62.3 | -47.2 | 175 | 165.6 | 0 | 0 | 0 | 0 | 112 | F643 L644 I670 N671 Y672 T677 Q678 | F643-S674 PolarHBondContact N-OG 3.04Å; L644-S674 PolarHBondContact N-OG 2.88Å; I670-S674 WeakPolarHBondContact O-CB 3.36Å; I670-S674 PolarHBondContact O-N 3.38Å; N671-S674 CarbonylContact O-C 3.52Å; N671-S674 WeakPolarHBondContact O-CA 3.35Å; N671-S674 VanDerWaalsContact O-CB 3.25Å; N671-S674 WeakPolarHBondContact O-CB 3.31Å; N671-S674 PolarHBondContact O-N 2.91Å; Y672-S674 VanDerWaalsContact C-N 3.3Å; Y672-S674 PolarHBondContact O-N 2.98Å; S674-T677 WeakPolarHBondContact O-CB 3.01Å; S674-T677 PolarHBondContact O-N 2.71Å; S674-Q678 PolarHBondContact O-N 3.07Å |
| 675 | H | 93.1 | Very high | 92.3 | Very high | 49 Ų | 49 | 71.4 Ų | 71.4 | 23% | 0.227 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -70.8 | -36.4 | 177.8 | -65.2 | -57.5 | 0 | 0 | 0 | 113 | D640 E641 N671 Y672 T677 Q678 Q679 | D640-H675 IonicContact OD1-CD2 3.87Å; E641-H675 PolarHBondContact O-NE2 3.37Å; N671-H675 PolarHBondContact O-CD2 3.41Å; N671-H675 PolarHBondContact O-N 3.02Å; Y672-H675 PolarHBondContact O-N 3.29Å; H675-T677 VanDerWaalsContact C-N 3.27Å; H675-T677 PolarHBondContact O-N 3.4Å; H675-Q678 VanDerWaalsContact CE1-CD 3.4Å; H675-Q678 PolarHBondContact CE1-OE1 2.99Å; H675-Q678 PolarHBondContact ND1-OE1 2.94Å; H675-Q678 WeakPolarHBondContact O-CB 3.3Å; H675-Q678 PolarHBondContact O-N 2.96Å; H675-Q679 WeakPolarHBondContact O-CB 3.27Å; H675-Q679 WeakPolarHBondContact O-CG 3.44Å; H675-Q679 PolarHBondContact O-N 3.35Å |
| 676 | A | 94.4 | Very high | 92.6 | Very high | 48 Ų | 48 | 75 Ų | 75 | 40% | 0.397 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -61.3 | -37.3 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y672 Q679 R680 | Y672-A676 VanDerWaalsContact O-CB 3.3Å; Y672-A676 WeakPolarHBondContact O-CB 3.34Å; Y672-A676 PolarHBondContact O-N 3.22Å; A676-Q679 PolarHBondContact O-N 2.92Å; A676-R680 PolarHBondContact O-N 2.89Å |
| 677 | T | 94.1 | Very high | 92.8 | Very high | 51 Ų | 51 | 75.9 Ų | 75.9 | 31% | 0.313 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -66.7 | -44.6 | 173.4 | -55.3 | 0 | 0 | 0 | 0 | 111.5 | L644 I673 S674 H675 Q679 R680 L681 | L644-T677 HydrophobicContact CD1-CG2 4.08Å; L644-T677 HydrophobicContact CD2-CG2 4.4Å; I673-T677 WeakPolarHBondContact O-CB 3.43Å; I673-T677 PolarHBondContact O-N 3.33Å; I673-T677 PolarHBondContact O-OG1 2.8Å; S674-T677 WeakPolarHBondContact O-CB 3.01Å; S674-T677 PolarHBondContact O-N 2.71Å; H675-T677 VanDerWaalsContact C-N 3.27Å; H675-T677 PolarHBondContact O-N 3.4Å; T677-Q679 VanDerWaalsContact C-N 3.34Å; T677-Q679 PolarHBondContact O-N 3.44Å; T677-R680 PolarHBondContact O-N 3.13Å; T677-L681 HydrophobicContact CG2-CD1 4.16Å; T677-L681 WeakPolarHBondContact O-CG 3.36Å; T677-L681 PolarHBondContact O-N 3.19Å |
| 678 | Q | 94.2 | Very high | 93.1 | Very high | 61 Ų | 61 | 71.5 Ų | 71.5 | 29% | 0.285 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -57.3 | -45.8 | 173.7 | -176.3 | -172.6 | -12.2 | 0 | 0 | 111.5 | F643 S674 H675 L681 Q682 | F643-Q678 HydrophobicContact CB-CB 3.94Å; F643-Q678 HydrophobicContact CB-CG 4.25Å; F643-Q678 HydrophobicContact CD1-CB 4Å; F643-Q678 HydrophobicContact CD2-CB 4.26Å; F643-Q678 HydrophobicContact CD2-CG 3.94Å; F643-Q678 HydrophobicContact CE2-CG 4.47Å; F643-Q678 HydrophobicContact CG-CB 3.79Å; F643-Q678 HydrophobicContact CG-CG 3.99Å; S674-Q678 PolarHBondContact O-N 3.07Å; H675-Q678 VanDerWaalsContact CE1-CD 3.4Å; H675-Q678 PolarHBondContact CE1-OE1 2.99Å; H675-Q678 PolarHBondContact ND1-OE1 2.94Å; H675-Q678 WeakPolarHBondContact O-CB 3.3Å; H675-Q678 PolarHBondContact O-N 2.96Å; Q678-L681 PolarHBondContact O-N 3.36Å; Q678-Q682 WeakPolarHBondContact O-CB 3.32Å; Q678-Q682 PolarHBondContact O-N 3.28Å |
| 679 | Q | 93.9 | Very high | 93.2 | Very high | 105 Ų | 105 | 67.2 Ų | 67.2 | 49% | 0.491 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -64.8 | -40.9 | 178.3 | -73.6 | -56.8 | -54.7 | 0 | 0 | 112.5 | H675 A676 T677 L681 Q682 N683 | H675-Q679 WeakPolarHBondContact O-CB 3.27Å; H675-Q679 WeakPolarHBondContact O-CG 3.44Å; H675-Q679 PolarHBondContact O-N 3.35Å; A676-Q679 PolarHBondContact O-N 2.92Å; T677-Q679 VanDerWaalsContact C-N 3.34Å; T677-Q679 PolarHBondContact O-N 3.44Å; Q679-L681 VanDerWaalsContact C-N 3.35Å; Q679-L681 PolarHBondContact O-N 2.82Å; Q679-Q682 PolarHBondContact O-N 3.39Å; Q679-N683 WeakPolarHBondContact O-CB 3.41Å; Q679-N683 PolarHBondContact O-N 2.87Å |
| 680 | R | 92.4 | Very high | 93.2 | Very high | 120 Ų | 120 | 69.3 Ų | 69.3 | 45% | 0.453 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -65.7 | -37 | 174.2 | -172.9 | 169.3 | 176.3 | -153.6 | -3.9 | 112.2 | A676 T677 L684 D841 D843 | A676-R680 PolarHBondContact O-N 2.89Å; T677-R680 PolarHBondContact O-N 3.13Å; R680-L684 WeakPolarHBondContact O-CB 3.4Å; R680-L684 PolarHBondContact O-N 3.32Å; R680-D841 IonicContact CZ-OD2 3.72Å; R680-D841 IonicContact NE-OD2 3.93Å; R680-D841 IonicContact NH2-OD1 3.98Å; R680-D841 IonicContact NH2-OD2 2.71Å; R680-D841 PolarHBondContact NH2-OD2 3.41Å; R680-D843 VanDerWaalsContact NH2-C 3.33Å; R680-D843 VanDerWaalsContact NH2-CB 3.29Å; R680-D843 PolarHBondContact NH2-O 3.27Å |
| 681 | L | 93 | Very high | 93.2 | Very high | 82 Ų | 82 | 70.8 Ų | 70.8 | 43% | 0.429 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -68.7 | -36.3 | 174.2 | -70.2 | 170.7 | 0 | 0 | 0 | 112.5 | F643 T677 Q678 Q679 L684 L685 | F643-L681 HydrophobicContact CE1-CD1 3.5Å; F643-L681 HydrophobicContact CZ-CD1 3.78Å; T677-L681 HydrophobicContact CG2-CD1 4.16Å; T677-L681 WeakPolarHBondContact O-CG 3.36Å; T677-L681 PolarHBondContact O-N 3.19Å; Q678-L681 PolarHBondContact O-N 3.36Å; Q679-L681 VanDerWaalsContact C-N 3.35Å; Q679-L681 PolarHBondContact O-N 2.82Å; L681-L684 PolarHBondContact O-N 3.15Å; L681-L685 WeakPolarHBondContact O-CB 3.5Å; L681-L685 PolarHBondContact O-N 3.15Å |
| 682 | Q | 93.8 | Very high | 93.2 | Very high | 99 Ų | 99 | 69.7 Ų | 69.7 | 46% | 0.463 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -63 | -48.9 | 173.9 | -178.6 | 173.5 | -10 | 0 | 0 | 111 | Q678 Q679 L684 L685 E686 | Q678-Q682 WeakPolarHBondContact O-CB 3.32Å; Q678-Q682 PolarHBondContact O-N 3.28Å; Q679-Q682 PolarHBondContact O-N 3.39Å; Q682-L684 PolarHBondContact O-N 3.21Å; Q682-L685 PolarHBondContact O-N 3.05Å; Q682-E686 WeakPolarHBondContact O-CB 3.33Å; Q682-E686 PolarHBondContact O-N 3.33Å |
| 683 | N | 93.9 | Very high | 92.9 | Very high | 89 Ų | 89 | 66.6 Ų | 66.6 | 48% | 0.476 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60.6 | -44.4 | 175.6 | -173.7 | -10.1 | 0 | 0 | 0 | 111.6 | Q679 L685 E686 N687 | Q679-N683 WeakPolarHBondContact O-CB 3.41Å; Q679-N683 PolarHBondContact O-N 2.87Å; N683-L685 VanDerWaalsContact C-N 3.32Å; N683-L685 PolarHBondContact O-N 3.25Å; N683-E686 PolarHBondContact O-N 3.18Å; N683-N687 PolarHBondContact O-N 3.26Å; N683-N687 PolarHBondContact O-ND2 3.46Å; N683-N687 PolarHBondContact OD1-ND2 3.45Å |
| 684 | L | 92.3 | Very high | 92.4 | Very high | 37 Ų | 37 | 67.9 Ų | 67.9 | 19% | 0.194 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -61.1 | -39.2 | 175.5 | -177.4 | 62.4 | 0 | 0 | 0 | 112.5 | R680 L681 Q682 A688 L834 C837 L838 | R680-L684 WeakPolarHBondContact O-CB 3.4Å; R680-L684 PolarHBondContact O-N 3.32Å; L681-L684 PolarHBondContact O-N 3.15Å; Q682-L684 PolarHBondContact O-N 3.21Å; L684-A688 WeakPolarHBondContact O-CB 3.3Å; L684-A688 PolarHBondContact O-N 3Å; L684-L834 HydrophobicContact CD1-CD1 4.11Å; L684-L834 HydrophobicContact CD2-CD1 3.98Å; L684-L834 HydrophobicContact CG-CD1 3.89Å; L684-C837 HydrophobicContact CD1-CB 3.8Å; L684-L838 HydrophobicContact CD1-CD2 4.13Å; L684-L838 HydrophobicContact CD2-CD2 3.99Å |
| 685 | L | 92.8 | Very high | 91.9 | Very high | 113 Ų | 113 | 73.3 Ų | 73.3 | 59% | 0.592 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -70.3 | -37.4 | 175.7 | -178.9 | 61.1 | 0 | 0 | 0 | 112.3 | L681 Q682 N683 A688 S689 | L681-L685 WeakPolarHBondContact O-CB 3.5Å; L681-L685 PolarHBondContact O-N 3.15Å; Q682-L685 PolarHBondContact O-N 3.05Å; N683-L685 VanDerWaalsContact C-N 3.32Å; N683-L685 PolarHBondContact O-N 3.25Å; L685-A688 PolarHBondContact O-N 2.8Å; L685-S689 WeakPolarHBondContact O-CB 3.24Å; L685-S689 PolarHBondContact O-N 3.08Å |
| 686 | E | 93.2 | Very high | 91 | Very high | 124 Ų | 124 | 75 Ų | 75 | 58% | 0.579 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -61.8 | -50.7 | 175.7 | -177.3 | 167.2 | -161.3 | 0 | 0 | 110.9 | Q682 N683 A688 S689 Q690 | Q682-E686 WeakPolarHBondContact O-CB 3.33Å; Q682-E686 PolarHBondContact O-N 3.33Å; N683-E686 PolarHBondContact O-N 3.18Å; E686-A688 PolarHBondContact O-N 3.16Å; E686-S689 CarbonylContact O-C 3.59Å; E686-S689 WeakPolarHBondContact O-CA 3.41Å; E686-S689 WeakPolarHBondContact O-CB 3.29Å; E686-S689 PolarHBondContact O-N 3.32Å; E686-S689 VanDerWaalsContact O-N 3.09Å; E686-S689 PolarHBondContact O-OG 3.01Å; E686-Q690 PolarHBondContact O-N 3.43Å |
| 687 | N | 93.6 | Very high | 90.2 | Very high | 63 Ų | 63 | 77.1 Ų | 77.1 | 34% | 0.337 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -58 | -45.6 | 173.7 | -70.1 | -61.8 | 0 | 0 | 0 | 112 | N683 S689 Q690 V691 C837 | N683-N687 PolarHBondContact O-N 3.26Å; N683-N687 PolarHBondContact O-ND2 3.46Å; N683-N687 PolarHBondContact OD1-ND2 3.45Å; N687-S689 VanDerWaalsContact C-N 3.25Å; N687-S689 PolarHBondContact O-N 3.44Å; N687-Q690 PolarHBondContact O-N 3.12Å; N687-Q690 VanDerWaalsContact O-N 3.1Å; N687-V691 WeakPolarHBondContact O-CG2 3.37Å; N687-V691 PolarHBondContact O-N 2.97Å; N687-C837 VanDerWaalsContact C-SG 3.56Å; N687-C837 HydrophobicContact CB-CB 4.49Å |
| 688 | A | 93.8 | Very high | 89.2 | Confident | 2 Ų | 2 | 78.6 Ų | 78.6 | 2% | 0.017 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -63.9 | -31.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L684 L685 E686 A692 V829 C837 | L684-A688 WeakPolarHBondContact O-CB 3.3Å; L684-A688 PolarHBondContact O-N 3Å; L685-A688 PolarHBondContact O-N 2.8Å; E686-A688 PolarHBondContact O-N 3.16Å; A688-A692 VanDerWaalsContact O-CB 3.3Å; A688-A692 WeakPolarHBondContact O-CB 3.39Å; A688-A692 PolarHBondContact O-N 2.93Å; A688-V829 HydrophobicContact CB-CG1 3.92Å; A688-C837 WeakPolarHBondContact CA-SG 3.48Å; A688-C837 PolarHBondContact N-SG 3.35Å; A688-C837 VanDerWaalsContact N-SG 3.4Å |
| 689 | S | 92.3 | Very high | 88 | Confident | 37 Ų | 37 | 81.1 Ų | 81.1 | 26% | 0.259 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -70.3 | -39.1 | 172.2 | 89.4 | 0 | 0 | 0 | 0 | 111.9 | L685 E686 N687 A692 Q693 | L685-S689 WeakPolarHBondContact O-CB 3.24Å; L685-S689 PolarHBondContact O-N 3.08Å; E686-S689 CarbonylContact O-C 3.59Å; E686-S689 WeakPolarHBondContact O-CA 3.41Å; E686-S689 WeakPolarHBondContact O-CB 3.29Å; E686-S689 PolarHBondContact O-N 3.32Å; E686-S689 VanDerWaalsContact O-N 3.09Å; E686-S689 PolarHBondContact O-OG 3.01Å; N687-S689 VanDerWaalsContact C-N 3.25Å; N687-S689 PolarHBondContact O-N 3.44Å; S689-A692 PolarHBondContact O-N 2.87Å; S689-Q693 WeakPolarHBondContact O-CB 3.38Å; S689-Q693 VanDerWaalsContact O-CG 3.26Å; S689-Q693 WeakPolarHBondContact O-CG 3.44Å; S689-Q693 PolarHBondContact O-N 3.44Å |
| 690 | Q | 91.6 | Very high | 86.8 | Confident | 114 Ų | 114 | 85.1 Ų | 85.1 | 53% | 0.533 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -67.5 | -44.6 | 177.8 | -167.6 | -176.9 | 62.5 | 0 | 0 | 111 | E686 N687 A692 Q693 L694 | E686-Q690 PolarHBondContact O-N 3.43Å; N687-Q690 PolarHBondContact O-N 3.12Å; N687-Q690 VanDerWaalsContact O-N 3.1Å; Q690-A692 VanDerWaalsContact C-N 3.33Å; Q690-A692 PolarHBondContact O-N 3.22Å; Q690-Q693 PolarHBondContact O-N 3.41Å; Q690-L694 HydrophobicContact CG-CD1 4.27Å; Q690-L694 WeakPolarHBondContact O-CB 3.07Å; Q690-L694 WeakPolarHBondContact O-CG 3.1Å; Q690-L694 PolarHBondContact O-N 3.4Å |
| 691 | V | 92.4 | Very high | 85.4 | Confident | 32 Ų | 32 | 86.9 Ų | 86.9 | 19% | 0.194 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -57.3 | -45.2 | 171.3 | 168.9 | 0 | 0 | 0 | 0 | 111.2 | N687 Q693 L694 K695 D833 L836 | N687-V691 WeakPolarHBondContact O-CG2 3.37Å; N687-V691 PolarHBondContact O-N 2.97Å; V691-Q693 VanDerWaalsContact C-N 3.33Å; V691-Q693 PolarHBondContact O-N 2.83Å; V691-L694 PolarHBondContact O-N 2.93Å; V691-K695 WeakPolarHBondContact O-CB 3.48Å; V691-K695 PolarHBondContact O-N 3.43Å; V691-K695 VanDerWaalsContact O-N 3.07Å; V691-D833 HydrophobicContact CG1-CB 3.92Å; V691-L836 HydrophobicContact CG1-CD2 3.93Å; V691-L836 HydrophobicContact CG2-CD2 4.37Å |
| 692 | A | 91.1 | Very high | 84.3 | Confident | 0 Ų | 0 | 84.6 Ų | 84.6 | 0% | 0 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -66.2 | -33.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | A688 S689 Q690 N696 T827 V829 | A688-A692 VanDerWaalsContact O-CB 3.3Å; A688-A692 WeakPolarHBondContact O-CB 3.39Å; A688-A692 PolarHBondContact O-N 2.93Å; S689-A692 PolarHBondContact O-N 2.87Å; Q690-A692 VanDerWaalsContact C-N 3.33Å; Q690-A692 PolarHBondContact O-N 3.22Å; A692-N696 PolarHBondContact O-ND2 2.68Å; A692-T827 HydrophobicContact CB-CG2 3.72Å; A692-V829 HydrophobicContact CB-CB 4.46Å; A692-V829 HydrophobicContact CB-CG2 3.94Å |
| 693 | Q | 87.3 | Confident | 83.3 | Confident | 111 Ų | 111 | 89.6 Ų | 89.6 | 52% | 0.519 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -69.6 | -50.1 | 173.1 | -74 | 173 | 51.5 | 0 | 0 | 111.7 | S689 Q690 V691 K695 N696 F697 T827 | S689-Q693 WeakPolarHBondContact O-CB 3.38Å; S689-Q693 VanDerWaalsContact O-CG 3.26Å; S689-Q693 WeakPolarHBondContact O-CG 3.44Å; S689-Q693 PolarHBondContact O-N 3.44Å; Q690-Q693 PolarHBondContact O-N 3.41Å; V691-Q693 VanDerWaalsContact C-N 3.33Å; V691-Q693 PolarHBondContact O-N 2.83Å; Q693-K695 VanDerWaalsContact C-N 3.28Å; Q693-K695 PolarHBondContact O-N 2.86Å; Q693-N696 CarbonylContact O-C 3.55Å; Q693-N696 WeakPolarHBondContact O-CA 3.27Å; Q693-N696 PolarHBondContact O-N 3.41Å; Q693-F697 PolarHBondContact O-N 3.12Å; Q693-T827 HydrophobicContact CG-CG2 4.18Å |
| 694 | L | 84.4 | Confident | 82.5 | Confident | 88 Ų | 88 | 95.4 Ų | 95.4 | 46% | 0.461 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -55.9 | -41.2 | 178.7 | -73.5 | 168.4 | 0 | 0 | 0 | 112.1 | Q690 V691 N696 F697 F699 | Q690-L694 HydrophobicContact CG-CD1 4.27Å; Q690-L694 WeakPolarHBondContact O-CB 3.07Å; Q690-L694 WeakPolarHBondContact O-CG 3.1Å; Q690-L694 PolarHBondContact O-N 3.4Å; V691-L694 PolarHBondContact O-N 2.93Å; L694-N696 PolarHBondContact O-N 2.72Å; L694-F697 WeakPolarHBondContact O-CB 3.46Å; L694-F697 PolarHBondContact O-N 3.01Å; L694-F697 VanDerWaalsContact O-N 3.11Å; L694-F699 HydrophobicContact CD2-CZ 4.44Å; L694-F699 WeakPolarHBondContact O-CE2 3.32Å |
| 695 | K | 81.6 | Confident | 81.4 | Confident | 114 Ų | 114 | 96 Ų | 96 | 50% | 0.496 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.2 | -24.2 | 174.2 | -178.2 | 177.3 | 62.3 | -174 | 0 | 114.1 | V691 Q693 N830 D833 | V691-K695 WeakPolarHBondContact O-CB 3.48Å; V691-K695 PolarHBondContact O-N 3.43Å; V691-K695 VanDerWaalsContact O-N 3.07Å; Q693-K695 VanDerWaalsContact C-N 3.28Å; Q693-K695 PolarHBondContact O-N 2.86Å; K695-N830 PolarHBondContact NZ-ND2 3.25Å; K695-D833 IonicContact NZ-OD1 2.92Å; K695-D833 PolarHBondContact NZ-OD1 2.91Å; K695-D833 IonicContact NZ-OD2 2.85Å; K695-D833 PolarHBondContact NZ-OD2 2.85Å |
| 696 | N | 74.8 | Confident | 80.8 | Confident | 86 Ų | 86 | 99 Ų | 99 | 46% | 0.46 | 47% | 0.469 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.5 | -0.6 | 176.7 | -74.4 | -85.8 | 0 | 0 | 0 | 113 | A692 Q693 L694 | A692-N696 PolarHBondContact O-ND2 2.68Å; Q693-N696 CarbonylContact O-C 3.55Å; Q693-N696 WeakPolarHBondContact O-CA 3.27Å; Q693-N696 PolarHBondContact O-N 3.41Å; L694-N696 PolarHBondContact O-N 2.72Å |
| 697 | F | 77.1 | Confident | 80 | Confident | 92 Ų | 92 | 98.9 Ų | 98.9 | 40% | 0.404 | 47% | 0.468 | S | S | . | . | trans | -76.4 | 133.1 | -176.6 | -166.6 | -92 | 0 | 0 | 0 | 111 | Q693 L694 F699 D702 | Q693-F697 PolarHBondContact O-N 3.12Å; L694-F697 WeakPolarHBondContact O-CB 3.46Å; L694-F697 PolarHBondContact O-N 3.01Å; L694-F697 VanDerWaalsContact O-N 3.11Å; F697-F699 HydrophobicContact CB-CE2 3.97Å; F697-F699 HydrophobicContact CB-CZ 4.01Å; F697-F699 AromaticContact CD1-CD1 3.65Å; F697-F699 HydrophobicContact CD1-CD1 3.65Å; F697-F699 HydrophobicContact CD1-CD2 4.16Å; F697-F699 AromaticContact CD1-CE1 3.7Å; F697-F699 HydrophobicContact CD1-CE1 3.7Å; F697-F699 HydrophobicContact CD1-CE2 4.2Å; F697-F699 AromaticContact CD1-CG 3.89Å; F697-F699 HydrophobicContact CD1-CG 3.89Å; F697-F699 AromaticContact CD1-CZ 3.98Å; F697-F699 HydrophobicContact CD1-CZ 3.98Å; F697-F699 HydrophobicContact CE1-CD1 4.11Å; F697-F699 HydrophobicContact CE1-CE1 4.36Å; F697-F699 HydrophobicContact CG-CE1 4.46Å; F697-F699 HydrophobicContact CG-CZ 4.37Å; F697-F699 VanDerWaalsContact O-CD2 3.24Å; F697-F699 WeakPolarHBondContact O-CD2 3.44Å; F697-F699 WeakPolarHBondContact O-CE2 3.48Å; F697-F699 PolarHBondContact O-N 3Å; F697-D702 HydrophobicContact CE1-CB 4.19Å; F697-D702 HydrophobicContact CZ-CB 4.18Å | ||
| 698 | N | 73.6 | Confident | 79.5 | Confident | 82 Ų | 82 | 102.5 Ų | 102.5 | 44% | 0.439 | 49% | 0.492 | S | S | . | . | trans | -91.4 | 78.1 | -178.6 | -166.8 | 15 | 0 | 0 | 0 | 111.1 | K700 E701 | N698-K700 PolarHBondContact O-N 3.06Å; N698-E701 HydrophobicContact CB-CB 4.27Å; N698-E701 PolarHBondContact ND2-OE2 2.71Å; N698-E701 PolarHBondContact O-N 3.13Å | ||
| 699 | F | 70.2 | Confident | 78.9 | Confident | 113 Ų | 113 | 105.9 Ų | 105.9 | 50% | 0.496 | 52% | 0.516 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.3 | -9.1 | 179.7 | -59.7 | -84.8 | 0 | 0 | 0 | 115.3 | L694 F697 | L694-F699 HydrophobicContact CD2-CZ 4.44Å; L694-F699 WeakPolarHBondContact O-CE2 3.32Å; F697-F699 HydrophobicContact CB-CE2 3.97Å; F697-F699 HydrophobicContact CB-CZ 4.01Å; F697-F699 AromaticContact CD1-CD1 3.65Å; F697-F699 HydrophobicContact CD1-CD1 3.65Å; F697-F699 HydrophobicContact CD1-CD2 4.16Å; F697-F699 AromaticContact CD1-CE1 3.7Å; F697-F699 HydrophobicContact CD1-CE1 3.7Å; F697-F699 HydrophobicContact CD1-CE2 4.2Å; F697-F699 AromaticContact CD1-CG 3.89Å; F697-F699 HydrophobicContact CD1-CG 3.89Å; F697-F699 AromaticContact CD1-CZ 3.98Å; F697-F699 HydrophobicContact CD1-CZ 3.98Å; F697-F699 HydrophobicContact CE1-CD1 4.11Å; F697-F699 HydrophobicContact CE1-CE1 4.36Å; F697-F699 HydrophobicContact CG-CE1 4.46Å; F697-F699 HydrophobicContact CG-CZ 4.37Å; F697-F699 VanDerWaalsContact O-CD2 3.24Å; F697-F699 WeakPolarHBondContact O-CD2 3.44Å; F697-F699 WeakPolarHBondContact O-CE2 3.48Å; F697-F699 PolarHBondContact O-N 3Å |
| 700 | K | 67.1 | Low | 78.5 | Confident | 189 Ų | 189 | 107.5 Ų | 107.5 | 82% | 0.822 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.6 | -2.6 | 175.8 | -61.6 | -170.1 | 174.6 | -119.9 | 0 | 114.2 | N698 | N698-K700 PolarHBondContact O-N 3.06Š|
| 701 | E | 64.8 | Low | 78.5 | Confident | 158 Ų | 158 | 106.6 Ų | 106.6 | 74% | 0.738 | 52% | 0.524 | S | S | * | . | S | Bend | trans | -125.3 | -4.7 | -168.7 | -162.8 | 166.1 | -145.6 | 0 | 0 | 112.6 | N698 | N698-E701 HydrophobicContact CB-CB 4.27Å; N698-E701 PolarHBondContact ND2-OE2 2.71Å; N698-E701 PolarHBondContact O-N 3.13Å |
| 702 | D | 69.6 | Low | 78.3 | Confident | 34 Ų | 34 | 114.5 Ų | 114.5 | 18% | 0.182 | 55% | 0.55 | C | S | . | . | trans | -103.7 | 116.1 | 171.2 | -167.5 | -33.2 | 0 | 0 | 0 | 109.6 | F697 R704 C705 | F697-D702 HydrophobicContact CE1-CB 4.19Å; F697-D702 HydrophobicContact CZ-CB 4.18Å; D702-R704 PolarHBondContact O-N 3.04Å; D702-R704 WeakPolarHBondContact OD1-CB 3.5Å; D702-R704 IonicContact OD1-CZ 2.68Å; D702-R704 PolarHBondContact OD1-N 2.7Å; D702-R704 IonicContact OD1-NE 2.8Å; D702-R704 PolarHBondContact OD1-NE 3.32Å; D702-R704 IonicContact OD1-NH2 2.66Å; D702-R704 PolarHBondContact OD1-NH2 2.82Å; D702-R704 IonicContact OD2-CZ 2.76Å; D702-R704 IonicContact OD2-NE 2.71Å; D702-R704 IonicContact OD2-NH2 3.81Å; D702-R704 PolarHBondContact OD2-NH2 2.9Å; D702-C705 WeakPolarHBondContact O-CB 3.43Å; D702-C705 PolarHBondContact O-N 2.85Å | ||
| 703 | E | 71.6 | Confident | 78.2 | Confident | 203 Ų | 203 | 116.9 Ų | 116.9 | 95% | 0.949 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | -12.7 | -177.3 | -166.1 | 168.9 | -165.7 | 0 | 0 | 113.5 | ||
| 704 | R | 76.9 | Confident | 78.5 | Confident | 211 Ų | 211 | 116.4 Ų | 116.4 | 80% | 0.796 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -5.1 | 175.5 | -58.5 | 164.3 | -66.6 | -155.8 | 5 | 113.5 | D702 | D702-R704 PolarHBondContact O-N 3.04Å; D702-R704 WeakPolarHBondContact OD1-CB 3.5Å; D702-R704 IonicContact OD1-CZ 2.68Å; D702-R704 PolarHBondContact OD1-N 2.7Å; D702-R704 IonicContact OD1-NE 2.8Å; D702-R704 PolarHBondContact OD1-NE 3.32Å; D702-R704 IonicContact OD1-NH2 2.66Å; D702-R704 PolarHBondContact OD1-NH2 2.82Å; D702-R704 IonicContact OD2-CZ 2.76Å; D702-R704 IonicContact OD2-NE 2.71Å; D702-R704 IonicContact OD2-NH2 3.81Å; D702-R704 PolarHBondContact OD2-NH2 2.9Å |
| 705 | C | 70.8 | Confident | 79 | Confident | 51 Ų | 51 | 117.8 Ų | 117.8 | 35% | 0.345 | 57% | 0.574 | S | S | . | * | trans | -97.4 | 92.7 | -178.5 | -70 | 0 | 0 | 0 | 0 | 111.8 | D702 | D702-C705 WeakPolarHBondContact O-CB 3.43Å; D702-C705 PolarHBondContact O-N 2.85Å | ||
| 706 | E | 78.4 | Confident | 79.7 | Confident | 175 Ų | 175 | 118.7 Ų | 118.7 | 82% | 0.818 | 58% | 0.578 | S | S | * | * | trans | -73.8 | 136.9 | 173.4 | -171.3 | 175 | -176.9 | 0 | 0 | 112.2 | V708 | E706-V708 PolarHBondContact O-N 3.22Å; E706-V708 VanDerWaalsContact O-N 3.07Å | ||
| 707 | Q | 78.3 | Confident | 80.7 | Confident | 121 Ų | 121 | 119.9 Ų | 119.9 | 57% | 0.565 | 58% | 0.579 | S | S | * | * | trans | -82.3 | 83.1 | 176.9 | -171.4 | 174.8 | -1.3 | 0 | 0 | 111.3 | S709 D710 | Q707-S709 PolarHBondContact O-N 2.96Å; Q707-S709 VanDerWaalsContact O-N 3.16Å; Q707-D710 PolarHBondContact NE2-OD2 2.92Å | ||
| 708 | V | 81.4 | Confident | 81.7 | Confident | 139 Ų | 139 | 120.9 Ų | 120.9 | 84% | 0.842 | 58% | 0.584 | S | S | * | * | trans | -58.5 | -27.8 | -178.8 | -174.7 | 0 | 0 | 0 | 0 | 113.6 | E706 | E706-V708 PolarHBondContact O-N 3.22Å; E706-V708 VanDerWaalsContact O-N 3.07Å | ||
| 709 | S | 81.2 | Confident | 82.7 | Confident | 74 Ų | 74 | 123.2 Ų | 123.2 | 52% | 0.517 | 59% | 0.592 | S | S | . | * | trans | -158.9 | 148.6 | 175.3 | -171.2 | 0 | 0 | 0 | 0 | 112.4 | Q707 V711 | Q707-S709 PolarHBondContact O-N 2.96Å; Q707-S709 VanDerWaalsContact O-N 3.16Å; S709-V711 WeakPolarHBondContact OG-CG2 3.33Å | ||
| 710 | D | 84.2 | Confident | 84 | Confident | 71 Ų | 71 | 123 Ų | 123 | 38% | 0.38 | 59% | 0.593 | S | S | . | * | trans | -113.7 | 63.5 | 167.4 | -153.2 | -27.2 | 0 | 0 | 0 | 112.5 | Q707 R712 A713 Q714 | Q707-D710 PolarHBondContact NE2-OD2 2.92Å; D710-R712 PolarHBondContact O-N 2.95Å; D710-R712 PolarHBondContact OD1-N 3.47Å; D710-A713 HydrophobicContact CB-CB 3.98Å; D710-A713 PolarHBondContact O-N 3.39Å; D710-A713 VanDerWaalsContact O-N 3.14Å; D710-A713 WeakPolarHBondContact OD1-CB 3.32Å; D710-A713 PolarHBondContact OD1-N 2.94Å; D710-Q714 WeakPolarHBondContact O-CB 3.34Å; D710-Q714 PolarHBondContact O-N 2.9Å | ||
| 711 | V | 91.7 | Very high | 85.4 | Confident | 95 Ų | 95 | 117.2 Ų | 117.2 | 58% | 0.576 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -53.8 | -26.1 | 172.1 | -172.2 | 0 | 0 | 0 | 0 | 111.7 | S709 L715 | S709-V711 WeakPolarHBondContact OG-CG2 3.33Å; V711-L715 VanDerWaalsContact O-CB 3.23Å; V711-L715 WeakPolarHBondContact O-CB 3.31Å; V711-L715 PolarHBondContact O-N 3.12Å |
| 712 | R | 88 | Confident | 86.9 | Confident | 198 Ų | 198 | 114.9 Ų | 114.9 | 75% | 0.747 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -76.1 | -40.6 | 179.2 | -174.1 | 179.2 | -67.7 | -86.4 | 1.5 | 112.2 | D710 K716 | D710-R712 PolarHBondContact O-N 2.95Å; D710-R712 PolarHBondContact OD1-N 3.47Å; R712-K716 WeakPolarHBondContact O-CG 3.45Å; R712-K716 PolarHBondContact O-N 3.04Å |
| 713 | A | 89.6 | Confident | 88.1 | Confident | 49 Ų | 49 | 118.8 Ų | 118.8 | 41% | 0.405 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -68.9 | -40 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111 | D710 K716 F717 | D710-A713 HydrophobicContact CB-CB 3.98Å; D710-A713 PolarHBondContact O-N 3.39Å; D710-A713 VanDerWaalsContact O-N 3.14Å; D710-A713 WeakPolarHBondContact OD1-CB 3.32Å; D710-A713 PolarHBondContact OD1-N 2.94Å; A713-K716 WeakPolarHBondContact O-CB 3.24Å; A713-K716 PolarHBondContact O-N 3.46Å; A713-F717 PolarHBondContact O-N 2.77Å |
| 714 | Q | 93.1 | Very high | 89.2 | Confident | 101 Ų | 101 | 113 Ų | 113 | 47% | 0.472 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -62.2 | -43 | 176.1 | -167.6 | -177.2 | 7.3 | 0 | 0 | 112.1 | D710 F717 F718 | D710-Q714 WeakPolarHBondContact O-CB 3.34Å; D710-Q714 PolarHBondContact O-N 2.9Å; Q714-F717 WeakPolarHBondContact O-CB 3.44Å; Q714-F717 PolarHBondContact O-N 3.16Å; Q714-F718 HydrophobicContact CG-CD2 4.19Å; Q714-F718 HydrophobicContact CG-CE2 3.78Å; Q714-F718 VanDerWaalsContact O-CD2 3.23Å; Q714-F718 WeakPolarHBondContact O-CD2 3.31Å; Q714-F718 PolarHBondContact O-N 2.85Å |
| 715 | L | 95.6 | Very high | 90 | Very high | 117 Ų | 117 | 107.1 Ų | 107.1 | 61% | 0.613 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64.4 | -39.7 | 175.5 | -176.2 | 62.3 | 0 | 0 | 0 | 112 | V711 F717 F718 E719 | V711-L715 VanDerWaalsContact O-CB 3.23Å; V711-L715 WeakPolarHBondContact O-CB 3.31Å; V711-L715 PolarHBondContact O-N 3.12Å; L715-F717 VanDerWaalsContact C-N 3.31Å; L715-F717 PolarHBondContact O-N 2.97Å; L715-F718 PolarHBondContact O-N 3.16Å; L715-E719 PolarHBondContact O-N 2.66Å |
| 716 | K | 95.4 | Very high | 91.2 | Very high | 133 Ų | 133 | 110.3 Ų | 110.3 | 58% | 0.578 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.3 | -34 | 172.1 | -78.2 | -176.3 | 169.5 | -164.7 | 0 | 113.2 | R712 A713 E719 Q720 | R712-K716 WeakPolarHBondContact O-CG 3.45Å; R712-K716 PolarHBondContact O-N 3.04Å; A713-K716 WeakPolarHBondContact O-CB 3.24Å; A713-K716 PolarHBondContact O-N 3.46Å; K716-E719 PolarHBondContact O-N 2.79Å; K716-Q720 WeakPolarHBondContact O-CB 3.49Å; K716-Q720 PolarHBondContact O-N 3.27Å |
| 717 | F | 96.4 | Very high | 91.9 | Very high | 111 Ų | 111 | 107.2 Ų | 107.2 | 49% | 0.487 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.6 | -39.4 | 173.8 | 175.7 | -106 | 0 | 0 | 0 | 111.2 | A713 Q714 L715 Q720 L721 | A713-F717 PolarHBondContact O-N 2.77Å; Q714-F717 WeakPolarHBondContact O-CB 3.44Å; Q714-F717 PolarHBondContact O-N 3.16Å; L715-F717 VanDerWaalsContact C-N 3.31Å; L715-F717 PolarHBondContact O-N 2.97Å; F717-Q720 PolarHBondContact O-N 3.41Å; F717-L721 HydrophobicContact CD1-CD1 3.98Å; F717-L721 HydrophobicContact CD1-CG 4.46Å; F717-L721 HydrophobicContact CE1-CD1 3.48Å; F717-L721 VanDerWaalsContact CE1-CD1 3.48Å; F717-L721 HydrophobicContact CE1-CG 4.09Å; F717-L721 HydrophobicContact CE2-CG 4.38Å; F717-L721 HydrophobicContact CZ-CD1 3.84Å; F717-L721 HydrophobicContact CZ-CD2 4.18Å; F717-L721 HydrophobicContact CZ-CG 4.05Å; F717-L721 WeakPolarHBondContact O-CG 3.31Å; F717-L721 PolarHBondContact O-N 2.85Å |
| 718 | F | 97 | Very high | 92.7 | Very high | 113 Ų | 113 | 107.7 Ų | 107.7 | 50% | 0.496 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.3 | -40.6 | 170.8 | -73 | -59.9 | 0 | 0 | 0 | 112.9 | Q714 L715 Q720 L721 D722 | Q714-F718 HydrophobicContact CG-CD2 4.19Å; Q714-F718 HydrophobicContact CG-CE2 3.78Å; Q714-F718 VanDerWaalsContact O-CD2 3.23Å; Q714-F718 WeakPolarHBondContact O-CD2 3.31Å; Q714-F718 PolarHBondContact O-N 2.85Å; L715-F718 PolarHBondContact O-N 3.16Å; F718-Q720 VanDerWaalsContact C-N 3.3Å; F718-Q720 PolarHBondContact O-N 2.79Å; F718-L721 HydrophobicContact CD1-CD1 4.11Å; F718-L721 PolarHBondContact O-N 3.16Å; F718-D722 PolarHBondContact O-N 2.94Å |
| 719 | E | 95.9 | Very high | 93.3 | Very high | 132 Ų | 132 | 106.1 Ų | 106.1 | 62% | 0.617 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -59.2 | -39.9 | 172 | -176.8 | 179.8 | -156.1 | 0 | 0 | 111.7 | L715 K716 Q723 | L715-E719 PolarHBondContact O-N 2.66Å; K716-E719 PolarHBondContact O-N 2.79Å; E719-Q723 WeakPolarHBondContact O-CB 3.36Å; E719-Q723 PolarHBondContact O-N 3.27Å |
| 720 | Q | 96.1 | Very high | 93.7 | Very high | 108 Ų | 108 | 107.5 Ų | 107.5 | 51% | 0.505 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -70 | -37.3 | 174.2 | -173.9 | 178 | -3.6 | 0 | 0 | 112.6 | K716 F717 F718 Q723 M724 | K716-Q720 WeakPolarHBondContact O-CB 3.49Å; K716-Q720 PolarHBondContact O-N 3.27Å; F717-Q720 PolarHBondContact O-N 3.41Å; F718-Q720 VanDerWaalsContact C-N 3.3Å; F718-Q720 PolarHBondContact O-N 2.79Å; Q720-Q723 PolarHBondContact O-N 3.29Å; Q720-M724 WeakPolarHBondContact O-CG 3.08Å; Q720-M724 PolarHBondContact O-N 3.21Å |
| 721 | L | 96.7 | Very high | 93.9 | Very high | 67 Ų | 67 | 110.6 Ų | 110.6 | 35% | 0.351 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.7 | -45.5 | 175.1 | -77.7 | 176.4 | 0 | 0 | 0 | 111.7 | F717 F718 Q723 M724 E725 | F717-L721 HydrophobicContact CD1-CD1 3.98Å; F717-L721 HydrophobicContact CD1-CG 4.46Å; F717-L721 HydrophobicContact CE1-CD1 3.48Å; F717-L721 VanDerWaalsContact CE1-CD1 3.48Å; F717-L721 HydrophobicContact CE1-CG 4.09Å; F717-L721 HydrophobicContact CE2-CG 4.38Å; F717-L721 HydrophobicContact CZ-CD1 3.84Å; F717-L721 HydrophobicContact CZ-CD2 4.18Å; F717-L721 HydrophobicContact CZ-CG 4.05Å; F717-L721 WeakPolarHBondContact O-CG 3.31Å; F717-L721 PolarHBondContact O-N 2.85Å; F718-L721 HydrophobicContact CD1-CD1 4.11Å; F718-L721 PolarHBondContact O-N 3.16Å; L721-Q723 VanDerWaalsContact C-N 3.34Å; L721-M724 HydrophobicContact CD2-CE 3.9Å; L721-M724 PolarHBondContact O-N 2.67Å; L721-E725 WeakPolarHBondContact O-CB 3.41Å; L721-E725 PolarHBondContact O-N 3.12Å |
| 722 | D | 95.9 | Very high | 93.9 | Very high | 109 Ų | 109 | 111 Ų | 111 | 58% | 0.583 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.1 | -44.8 | 174.6 | 179.1 | 67.4 | 0 | 0 | 0 | 111 | F718 M724 E725 K726 | F718-D722 PolarHBondContact O-N 2.94Å; D722-M724 VanDerWaalsContact C-N 3.34Å; D722-M724 PolarHBondContact O-N 3.34Å; D722-E725 PolarHBondContact O-N 3.03Å; D722-K726 VanDerWaalsContact O-CB 3.31Å; D722-K726 WeakPolarHBondContact O-CB 3.35Å; D722-K726 PolarHBondContact O-N 2.98Å |
| 723 | Q | 96.4 | Very high | 93.8 | Very high | 117 Ų | 117 | 108.4 Ų | 108.4 | 55% | 0.547 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.6 | -40 | 175.3 | -176.7 | 167.7 | 97.8 | 0 | 0 | 112.8 | E719 Q720 L721 Q727 | E719-Q723 WeakPolarHBondContact O-CB 3.36Å; E719-Q723 PolarHBondContact O-N 3.27Å; Q720-Q723 PolarHBondContact O-N 3.29Å; L721-Q723 VanDerWaalsContact C-N 3.34Å; Q723-Q727 WeakPolarHBondContact O-CB 3.28Å; Q723-Q727 VanDerWaalsContact O-CG 3.31Å; Q723-Q727 WeakPolarHBondContact O-CG 3.31Å; Q723-Q727 PolarHBondContact O-N 2.89Å |
| 724 | M | 93.7 | Very high | 93.6 | Very high | 81 Ų | 81 | 109.3 Ų | 109.3 | 40% | 0.399 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -73.1 | -35 | 175.7 | -72.7 | -167.8 | -55.5 | 0 | 0 | 113 | Q720 L721 D722 Q727 R728 | Q720-M724 WeakPolarHBondContact O-CG 3.08Å; Q720-M724 PolarHBondContact O-N 3.21Å; L721-M724 HydrophobicContact CD2-CE 3.9Å; L721-M724 PolarHBondContact O-N 2.67Å; D722-M724 VanDerWaalsContact C-N 3.34Å; D722-M724 PolarHBondContact O-N 3.34Å; M724-Q727 PolarHBondContact O-N 3.12Å; M724-R728 WeakPolarHBondContact O-CB 3.36Å; M724-R728 PolarHBondContact O-N 3.41Å |
| 725 | E | 94.3 | Very high | 93.3 | Very high | 87 Ų | 87 | 109.5 Ų | 109.5 | 41% | 0.407 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.9 | -40.9 | 173.9 | -175.4 | 175.9 | 150.4 | 0 | 0 | 111 | L721 D722 R728 K729 | L721-E725 WeakPolarHBondContact O-CB 3.41Å; L721-E725 PolarHBondContact O-N 3.12Å; D722-E725 PolarHBondContact O-N 3.03Å; E725-R728 WeakPolarHBondContact O-CB 3.5Å; E725-R728 PolarHBondContact O-N 3.5Å; E725-K729 HydrophobicContact CG-CD 4.45Å; E725-K729 WeakPolarHBondContact O-CG 3.19Å; E725-K729 PolarHBondContact O-N 3.46Å; E725-K729 WeakPolarHBondContact OE1-CE 3.15Å; E725-K729 IonicContact OE1-NZ 2.73Å; E725-K729 PolarHBondContact OE1-NZ 2.68Å |
| 726 | K | 95.4 | Very high | 92.9 | Very high | 119 Ų | 119 | 109.3 Ų | 109.3 | 52% | 0.517 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.4 | -48.2 | 172.3 | 178.3 | 170.8 | 174 | 172 | 0 | 111.8 | D722 R728 K729 E730 | D722-K726 VanDerWaalsContact O-CB 3.31Å; D722-K726 WeakPolarHBondContact O-CB 3.35Å; D722-K726 PolarHBondContact O-N 2.98Å; K726-R728 VanDerWaalsContact C-N 3.3Å; K726-R728 PolarHBondContact O-N 2.94Å; K726-K729 PolarHBondContact O-N 3.1Å; K726-K729 VanDerWaalsContact O-N 3.13Å; K726-E730 WeakPolarHBondContact CE-OE1 3.29Å; K726-E730 HydrophobicContact CG-CG 4.47Å; K726-E730 IonicContact NZ-OE1 3.26Å; K726-E730 WeakPolarHBondContact O-CG 3.45Å; K726-E730 PolarHBondContact O-N 2.92Å |
| 727 | Q | 93.8 | Very high | 92.1 | Very high | 109 Ų | 109 | 103.8 Ų | 103.8 | 51% | 0.509 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -58.3 | -41.8 | 175.1 | -77.1 | 173.2 | 6.9 | 0 | 0 | 111.9 | Q723 M724 K729 E730 E731 | Q723-Q727 WeakPolarHBondContact O-CB 3.28Å; Q723-Q727 VanDerWaalsContact O-CG 3.31Å; Q723-Q727 WeakPolarHBondContact O-CG 3.31Å; Q723-Q727 PolarHBondContact O-N 2.89Å; M724-Q727 PolarHBondContact O-N 3.12Å; Q727-K729 VanDerWaalsContact C-N 3.34Å; Q727-K729 PolarHBondContact O-N 3.32Å; Q727-E730 PolarHBondContact O-N 3.17Å; Q727-E731 VanDerWaalsContact O-CB 3.32Å; Q727-E731 WeakPolarHBondContact O-CB 3.46Å; Q727-E731 PolarHBondContact O-N 2.87Å |
| 728 | R | 94.8 | Very high | 91.3 | Very high | 131 Ų | 131 | 102.8 Ų | 102.8 | 49% | 0.494 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.6 | -39.7 | 175.6 | -167.6 | -167.1 | -56.9 | 122.1 | 2.6 | 112.3 | M724 E725 K726 Q732 | M724-R728 WeakPolarHBondContact O-CB 3.36Å; M724-R728 PolarHBondContact O-N 3.41Å; E725-R728 WeakPolarHBondContact O-CB 3.5Å; E725-R728 PolarHBondContact O-N 3.5Å; K726-R728 VanDerWaalsContact C-N 3.3Å; K726-R728 PolarHBondContact O-N 2.94Å; R728-Q732 WeakPolarHBondContact O-CB 3.22Å; R728-Q732 VanDerWaalsContact O-CG 3.24Å; R728-Q732 WeakPolarHBondContact O-CG 3.42Å; R728-Q732 PolarHBondContact O-N 3.24Å |
| 729 | K | 94.1 | Very high | 90.8 | Very high | 106 Ų | 106 | 103.4 Ų | 103.4 | 46% | 0.461 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -68.2 | -45.7 | 176.3 | -71.5 | 169.8 | -175.7 | 166.9 | 0 | 111.6 | E725 K726 Q727 E731 Q732 E733 | E725-K729 HydrophobicContact CG-CD 4.45Å; E725-K729 WeakPolarHBondContact O-CG 3.19Å; E725-K729 PolarHBondContact O-N 3.46Å; E725-K729 WeakPolarHBondContact OE1-CE 3.15Å; E725-K729 IonicContact OE1-NZ 2.73Å; E725-K729 PolarHBondContact OE1-NZ 2.68Å; K726-K729 PolarHBondContact O-N 3.1Å; K726-K729 VanDerWaalsContact O-N 3.13Å; Q727-K729 VanDerWaalsContact C-N 3.34Å; Q727-K729 PolarHBondContact O-N 3.32Å; K729-E731 VanDerWaalsContact C-N 3.3Å; K729-E731 PolarHBondContact O-N 3.01Å; K729-Q732 PolarHBondContact O-N 2.97Å; K729-E733 PolarHBondContact O-N 2.87Å |
| 730 | E | 89.6 | Confident | 90 | Very high | 104 Ų | 104 | 98.3 Ų | 98.3 | 49% | 0.486 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.1 | -37.9 | 175.3 | -70.3 | 175.7 | 177.2 | 0 | 0 | 111.7 | K726 Q727 R734 | K726-E730 WeakPolarHBondContact CE-OE1 3.29Å; K726-E730 HydrophobicContact CG-CG 4.47Å; K726-E730 IonicContact NZ-OE1 3.26Å; K726-E730 WeakPolarHBondContact O-CG 3.45Å; K726-E730 PolarHBondContact O-N 2.92Å; Q727-E730 PolarHBondContact O-N 3.17Å; E730-R734 VanDerWaalsContact O-CB 3.24Å; E730-R734 WeakPolarHBondContact O-CB 3.46Å; E730-R734 PolarHBondContact O-N 3.35Å |
| 731 | E | 88.9 | Confident | 89 | Confident | 135 Ų | 135 | 94.5 Ų | 94.5 | 63% | 0.631 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -68.5 | -40.3 | 173.6 | -175.3 | 170.1 | -135.2 | 0 | 0 | 112.6 | Q727 K729 R734 E735 | Q727-E731 VanDerWaalsContact O-CB 3.32Å; Q727-E731 WeakPolarHBondContact O-CB 3.46Å; Q727-E731 PolarHBondContact O-N 2.87Å; K729-E731 VanDerWaalsContact C-N 3.3Å; K729-E731 PolarHBondContact O-N 3.01Å; E731-R734 CarbonylContact O-C 3.51Å; E731-R734 WeakPolarHBondContact O-CB 3.32Å; E731-R734 PolarHBondContact O-N 3.03Å; E731-E735 PolarHBondContact O-N 2.9Å |
| 732 | Q | 91.1 | Very high | 88.1 | Confident | 105 Ų | 105 | 99.7 Ų | 99.7 | 49% | 0.491 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.7 | -45.1 | 175.5 | -77.5 | 173 | -10.9 | 0 | 0 | 112.3 | R728 K729 R734 E735 I736 | R728-Q732 WeakPolarHBondContact O-CB 3.22Å; R728-Q732 VanDerWaalsContact O-CG 3.24Å; R728-Q732 WeakPolarHBondContact O-CG 3.42Å; R728-Q732 PolarHBondContact O-N 3.24Å; K729-Q732 PolarHBondContact O-N 2.97Å; Q732-R734 PolarHBondContact O-N 2.99Å; Q732-E735 PolarHBondContact O-N 3.23Å; Q732-I736 WeakPolarHBondContact O-CB 3.4Å; Q732-I736 WeakPolarHBondContact O-CD1 3.4Å; Q732-I736 VanDerWaalsContact O-CG1 3.26Å; Q732-I736 WeakPolarHBondContact O-CG1 3.44Å; Q732-I736 PolarHBondContact O-N 3.33Å |
| 733 | E | 86.9 | Confident | 86.7 | Confident | 143 Ų | 143 | 97.7 Ų | 97.7 | 67% | 0.668 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -58.2 | -40.5 | 172.5 | -75 | -174.5 | -159.7 | 0 | 0 | 111.2 | K729 L737 | K729-E733 PolarHBondContact O-N 2.87Å; E733-L737 WeakPolarHBondContact O-CB 3.4Å; E733-L737 PolarHBondContact O-N 3.33Å |
| 734 | R | 84.3 | Confident | 84.9 | Confident | 67 Ų | 67 | 104 Ų | 104 | 25% | 0.253 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.6 | -43.8 | 175.2 | 165.2 | 173 | 169.4 | 109.7 | -4.2 | 113.1 | E730 E731 Q732 L737 L738 M762 E766 | E730-R734 VanDerWaalsContact O-CB 3.24Å; E730-R734 WeakPolarHBondContact O-CB 3.46Å; E730-R734 PolarHBondContact O-N 3.35Å; E731-R734 CarbonylContact O-C 3.51Å; E731-R734 WeakPolarHBondContact O-CB 3.32Å; E731-R734 PolarHBondContact O-N 3.03Å; Q732-R734 PolarHBondContact O-N 2.99Å; R734-L737 PolarHBondContact O-N 3.45Å; R734-L738 VanDerWaalsContact O-CB 3.32Å; R734-L738 WeakPolarHBondContact O-CB 3.46Å; R734-L738 PolarHBondContact O-N 3.03Å; R734-M762 HydrophobicContact CB-CE 3.57Å; R734-M762 HydrophobicContact CB-SD 4.1Å; R734-M762 HydrophobicContact CG-CE 3.63Å; R734-M762 HydrophobicContact CG-SD 3.68Å; R734-M762 PolarHBondContact NH1-SD 3.45Å; R734-E766 IonicContact CZ-OE1 3.67Å; R734-E766 IonicContact CZ-OE2 2.82Å; R734-E766 IonicContact NE-OE1 2.87Å; R734-E766 IonicContact NH1-OE1 2.68Å; R734-E766 PolarHBondContact NH1-OE1 3.41Å; R734-E766 IonicContact NH1-OE2 2.7Å; R734-E766 PolarHBondContact NH1-OE2 3.23Å; R734-E766 IonicContact NH2-OE1 3.13Å; R734-E766 PolarHBondContact NH2-OE1 3.27Å; R734-E766 IonicContact NH2-OE2 3.53Å; R734-E766 PolarHBondContact NH2-OE2 2.9Å |
| 735 | E | 86.8 | Confident | 83.3 | Confident | 106 Ų | 106 | 103.8 Ų | 103.8 | 50% | 0.495 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.5 | -46.4 | 176.2 | -164.2 | -145.9 | 130.5 | 0 | 0 | 110.1 | E731 Q732 L737 L738 K739 | E731-E735 PolarHBondContact O-N 2.9Å; Q732-E735 PolarHBondContact O-N 3.23Å; E735-L737 VanDerWaalsContact C-N 3.33Å; E735-L737 PolarHBondContact O-N 3.04Å; E735-L738 PolarHBondContact O-N 3.49Å; E735-K739 WeakPolarHBondContact O-CB 3.25Å; E735-K739 PolarHBondContact O-N 3.1Å; E735-K739 IonicContact OE1-NZ 2.8Å; E735-K739 PolarHBondContact OE1-NZ 2.82Å |
| 736 | I | 86.8 | Confident | 81.2 | Confident | 113 Ų | 113 | 111.9 Ų | 111.9 | 58% | 0.579 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -57.9 | -46.4 | 177.6 | -69.2 | 165 | 0 | 0 | 0 | 110.6 | Q732 K739 A740 | Q732-I736 WeakPolarHBondContact O-CB 3.4Å; Q732-I736 WeakPolarHBondContact O-CD1 3.4Å; Q732-I736 VanDerWaalsContact O-CG1 3.26Å; Q732-I736 WeakPolarHBondContact O-CG1 3.44Å; Q732-I736 PolarHBondContact O-N 3.33Å; I736-K739 PolarHBondContact O-N 3.46Å; I736-A740 WeakPolarHBondContact O-CB 3.34Å; I736-A740 PolarHBondContact O-N 3.27Å |
| 737 | L | 79.1 | Confident | 79.3 | Confident | 17 Ų | 17 | 114.4 Ų | 114.4 | 9% | 0.089 | 53% | 0.529 | C | S | . | . | H | α-helix | trans | -64 | -43.4 | 179 | -162.4 | 78.5 | 0 | 0 | 0 | 112.1 | E733 R734 E735 A741 L755 K758 A759 M762 | E733-L737 WeakPolarHBondContact O-CB 3.4Å; E733-L737 PolarHBondContact O-N 3.33Å; R734-L737 PolarHBondContact O-N 3.45Å; E735-L737 VanDerWaalsContact C-N 3.33Å; E735-L737 PolarHBondContact O-N 3.04Å; L737-A741 VanDerWaalsContact O-CB 3.31Å; L737-A741 WeakPolarHBondContact O-CB 3.48Å; L737-A741 PolarHBondContact O-N 3.03Å; L737-L755 HydrophobicContact CD1-CD1 3.41Å; L737-L755 VanDerWaalsContact CD1-CD1 3.41Å; L737-L755 HydrophobicContact CD1-CG 3.64Å; L737-K758 HydrophobicContact CD1-CD 4.11Å; L737-K758 HydrophobicContact CD2-CB 4.23Å; L737-K758 HydrophobicContact CD2-CD 4.15Å; L737-K758 HydrophobicContact CD2-CG 3.95Å; L737-A759 HydrophobicContact CD2-CB 4.12Å; L737-A759 HydrophobicContact CG-CB 4.11Å; L737-M762 HydrophobicContact CB-CE 4.36Å; L737-M762 HydrophobicContact CD2-CE 3.64Å |
| 738 | L | 80.8 | Confident | 77.3 | Confident | 90 Ų | 90 | 114.4 Ų | 114.4 | 47% | 0.471 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.9 | -38.5 | 177.6 | -177.1 | 62.6 | 0 | 0 | 0 | 112 | R734 E735 A741 K742 | R734-L738 VanDerWaalsContact O-CB 3.32Å; R734-L738 WeakPolarHBondContact O-CB 3.46Å; R734-L738 PolarHBondContact O-N 3.03Å; E735-L738 PolarHBondContact O-N 3.49Å; L738-A741 PolarHBondContact O-N 3.33Å; L738-K742 WeakPolarHBondContact O-CB 3.43Å; L738-K742 PolarHBondContact O-N 3.32Å |
| 739 | K | 85.4 | Confident | 76.3 | Confident | 125 Ų | 125 | 112.2 Ų | 112.2 | 54% | 0.543 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.8 | -46.7 | 177.2 | -169.8 | 179.5 | -151 | 147.8 | 0 | 110.9 | E735 I736 A741 K742 S743 | E735-K739 WeakPolarHBondContact O-CB 3.25Å; E735-K739 PolarHBondContact O-N 3.1Å; E735-K739 IonicContact OE1-NZ 2.8Å; E735-K739 PolarHBondContact OE1-NZ 2.82Å; I736-K739 PolarHBondContact O-N 3.46Å; K739-A741 PolarHBondContact O-N 2.86Å; K739-K742 PolarHBondContact O-N 2.66Å; K739-K742 VanDerWaalsContact O-N 3.12Å; K739-S743 PolarHBondContact O-N 3.25Å; K739-S743 VanDerWaalsContact O-N 3.12Å; K739-S743 PolarHBondContact O-OG 3.46Å |
| 740 | A | 79.5 | Confident | 75.3 | Confident | 26 Ų | 26 | 111.9 Ų | 111.9 | 22% | 0.215 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -65.1 | -37.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | I736 K742 S743 Q752 L755 | I736-A740 WeakPolarHBondContact O-CB 3.34Å; I736-A740 PolarHBondContact O-N 3.27Å; A740-K742 VanDerWaalsContact C-N 3.26Å; A740-K742 PolarHBondContact O-N 3.46Å; A740-S743 WeakPolarHBondContact O-CB 3.49Å; A740-S743 PolarHBondContact O-N 3.4Å; A740-Q752 PolarHBondContact O-NE2 2.87Å; A740-L755 HydrophobicContact CB-CD2 3.54Å |
| 741 | A | 74.6 | Confident | 74.6 | Confident | 28 Ų | 28 | 113.9 Ų | 113.9 | 23% | 0.231 | 54% | 0.544 | C | S | . | . | H | α-helix | trans | -67.4 | -24.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | L737 L738 K739 K756 A759 | L737-A741 VanDerWaalsContact O-CB 3.31Å; L737-A741 WeakPolarHBondContact O-CB 3.48Å; L737-A741 PolarHBondContact O-N 3.03Å; L738-A741 PolarHBondContact O-N 3.33Å; K739-A741 PolarHBondContact O-N 2.86Å; A741-K756 HydrophobicContact CB-CB 4.23Å; A741-A759 HydrophobicContact CB-CB 3.63Å |
| 742 | K | 77.6 | Confident | 73.9 | Confident | 176 Ų | 176 | 109.4 Ų | 109.4 | 77% | 0.765 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -89 | -12.6 | 177.2 | -165 | 172.7 | -178.8 | -180 | 0 | 113.2 | L738 K739 A740 R744 | L738-K742 WeakPolarHBondContact O-CB 3.43Å; L738-K742 PolarHBondContact O-N 3.32Å; K739-K742 PolarHBondContact O-N 2.66Å; K739-K742 VanDerWaalsContact O-N 3.12Å; A740-K742 VanDerWaalsContact C-N 3.26Å; A740-K742 PolarHBondContact O-N 3.46Å; K742-R744 PolarHBondContact O-N 2.97Å |
| 743 | S | 67.4 | Low | 73.3 | Confident | 67 Ų | 67 | 108.6 Ų | 108.6 | 47% | 0.469 | 52% | 0.522 | S | S | . | . | trans | -66.5 | 113.2 | 179.1 | -68.9 | 0 | 0 | 0 | 0 | 112.5 | K739 A740 S745 Q752 | K739-S743 PolarHBondContact O-N 3.25Å; K739-S743 VanDerWaalsContact O-N 3.12Å; K739-S743 PolarHBondContact O-OG 3.46Å; A740-S743 WeakPolarHBondContact O-CB 3.49Å; A740-S743 PolarHBondContact O-N 3.4Å; S743-S745 VanDerWaalsContact C-N 3.25Å; S743-S745 PolarHBondContact O-N 3.47Å; S743-Q752 PolarHBondContact O-NE2 3.3Å | ||
| 744 | R | 57.8 | Low | 73 | Confident | 249 Ų | 249 | 110.8 Ų | 110.8 | 94% | 0.94 | 52% | 0.524 | S | S | * | . | trans | -79.4 | 60 | -179.8 | -62.9 | -178.6 | 177 | -179.4 | -1.8 | 112.9 | K742 | K742-R744 PolarHBondContact O-N 2.97Š| ||
| 745 | S | 59.8 | Low | 72.7 | Confident | 76 Ų | 76 | 110.8 Ų | 110.8 | 53% | 0.531 | 53% | 0.529 | S | S | . | . | trans | -66.8 | 139.9 | 161.9 | -172 | 0 | 0 | 0 | 0 | 109.1 | S743 Q747 | S743-S745 VanDerWaalsContact C-N 3.25Å; S743-S745 PolarHBondContact O-N 3.47Å; S745-Q747 PolarHBondContact OG-O 2.87Å | ||
| 746 | R | 51.8 | Low | 72.5 | Confident | 257 Ų | 257 | 110.2 Ų | 110.2 | 97% | 0.97 | 53% | 0.525 | S | S | * | . | S | Bend | trans | -100.6 | 3.2 | -174.3 | -154.3 | 177.4 | -179.2 | -124.4 | 0.4 | 113.8 | ||
| 747 | Q | 53.8 | Low | 72.3 | Confident | 173 Ų | 173 | 110.9 Ų | 110.9 | 81% | 0.808 | 53% | 0.525 | S | S | * | . | S | Bend | trans | -131.4 | 107.6 | 174.1 | -168.8 | 160.7 | -21.2 | 0 | 0 | 106.1 | S745 D749 | S745-Q747 PolarHBondContact OG-O 2.87Å; Q747-D749 PolarHBondContact O-N 2.87Å |
| 748 | E | 53.7 | Low | 72.6 | Confident | 109 Ų | 109 | 116 Ų | 116 | 51% | 0.509 | 55% | 0.547 | S | S | . | . | trans | -88.5 | 106.8 | -160.7 | -164.1 | 162 | -152.1 | 0 | 0 | 110.9 | K756 | E748-K756 IonicContact OE1-NZ 3.46Å; E748-K756 PolarHBondContact OE1-NZ 2.99Å | ||
| 749 | D | 73.2 | Confident | 72.7 | Confident | 85 Ų | 85 | 112.2 Ų | 112.2 | 46% | 0.455 | 53% | 0.528 | S | S | . | . | trans | -65.6 | 134.3 | 170.3 | -173.2 | -40.4 | 0 | 0 | 0 | 109.8 | Q747 E751 Q752 L753 | Q747-D749 PolarHBondContact O-N 2.87Å; D749-E751 PolarHBondContact O-N 3Å; D749-E751 VanDerWaalsContact O-N 3.15Å; D749-E751 WeakPolarHBondContact OD1-CB 3.14Å; D749-E751 PolarHBondContact OD1-N 2.9Å; D749-Q752 HydrophobicContact CB-CB 4.32Å; D749-Q752 PolarHBondContact O-N 2.9Å; D749-L753 PolarHBondContact O-N 3.29Å | ||
| 750 | P | 73.4 | Confident | 72.8 | Confident | 98 Ų | 98 | 113.5 Ų | 113.5 | 64% | 0.636 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -53.9 | -29.9 | 174.9 | 22.6 | -34.7 | 0 | 0 | 0 | 113.8 | R754 | P750-R754 WeakPolarHBondContact O-CG 3.38Å; P750-R754 PolarHBondContact O-N 2.73Å |
| 751 | E | 74.3 | Confident | 73.2 | Confident | 146 Ų | 146 | 118 Ų | 118 | 68% | 0.682 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -67.9 | -40.5 | 174 | -61.3 | -142.1 | 135.7 | 0 | 0 | 111.9 | D749 L753 R754 L755 | D749-E751 PolarHBondContact O-N 3Å; D749-E751 VanDerWaalsContact O-N 3.15Å; D749-E751 WeakPolarHBondContact OD1-CB 3.14Å; D749-E751 PolarHBondContact OD1-N 2.9Å; E751-L753 VanDerWaalsContact C-N 3.31Å; E751-L753 PolarHBondContact O-N 2.95Å; E751-R754 PolarHBondContact O-N 3.2Å; E751-L755 WeakPolarHBondContact O-CB 3.31Å; E751-L755 PolarHBondContact O-N 2.8Å |
| 752 | Q | 74.1 | Confident | 73.5 | Confident | 41 Ų | 41 | 119.2 Ų | 119.2 | 19% | 0.192 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -65.3 | -36.2 | 179 | -162.2 | -177.4 | 5.1 | 0 | 0 | 111.6 | A740 S743 D749 L755 K756 | A740-Q752 PolarHBondContact O-NE2 2.87Å; S743-Q752 PolarHBondContact O-NE2 3.3Å; D749-Q752 HydrophobicContact CB-CB 4.32Å; D749-Q752 PolarHBondContact O-N 2.9Å; Q752-L755 PolarHBondContact O-N 3.22Å; Q752-K756 VanDerWaalsContact O-CB 3.24Å; Q752-K756 WeakPolarHBondContact O-CB 3.27Å; Q752-K756 PolarHBondContact O-N 2.68Å |
| 753 | L | 78.6 | Confident | 73.9 | Confident | 88 Ų | 88 | 115.6 Ų | 115.6 | 46% | 0.461 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.3 | -43 | 173.7 | -177.7 | 61.7 | 0 | 0 | 0 | 111.9 | D749 E751 L755 K756 Q757 | D749-L753 PolarHBondContact O-N 3.29Å; E751-L753 VanDerWaalsContact C-N 3.31Å; E751-L753 PolarHBondContact O-N 2.95Å; L753-L755 VanDerWaalsContact C-N 3.35Å; L753-K756 PolarHBondContact O-N 3.47Å; L753-Q757 PolarHBondContact O-N 2.7Å |
| 754 | R | 80.4 | Confident | 75 | Confident | 189 Ų | 189 | 119 Ų | 119 | 71% | 0.713 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.4 | -38.1 | 175.7 | -65.9 | 178.4 | 94.9 | 166.5 | 8.6 | 111.8 | P750 E751 Q757 K758 | P750-R754 WeakPolarHBondContact O-CG 3.38Å; P750-R754 PolarHBondContact O-N 2.73Å; E751-R754 PolarHBondContact O-N 3.2Å; R754-Q757 PolarHBondContact O-N 3.48Å; R754-K758 WeakPolarHBondContact O-CB 3.47Å; R754-K758 PolarHBondContact O-N 2.79Å |
| 755 | L | 78.3 | Confident | 76.5 | Confident | 68 Ų | 68 | 112.8 Ų | 112.8 | 36% | 0.356 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.3 | -41.3 | 177.5 | -150.9 | 69.5 | 0 | 0 | 0 | 111.8 | L737 A740 E751 Q752 L753 K758 A759 | L737-L755 HydrophobicContact CD1-CD1 3.41Å; L737-L755 VanDerWaalsContact CD1-CD1 3.41Å; L737-L755 HydrophobicContact CD1-CG 3.64Å; A740-L755 HydrophobicContact CB-CD2 3.54Å; E751-L755 WeakPolarHBondContact O-CB 3.31Å; E751-L755 PolarHBondContact O-N 2.8Å; Q752-L755 PolarHBondContact O-N 3.22Å; L753-L755 VanDerWaalsContact C-N 3.35Å; L755-K758 PolarHBondContact O-N 3.47Å; L755-A759 PolarHBondContact O-N 3.08Å |
| 756 | K | 81.7 | Confident | 77.8 | Confident | 93 Ų | 93 | 112 Ų | 112 | 40% | 0.404 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.3 | -36.9 | 173.5 | 173.8 | 175.2 | 158.3 | -167.7 | 0 | 112.7 | A741 E748 Q752 L753 K760 | A741-K756 HydrophobicContact CB-CB 4.23Å; E748-K756 IonicContact OE1-NZ 3.46Å; E748-K756 PolarHBondContact OE1-NZ 2.99Å; Q752-K756 VanDerWaalsContact O-CB 3.24Å; Q752-K756 WeakPolarHBondContact O-CB 3.27Å; Q752-K756 PolarHBondContact O-N 2.68Å; L753-K756 PolarHBondContact O-N 3.47Å; K756-K760 PolarHBondContact O-N 3Å |
| 757 | Q | 83.7 | Confident | 79.6 | Confident | 127 Ų | 127 | 104.7 Ų | 104.7 | 59% | 0.593 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.6 | -49.5 | 169.8 | -179.3 | 176.2 | -10.4 | 0 | 0 | 111.4 | L753 R754 A759 K760 E761 | L753-Q757 PolarHBondContact O-N 2.7Å; R754-Q757 PolarHBondContact O-N 3.48Å; Q757-A759 VanDerWaalsContact C-N 3.28Å; Q757-A759 PolarHBondContact O-N 3.32Å; Q757-K760 PolarHBondContact O-N 2.89Å; Q757-K760 VanDerWaalsContact O-N 3.1Å; Q757-E761 PolarHBondContact O-N 3.43Å |
| 758 | K | 85.4 | Confident | 81.2 | Confident | 126 Ų | 126 | 99.1 Ų | 99.1 | 55% | 0.548 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -58.3 | -38.1 | 178.2 | -167.8 | -174 | 176.9 | -172.9 | 0 | 112.1 | L737 R754 L755 M762 | L737-K758 HydrophobicContact CD1-CD 4.11Å; L737-K758 HydrophobicContact CD2-CB 4.23Å; L737-K758 HydrophobicContact CD2-CD 4.15Å; L737-K758 HydrophobicContact CD2-CG 3.95Å; R754-K758 WeakPolarHBondContact O-CB 3.47Å; R754-K758 PolarHBondContact O-N 2.79Å; L755-K758 PolarHBondContact O-N 3.47Å; K758-M762 WeakPolarHBondContact O-CB 3.32Å; K758-M762 PolarHBondContact O-N 3.03Å |
| 759 | A | 82.9 | Confident | 83 | Confident | 9 Ų | 9 | 98.6 Ų | 98.6 | 7% | 0.074 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -63 | -44.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L737 A741 L755 Q757 Q763 | L737-A759 HydrophobicContact CD2-CB 4.12Å; L737-A759 HydrophobicContact CG-CB 4.11Å; A741-A759 HydrophobicContact CB-CB 3.63Å; L755-A759 PolarHBondContact O-N 3.08Å; Q757-A759 VanDerWaalsContact C-N 3.28Å; Q757-A759 PolarHBondContact O-N 3.32Å; A759-Q763 WeakPolarHBondContact O-CB 3.36Å; A759-Q763 PolarHBondContact O-N 2.99Å |
| 760 | K | 86.4 | Confident | 83.9 | Confident | 152 Ų | 152 | 97.2 Ų | 97.2 | 66% | 0.661 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -66.2 | -40.8 | 177.7 | -172.6 | -178.2 | 177.9 | -174.3 | 0 | 112.1 | K756 Q757 Q763 Q764 | K756-K760 PolarHBondContact O-N 3Å; Q757-K760 PolarHBondContact O-N 2.89Å; Q757-K760 VanDerWaalsContact O-N 3.1Å; K760-Q763 PolarHBondContact O-N 3.15Å; K760-Q764 WeakPolarHBondContact O-CB 3.41Å; K760-Q764 PolarHBondContact O-N 2.79Å |
| 761 | E | 87.9 | Confident | 84.8 | Confident | 121 Ų | 121 | 101.6 Ų | 101.6 | 57% | 0.565 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -63.7 | -46.9 | 176.7 | -175.5 | 177.7 | 176.3 | 0 | 0 | 111.6 | Q757 Q763 Q764 L765 | Q757-E761 PolarHBondContact O-N 3.43Å; E761-Q763 PolarHBondContact O-N 3.37Å; E761-Q764 WeakPolarHBondContact O-CB 3.42Å; E761-Q764 PolarHBondContact O-N 3.39Å; E761-Q764 VanDerWaalsContact O-N 3.17Å; E761-L765 WeakPolarHBondContact O-CB 3.41Å; E761-L765 PolarHBondContact O-N 2.72Å |
| 762 | M | 82.2 | Confident | 85.7 | Confident | 54 Ų | 54 | 100.5 Ų | 100.5 | 27% | 0.266 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -65.9 | -36.1 | 177.3 | 178.7 | -106.6 | -77.9 | 0 | 0 | 112.6 | R734 L737 K758 L765 E766 | R734-M762 HydrophobicContact CB-CE 3.57Å; R734-M762 HydrophobicContact CB-SD 4.1Å; R734-M762 HydrophobicContact CG-CE 3.63Å; R734-M762 HydrophobicContact CG-SD 3.68Å; R734-M762 PolarHBondContact NH1-SD 3.45Å; L737-M762 HydrophobicContact CB-CE 4.36Å; L737-M762 HydrophobicContact CD2-CE 3.64Å; K758-M762 WeakPolarHBondContact O-CB 3.32Å; K758-M762 PolarHBondContact O-N 3.03Å; M762-L765 PolarHBondContact O-N 2.89Å; M762-E766 WeakPolarHBondContact O-CB 3.3Å; M762-E766 PolarHBondContact O-N 3.02Å |
| 763 | Q | 84.8 | Confident | 86.6 | Confident | 99 Ų | 99 | 105.2 Ų | 105.2 | 46% | 0.463 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.5 | -40.8 | 170.9 | -172.7 | 179.7 | 36.2 | 0 | 0 | 112 | A759 K760 E761 L767 | A759-Q763 WeakPolarHBondContact O-CB 3.36Å; A759-Q763 PolarHBondContact O-N 2.99Å; K760-Q763 PolarHBondContact O-N 3.15Å; E761-Q763 PolarHBondContact O-N 3.37Å; Q763-L767 HydrophobicContact CG-CD1 4.36Å; Q763-L767 WeakPolarHBondContact O-CG 3.4Å; Q763-L767 PolarHBondContact O-N 2.86Å; Q763-L767 VanDerWaalsContact O-N 3.08Å |
| 764 | Q | 89.9 | Confident | 87.3 | Confident | 139 Ų | 139 | 106.3 Ų | 106.3 | 65% | 0.65 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -66.8 | -40.5 | 176.8 | -174.6 | 174.1 | 8.2 | 0 | 0 | 112 | K760 E761 L767 A768 | K760-Q764 WeakPolarHBondContact O-CB 3.41Å; K760-Q764 PolarHBondContact O-N 2.79Å; E761-Q764 WeakPolarHBondContact O-CB 3.42Å; E761-Q764 PolarHBondContact O-N 3.39Å; E761-Q764 VanDerWaalsContact O-N 3.17Å; Q764-L767 PolarHBondContact O-N 3.35Å; Q764-A768 WeakPolarHBondContact O-CB 3.45Å; Q764-A768 PolarHBondContact O-N 2.73Å |
| 765 | L | 89.9 | Confident | 87.9 | Confident | 119 Ų | 119 | 99.9 Ų | 99.9 | 62% | 0.623 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -64.7 | -42.6 | 177.3 | -178.2 | 63.2 | 0 | 0 | 0 | 112 | E761 M762 A768 Q769 | E761-L765 WeakPolarHBondContact O-CB 3.41Å; E761-L765 PolarHBondContact O-N 2.72Å; M762-L765 PolarHBondContact O-N 2.89Å; L765-A768 PolarHBondContact O-N 3.22Å; L765-Q769 WeakPolarHBondContact O-CB 3.48Å; L765-Q769 PolarHBondContact O-N 3.03Å |
| 766 | E | 86.8 | Confident | 88.6 | Confident | 60 Ų | 60 | 101.1 Ų | 101.1 | 28% | 0.28 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.4 | -48.6 | 174.4 | 177.4 | -160.6 | -129.7 | 0 | 0 | 111.6 | R734 M762 A768 Q769 I770 | R734-E766 IonicContact CZ-OE1 3.67Å; R734-E766 IonicContact CZ-OE2 2.82Å; R734-E766 IonicContact NE-OE1 2.87Å; R734-E766 IonicContact NH1-OE1 2.68Å; R734-E766 PolarHBondContact NH1-OE1 3.41Å; R734-E766 IonicContact NH1-OE2 2.7Å; R734-E766 PolarHBondContact NH1-OE2 3.23Å; R734-E766 IonicContact NH2-OE1 3.13Å; R734-E766 PolarHBondContact NH2-OE1 3.27Å; R734-E766 IonicContact NH2-OE2 3.53Å; R734-E766 PolarHBondContact NH2-OE2 2.9Å; M762-E766 WeakPolarHBondContact O-CB 3.3Å; M762-E766 PolarHBondContact O-N 3.02Å; E766-A768 VanDerWaalsContact C-N 3.25Å; E766-A768 PolarHBondContact O-N 3.28Å; E766-Q769 CarbonylContact O-C 3.56Å; E766-Q769 WeakPolarHBondContact O-CA 3.45Å; E766-Q769 WeakPolarHBondContact O-CB 3.32Å; E766-Q769 PolarHBondContact O-N 3.28Å; E766-I770 HydrophobicContact CG-CD1 3.88Å; E766-I770 HydrophobicContact CG-CG1 4.38Å; E766-I770 WeakPolarHBondContact O-CG1 3.44Å; E766-I770 PolarHBondContact O-N 2.87Å |
| 767 | L | 89.3 | Confident | 89.1 | Confident | 103 Ų | 103 | 102.5 Ų | 102.5 | 54% | 0.539 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60 | -36.9 | 177.5 | -74.5 | 169.5 | 0 | 0 | 0 | 112 | Q763 Q764 R771 | Q763-L767 HydrophobicContact CG-CD1 4.36Å; Q763-L767 WeakPolarHBondContact O-CG 3.4Å; Q763-L767 PolarHBondContact O-N 2.86Å; Q763-L767 VanDerWaalsContact O-N 3.08Å; Q764-L767 PolarHBondContact O-N 3.35Å; L767-R771 WeakPolarHBondContact O-CB 3.47Å; L767-R771 PolarHBondContact O-N 2.89Å |
| 768 | A | 88.5 | Confident | 89.5 | Confident | 55 Ų | 55 | 100.9 Ų | 100.9 | 46% | 0.455 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.1 | -40.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q764 L765 E766 R771 Q772 | Q764-A768 WeakPolarHBondContact O-CB 3.45Å; Q764-A768 PolarHBondContact O-N 2.73Å; L765-A768 PolarHBondContact O-N 3.22Å; E766-A768 VanDerWaalsContact C-N 3.25Å; E766-A768 PolarHBondContact O-N 3.28Å; A768-R771 PolarHBondContact O-N 3.09Å; A768-Q772 WeakPolarHBondContact O-CB 3.28Å; A768-Q772 PolarHBondContact O-N 3.48Å |
| 769 | Q | 92.3 | Very high | 89.7 | Confident | 98 Ų | 98 | 97.1 Ų | 97.1 | 46% | 0.458 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -67.9 | -38.9 | 177.3 | -167.7 | -165.4 | 94.9 | 0 | 0 | 112.3 | L765 E766 Q772 R773 | L765-Q769 WeakPolarHBondContact O-CB 3.48Å; L765-Q769 PolarHBondContact O-N 3.03Å; E766-Q769 CarbonylContact O-C 3.56Å; E766-Q769 WeakPolarHBondContact O-CA 3.45Å; E766-Q769 WeakPolarHBondContact O-CB 3.32Å; E766-Q769 PolarHBondContact O-N 3.28Å; Q769-Q772 PolarHBondContact O-N 2.98Å; Q769-R773 WeakPolarHBondContact O-CB 3.46Å; Q769-R773 PolarHBondContact O-N 3.12Å |
| 770 | I | 90.4 | Very high | 89.7 | Confident | 56 Ų | 56 | 102.5 Ų | 102.5 | 29% | 0.287 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.9 | -53.7 | 173 | -69.7 | 168.6 | 0 | 0 | 0 | 109.2 | E766 Q772 R773 E774 | E766-I770 HydrophobicContact CG-CD1 3.88Å; E766-I770 HydrophobicContact CG-CG1 4.38Å; E766-I770 WeakPolarHBondContact O-CG1 3.44Å; E766-I770 PolarHBondContact O-N 2.87Å; I770-Q772 VanDerWaalsContact C-N 3.25Å; I770-Q772 PolarHBondContact O-N 3.23Å; I770-R773 WeakPolarHBondContact O-CB 3.46Å; I770-R773 PolarHBondContact O-N 2.8Å; I770-E774 HydrophobicContact CG2-CG 4.32Å; I770-E774 WeakPolarHBondContact CG2-OE1 3.14Å; I770-E774 WeakPolarHBondContact O-CG 3.4Å; I770-E774 PolarHBondContact O-N 3.43Å |
| 771 | R | 93.5 | Very high | 89.6 | Confident | 191 Ų | 191 | 99 Ų | 99 | 72% | 0.721 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -55 | -39.1 | 175.3 | 173 | 177.4 | -79.8 | -176.5 | -6.1 | 112.6 | L767 A768 A775 | L767-R771 WeakPolarHBondContact O-CB 3.47Å; L767-R771 PolarHBondContact O-N 2.89Å; A768-R771 PolarHBondContact O-N 3.09Å; R771-A775 VanDerWaalsContact O-CB 3.27Å; R771-A775 WeakPolarHBondContact O-CB 3.42Å; R771-A775 PolarHBondContact O-N 3.33Å |
| 772 | Q | 93 | Very high | 89.5 | Confident | 123 Ų | 123 | 97.3 Ų | 97.3 | 58% | 0.575 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -68.2 | -40.7 | 176.9 | -169.5 | -178.4 | 30.8 | 0 | 0 | 111.9 | A768 Q769 I770 A775 N776 | A768-Q772 WeakPolarHBondContact O-CB 3.28Å; A768-Q772 PolarHBondContact O-N 3.48Å; Q769-Q772 PolarHBondContact O-N 2.98Å; I770-Q772 VanDerWaalsContact C-N 3.25Å; I770-Q772 PolarHBondContact O-N 3.23Å; Q772-A775 PolarHBondContact O-N 3.45Å; Q772-N776 WeakPolarHBondContact O-CB 3.49Å; Q772-N776 VanDerWaalsContact O-CG 3.25Å; Q772-N776 PolarHBondContact O-N 2.89Å; Q772-N776 PolarHBondContact O-ND2 3.13Å |
| 773 | R | 93.2 | Very high | 89.3 | Confident | 140 Ų | 140 | 99.8 Ų | 99.8 | 53% | 0.528 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.2 | -42.1 | 176.2 | -168 | -173.3 | -67.1 | 110.4 | -2 | 111.3 | Q769 I770 N776 L777 | Q769-R773 WeakPolarHBondContact O-CB 3.46Å; Q769-R773 PolarHBondContact O-N 3.12Å; I770-R773 WeakPolarHBondContact O-CB 3.46Å; I770-R773 PolarHBondContact O-N 2.8Å; R773-N776 PolarHBondContact O-N 3.34Å; R773-L777 WeakPolarHBondContact O-CB 3.35Å; R773-L777 PolarHBondContact O-N 3.35Å |
| 774 | E | 91.9 | Very high | 88.8 | Confident | 110 Ų | 110 | 96.8 Ų | 96.8 | 51% | 0.514 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.2 | -45.5 | 173.6 | -70.4 | 169.7 | 163.6 | 0 | 0 | 112 | I770 N776 L777 T778 | I770-E774 HydrophobicContact CG2-CG 4.32Å; I770-E774 WeakPolarHBondContact CG2-OE1 3.14Å; I770-E774 WeakPolarHBondContact O-CG 3.4Å; I770-E774 PolarHBondContact O-N 3.43Å; E774-N776 VanDerWaalsContact C-N 3.34Å; E774-N776 PolarHBondContact O-N 2.95Å; E774-L777 PolarHBondContact O-N 2.87Å; E774-T778 WeakPolarHBondContact O-CB 3.45Å; E774-T778 PolarHBondContact O-N 3.11Å; E774-T778 PolarHBondContact O-OG1 3.03Å |
| 775 | A | 92.9 | Very high | 87.8 | Confident | 54 Ų | 54 | 96.8 Ų | 96.8 | 45% | 0.446 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.6 | -41.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | R771 Q772 T778 A779 | R771-A775 VanDerWaalsContact O-CB 3.27Å; R771-A775 WeakPolarHBondContact O-CB 3.42Å; R771-A775 PolarHBondContact O-N 3.33Å; Q772-A775 PolarHBondContact O-N 3.45Å; A775-T778 PolarHBondContact O-N 2.61Å; A775-A779 VanDerWaalsContact O-CB 3.32Å; A775-A779 WeakPolarHBondContact O-CB 3.38Å; A775-A779 PolarHBondContact O-N 3.03Å |
| 776 | N | 93.1 | Very high | 86.4 | Confident | 94 Ų | 94 | 101.2 Ų | 101.2 | 50% | 0.503 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.8 | -42.6 | 174.7 | -74 | -22.5 | 0 | 0 | 0 | 112.2 | Q772 R773 E774 A779 L780 | Q772-N776 WeakPolarHBondContact O-CB 3.49Å; Q772-N776 VanDerWaalsContact O-CG 3.25Å; Q772-N776 PolarHBondContact O-N 2.89Å; Q772-N776 PolarHBondContact O-ND2 3.13Å; R773-N776 PolarHBondContact O-N 3.34Å; E774-N776 VanDerWaalsContact C-N 3.34Å; E774-N776 PolarHBondContact O-N 2.95Å; N776-A779 PolarHBondContact O-N 2.96Å; N776-L780 WeakPolarHBondContact O-CG 3.33Å; N776-L780 PolarHBondContact O-N 3.5Å |
| 777 | L | 92.6 | Very high | 84.8 | Confident | 123 Ų | 123 | 107.7 Ų | 107.7 | 64% | 0.644 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -63.1 | -43.6 | 175.9 | -178.5 | 62.8 | 0 | 0 | 0 | 111.5 | R773 E774 L780 A781 | R773-L777 WeakPolarHBondContact O-CB 3.35Å; R773-L777 PolarHBondContact O-N 3.35Å; E774-L777 PolarHBondContact O-N 2.87Å; L777-L780 PolarHBondContact O-N 3.3Å; L777-A781 PolarHBondContact O-N 3.4Å |
| 778 | T | 91.7 | Very high | 83.1 | Confident | 93 Ų | 93 | 112.1 Ų | 112.1 | 57% | 0.571 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -63.9 | -41.3 | 176.3 | -54.8 | 0 | 0 | 0 | 0 | 111.3 | E774 A775 A781 A782 | E774-T778 WeakPolarHBondContact O-CB 3.45Å; E774-T778 PolarHBondContact O-N 3.11Å; E774-T778 PolarHBondContact O-OG1 3.03Å; A775-T778 PolarHBondContact O-N 2.61Å; T778-A781 PolarHBondContact O-N 3.48Å; T778-A782 VanDerWaalsContact O-CB 3.3Å; T778-A782 WeakPolarHBondContact O-CB 3.42Å; T778-A782 PolarHBondContact O-N 2.85Å |
| 779 | A | 89.8 | Confident | 81.4 | Confident | 47 Ų | 47 | 120.6 Ų | 120.6 | 39% | 0.388 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -63.8 | -42.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A775 N776 A782 I783 | A775-A779 VanDerWaalsContact O-CB 3.32Å; A775-A779 WeakPolarHBondContact O-CB 3.38Å; A775-A779 PolarHBondContact O-N 3.03Å; N776-A779 PolarHBondContact O-N 2.96Å; A779-A782 PolarHBondContact O-N 3.3Å; A779-I783 WeakPolarHBondContact O-CD1 3.39Å; A779-I783 WeakPolarHBondContact O-CG1 3.42Å; A779-I783 PolarHBondContact O-N 2.94Å |
| 780 | L | 83.7 | Confident | 78.7 | Confident | 122 Ų | 122 | 127 Ų | 127 | 64% | 0.639 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -63.4 | -41 | 175.2 | -72.5 | 169.6 | 0 | 0 | 0 | 112.1 | N776 L777 | N776-L780 WeakPolarHBondContact O-CG 3.33Å; N776-L780 PolarHBondContact O-N 3.5Å; L777-L780 PolarHBondContact O-N 3.3Å |
| 781 | A | 85.1 | Confident | 76.7 | Confident | 79 Ų | 79 | 130.6 Ų | 130.6 | 65% | 0.653 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -63.4 | -43.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L777 T778 G784 | L777-A781 PolarHBondContact O-N 3.4Å; T778-A781 PolarHBondContact O-N 3.48Å; A781-G784 PolarHBondContact O-N 3.4Å |
| 782 | A | 83.9 | Confident | 73.8 | Confident | 85 Ų | 85 | 128.9 Ų | 128.9 | 70% | 0.702 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -71.1 | -26.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | T778 A779 G784 | T778-A782 VanDerWaalsContact O-CB 3.3Å; T778-A782 WeakPolarHBondContact O-CB 3.42Å; T778-A782 PolarHBondContact O-N 2.85Å; A779-A782 PolarHBondContact O-N 3.3Å; A782-G784 VanDerWaalsContact C-N 3.28Å |
| 783 | I | 77.9 | Confident | 70.9 | Confident | 106 Ų | 106 | 128.3 Ų | 128.3 | 54% | 0.544 | 67% | 0.67 | S | S | . | * | H | α-helix | trans | -66.3 | -33.3 | 172.4 | -75.3 | 162.3 | 0 | 0 | 0 | 111.2 | A779 | A779-I783 WeakPolarHBondContact O-CD1 3.39Å; A779-I783 WeakPolarHBondContact O-CG1 3.42Å; A779-I783 PolarHBondContact O-N 2.94Å |
| 784 | G | 74.9 | Confident | 68.6 | Low | 35 Ų | 35 | 127.6 Ų | 127.6 | 36% | 0.361 | 68% | 0.684 | S | S | . | * | trans | 61.7 | -174.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | A781 A782 R786 | A781-G784 PolarHBondContact O-N 3.4Å; A782-G784 VanDerWaalsContact C-N 3.28Å; G784-R786 VanDerWaalsContact C-N 3.25Å; G784-R786 PolarHBondContact O-N 3.5Å | ||
| 785 | P | 68.9 | Low | 66.1 | Low | 139 Ų | 139 | 130.5 Ų | 130.5 | 90% | 0.903 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -69.6 | 76.8 | 175.1 | -19.9 | 34.5 | 0 | 0 | 0 | 111.9 | K787 | P785-K787 VanDerWaalsContact C-N 3.34Å; P785-K787 PolarHBondContact O-N 2.92Å |
| 786 | R | 60.8 | Low | 63.3 | Low | 212 Ų | 212 | 133.4 Ų | 133.4 | 80% | 0.8 | 72% | 0.719 | S | S | * | * | trans | -68.8 | 84 | -172.8 | -167.2 | 175.7 | -177.6 | -177.9 | 1.8 | 112.6 | G784 K788 | G784-R786 VanDerWaalsContact C-N 3.25Å; G784-R786 PolarHBondContact O-N 3.5Å; R786-K788 PolarHBondContact O-N 3.24Å | ||
| 787 | K | 53.2 | Low | 60.6 | Low | 197 Ų | 197 | 132.1 Ų | 132.1 | 86% | 0.857 | 73% | 0.728 | S | S | * | * | trans | -48.4 | 107.7 | 167.5 | -173.4 | 173.9 | -175.8 | 175.2 | 0 | 108.9 | P785 R789 | P785-K787 VanDerWaalsContact C-N 3.34Å; P785-K787 PolarHBondContact O-N 2.92Å; K787-R789 PolarHBondContact O-N 3.22Å | ||
| 788 | K | 53.4 | Low | 57.9 | Low | 196 Ų | 196 | 131.4 Ų | 131.4 | 85% | 0.852 | 74% | 0.74 | S | S | * | * | trans | -64.2 | 94 | 178.2 | -77.8 | -166.8 | 176.4 | -174.3 | 0 | 109.6 | R786 R790 | R786-K788 PolarHBondContact O-N 3.24Å; K788-R790 PolarHBondContact O-N 3.02Å | ||
| 789 | R | 53.9 | Low | 55.2 | Low | 232 Ų | 232 | 132.3 Ų | 132.3 | 88% | 0.875 | 75% | 0.75 | S | S | * | * | trans | -57.2 | 122.8 | 163.3 | -163.2 | -173.6 | -62.2 | 176.4 | 0.5 | 106.5 | K787 T791 | K787-R789 PolarHBondContact O-N 3.22Å; R789-T791 PolarHBondContact O-N 3.23Å | ||
| 790 | R | 34.4 | Very low | 52.6 | Low | 233 Ų | 233 | 134.7 Ų | 134.7 | 88% | 0.879 | 77% | 0.77 | S | S | * | * | trans | -68.3 | 113.4 | 173.8 | -68.5 | -74.2 | -174.8 | 162.5 | 2.2 | 107.1 | K788 D792 | K788-R790 PolarHBondContact O-N 3.02Å; R790-D792 PolarHBondContact O-N 3.48Å | ||
| 791 | T | 47.8 | Very low | 50.4 | Low | 132 Ų | 132 | 137.6 Ų | 137.6 | 81% | 0.81 | 78% | 0.78 | S | S | * | * | trans | -75.5 | 97.7 | 160.7 | -52.6 | 0 | 0 | 0 | 0 | 106 | R789 | R789-T791 PolarHBondContact O-N 3.23Š| ||
| 792 | D | 34.2 | Very low | 47.9 | Very low | 154 Ų | 154 | 137.5 Ų | 137.5 | 82% | 0.824 | 79% | 0.786 | S | S | * | * | trans | 166.3 | 90.3 | 154.5 | -84.4 | -22.3 | 0 | 0 | 0 | 109.9 | R790 | R790-D792 PolarHBondContact O-N 3.48Š| ||
| 793 | S | 31.2 | Very low | 45.7 | Very low | 112 Ų | 112 | 139.5 Ų | 139.5 | 78% | 0.783 | 80% | 0.795 | S | S | * | * | trans | -170.6 | 136 | 155.6 | -176.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 794 | P | 44.4 | Very low | 43.4 | Very low | 125 Ų | 125 | 138.3 Ų | 138.3 | 81% | 0.812 | 81% | 0.809 | S | S | * | * | trans | -74.2 | 173.8 | 171.6 | 31.9 | -34.7 | 0 | 0 | 0 | 112.9 | ||||
| 795 | L | 39.4 | Very low | 41.5 | Very low | 170 Ų | 170 | 145.7 Ų | 145.7 | 89% | 0.89 | 84% | 0.839 | S | S | * | * | trans | -79.6 | 140.9 | -164.1 | 180 | 68.3 | 0 | 0 | 0 | 115.3 | ||||
| 796 | S | 34.3 | Very low | 39.7 | Very low | 115 Ų | 115 | 143 Ų | 143 | 80% | 0.804 | 84% | 0.836 | S | S | * | * | trans | -153.6 | 158 | 140.5 | -162 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 797 | G | 36.1 | Very low | 38.7 | Very low | 68 Ų | 68 | 138.8 Ų | 138.8 | 70% | 0.701 | 84% | 0.839 | S | S | * | * | trans | -86 | -174.2 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 798 | A | 36 | Very low | 37.6 | Very low | 108 Ų | 108 | 135.1 Ų | 135.1 | 89% | 0.893 | 84% | 0.838 | S | S | * | * | cis | -153.8 | -179 | 7.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 799 | S | 35.3 | Very low | 36.9 | Very low | 112 Ų | 112 | 134.7 Ų | 134.7 | 78% | 0.783 | 84% | 0.839 | S | S | * | * | trans | -46.1 | 144.4 | -173.2 | -171.7 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 800 | A | 36 | Very low | 36.8 | Very low | 97 Ų | 97 | 129.3 Ų | 129.3 | 80% | 0.802 | 84% | 0.835 | S | S | * | * | trans | -159.6 | 144.6 | 132.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 801 | E | 37.8 | Very low | 36.7 | Very low | 183 Ų | 183 | 121.9 Ų | 121.9 | 86% | 0.855 | 83% | 0.831 | S | S | * | * | trans | -87.7 | 160.2 | -177.7 | -77.2 | -72.8 | 133.1 | 0 | 0 | 113.7 | ||||
| 802 | G | 32 | Very low | 36.4 | Very low | 76 Ų | 76 | 119.8 Ų | 119.8 | 78% | 0.784 | 84% | 0.835 | S | S | * | * | trans | 164.6 | 96.7 | 169.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 803 | S | 36.8 | Very low | 36.4 | Very low | 128 Ų | 128 | 118.1 Ų | 118.1 | 90% | 0.895 | 84% | 0.836 | S | S | * | * | trans | -91.8 | 146.8 | 177 | -72.1 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 804 | G | 29.8 | Very low | 37.1 | Very low | 80 Ų | 80 | 118.1 Ų | 118.1 | 83% | 0.825 | 84% | 0.836 | S | S | * | * | trans | -174.8 | 124.5 | 170.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 805 | L | 36.8 | Very low | 36.6 | Very low | 191 Ų | 191 | 115.8 Ų | 115.8 | 100% | 1 | 83% | 0.834 | S | S | * | * | trans | -102.6 | 145.5 | 177.7 | -79.4 | 159.2 | 0 | 0 | 0 | 111 | ||||
| 806 | G | 29.1 | Very low | 37 | Very low | 81 Ų | 81 | 117.2 Ų | 117.2 | 84% | 0.835 | 84% | 0.836 | S | S | * | * | trans | -164.2 | 134.8 | 172 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 807 | S | 39.7 | Very low | 37 | Very low | 124 Ų | 124 | 115 Ų | 115 | 87% | 0.867 | 83% | 0.832 | S | S | * | * | trans | -123.7 | 137 | -171.3 | 178.5 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 808 | S | 30.9 | Very low | 36.9 | Very low | 120 Ų | 120 | 117 Ų | 117 | 84% | 0.839 | 84% | 0.835 | S | S | * | * | trans | -168.4 | 156.6 | 147.4 | 48.2 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 809 | Q | 38.3 | Very low | 37.2 | Very low | 187 Ų | 187 | 123.4 Ų | 123.4 | 87% | 0.874 | 84% | 0.836 | S | S | * | * | trans | -63.8 | -173.9 | -164 | -105.2 | 179.7 | -111 | 0 | 0 | 118.4 | ||||
| 810 | P | 53 | Low | 37.6 | Very low | 119 Ų | 119 | 126 Ų | 126 | 77% | 0.773 | 84% | 0.836 | S | S | * | * | trans | -92 | 156.4 | -157.6 | 37.2 | -37.9 | 0 | 0 | 0 | 115.3 | ||||
| 811 | G | 31.8 | Very low | 37.8 | Very low | 78 Ų | 78 | 131.1 Ų | 131.1 | 80% | 0.804 | 84% | 0.84 | S | S | * | * | trans | -148.1 | 135.7 | 162.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 812 | G | 41.6 | Very low | 38.3 | Very low | 87 Ų | 87 | 131.5 Ų | 131.5 | 90% | 0.897 | 84% | 0.844 | S | S | * | * | trans | -84.6 | 139.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 813 | S | 34.8 | Very low | 39.2 | Very low | 120 Ų | 120 | 138.7 Ų | 138.7 | 84% | 0.839 | 85% | 0.848 | S | S | * | * | trans | -152.4 | 143.2 | 158.5 | -171 | 0 | 0 | 0 | 0 | 110.7 | G815 | S813-G815 PolarHBondContact O-N 3.23Å; S813-G815 VanDerWaalsContact O-N 3.13Å | ||
| 814 | S | 45.9 | Very low | 40 | Very low | 112 Ų | 112 | 141.2 Ų | 141.2 | 78% | 0.783 | 85% | 0.846 | S | S | * | * | trans | -77 | 92.3 | -175.6 | 51.2 | 0 | 0 | 0 | 0 | 111.8 | Q816 | S814-Q816 PolarHBondContact O-N 3.06Å; S814-Q816 VanDerWaalsContact O-N 3.12Å | ||
| 815 | G | 33.1 | Very low | 41.7 | Very low | 75 Ų | 75 | 147 Ų | 147 | 77% | 0.773 | 84% | 0.842 | S | S | * | * | trans | -73.3 | 95.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | S813 G817 | S813-G815 PolarHBondContact O-N 3.23Å; S813-G815 VanDerWaalsContact O-N 3.13Å; G815-G817 PolarHBondContact O-N 2.85Å | ||
| 816 | Q | 47.5 | Very low | 43.8 | Very low | 201 Ų | 201 | 145 Ų | 145 | 94% | 0.939 | 83% | 0.831 | S | S | * | * | trans | -59.4 | 117.5 | 166.9 | -69.6 | -176.7 | -5.9 | 0 | 0 | 109.4 | S814 | S814-Q816 PolarHBondContact O-N 3.06Å; S814-Q816 VanDerWaalsContact O-N 3.12Å | ||
| 817 | G | 34.2 | Very low | 46.3 | Very low | 68 Ų | 68 | 143.8 Ų | 143.8 | 70% | 0.701 | 81% | 0.808 | S | S | * | * | trans | -142.6 | 109.4 | -168.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | G815 | G815-G817 PolarHBondContact O-N 2.85Š| ||
| 818 | S | 34 | Very low | 48.7 | Very low | 111 Ų | 111 | 147.3 Ų | 147.3 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | trans | 65.4 | 102.4 | 175.8 | -160.3 | 0 | 0 | 0 | 0 | 115.8 | Q820 | S818-Q820 PolarHBondContact O-N 2.93Š| ||
| 819 | R | 42.9 | Very low | 51.5 | Low | 242 Ų | 242 | 144.5 Ų | 144.5 | 91% | 0.913 | 78% | 0.78 | S | S | * | * | trans | -60.1 | 105.9 | 157.7 | -64.2 | 178.4 | -172.5 | -104.1 | 2.4 | 107.4 | F821 | R819-F821 PolarHBondContact O-N 3.03Š| ||
| 820 | Q | 43.3 | Very low | 54 | Low | 166 Ų | 166 | 139.3 Ų | 139.3 | 78% | 0.776 | 76% | 0.758 | S | S | * | * | trans | -62.3 | 125.6 | 168.2 | -65.7 | -164.2 | 10.4 | 0 | 0 | 107.8 | S818 M822 | S818-Q820 PolarHBondContact O-N 2.93Å; Q820-M822 PolarHBondContact O-N 3.43Å | ||
| 821 | F | 41 | Very low | 55.8 | Low | 204 Ų | 204 | 138.4 Ų | 138.4 | 90% | 0.895 | 75% | 0.746 | S | S | * | * | trans | -52.5 | 127.5 | 170.3 | -73.2 | -92.7 | 0 | 0 | 0 | 108.4 | R819 R823 | R819-F821 PolarHBondContact O-N 3.03Å; F821-R823 PolarHBondContact O-N 3.34Å | ||
| 822 | M | 48.2 | Very low | 58.7 | Low | 191 Ų | 191 | 144.9 Ų | 144.9 | 94% | 0.941 | 75% | 0.746 | S | S | * | * | trans | -67.6 | 63.9 | 175.8 | -78.6 | -83.7 | -156.5 | 0 | 0 | 110.6 | Q820 Q824 | Q820-M822 PolarHBondContact O-N 3.43Å; M822-Q824 PolarHBondContact O-N 2.89Å | ||
| 823 | R | 50 | Low | 61.1 | Low | 227 Ų | 227 | 141.1 Ų | 141.1 | 86% | 0.857 | 71% | 0.706 | S | S | * | * | trans | -66.2 | 98.9 | 168.6 | -164.9 | -176.4 | -152.2 | -76.4 | 0.4 | 105.6 | F821 R825 | F821-R823 PolarHBondContact O-N 3.34Å; R823-R825 PolarHBondContact O-N 2.9Å | ||
| 824 | Q | 53.7 | Low | 63.8 | Low | 182 Ų | 182 | 138.3 Ų | 138.3 | 85% | 0.85 | 68% | 0.681 | S | S | * | * | trans | -40.4 | 106.7 | -172.4 | -71.6 | 178.5 | -14.7 | 0 | 0 | 110.4 | M822 I826 | M822-Q824 PolarHBondContact O-N 2.89Å; Q824-I826 PolarHBondContact O-N 3.44Å | ||
| 825 | R | 65.9 | Low | 66.1 | Low | 200 Ų | 200 | 134 Ų | 134 | 76% | 0.755 | 65% | 0.649 | S | S | * | * | trans | -75 | 101.8 | -176.8 | -179.1 | -178.3 | -77 | -175.1 | -0.6 | 106.7 | R823 T827 | R823-R825 PolarHBondContact O-N 2.9Å; R825-T827 PolarHBondContact O-N 3.33Å; R825-T827 PolarHBondContact O-OG1 2.95Å | ||
| 826 | I | 79.9 | Confident | 68.9 | Low | 149 Ų | 149 | 133.9 Ų | 133.9 | 76% | 0.764 | 63% | 0.63 | S | S | * | * | trans | -50.7 | 106.9 | 178.6 | -59.2 | 174.7 | 0 | 0 | 0 | 108.4 | Q824 R828 | Q824-I826 PolarHBondContact O-N 3.44Å; I826-R828 PolarHBondContact O-N 2.91Å | ||
| 827 | T | 83.1 | Confident | 71 | Confident | 57 Ų | 57 | 124.8 Ų | 124.8 | 35% | 0.35 | 59% | 0.589 | S | S | . | * | trans | -77.8 | 109.1 | -177.7 | -68.6 | 0 | 0 | 0 | 0 | 107.7 | A692 Q693 R825 V829 | A692-T827 HydrophobicContact CB-CG2 3.72Å; Q693-T827 HydrophobicContact CG-CG2 4.18Å; R825-T827 PolarHBondContact O-N 3.33Å; R825-T827 PolarHBondContact O-OG1 2.95Å; T827-V829 PolarHBondContact O-N 3.14Å | ||
| 828 | R | 88.6 | Confident | 73.8 | Confident | 197 Ų | 197 | 122 Ų | 122 | 74% | 0.743 | 56% | 0.558 | S | S | * | * | trans | -82.3 | 113.7 | -179.6 | -68 | -174.8 | 174.7 | -163.1 | -3.8 | 109.7 | I826 N830 | I826-R828 PolarHBondContact O-N 2.91Å; R828-N830 PolarHBondContact O-ND2 3.05Å | ||
| 829 | V | 91 | Very high | 76.7 | Confident | 62 Ų | 62 | 121.9 Ų | 121.9 | 38% | 0.376 | 55% | 0.545 | S | S | . | . | trans | -69 | 139.2 | 163 | -174.3 | 0 | 0 | 0 | 0 | 108.5 | A688 A692 T827 D833 | A688-V829 HydrophobicContact CB-CG1 3.92Å; A692-V829 HydrophobicContact CB-CB 4.46Å; A692-V829 HydrophobicContact CB-CG2 3.94Å; T827-V829 PolarHBondContact O-N 3.14Å; V829-D833 HydrophobicContact CG1-CB 4.07Å | ||
| 830 | N | 90.7 | Very high | 78.9 | Confident | 78 Ų | 78 | 116.3 Ų | 116.3 | 42% | 0.417 | 53% | 0.533 | S | S | . | . | trans | -123.6 | 163.8 | -177.6 | -51.2 | -101.1 | 0 | 0 | 0 | 109.1 | K695 R828 R832 D833 L834 | K695-N830 PolarHBondContact NZ-ND2 3.25Å; R828-N830 PolarHBondContact O-ND2 3.05Å; N830-R832 PolarHBondContact O-N 3.22Å; N830-D833 WeakPolarHBondContact CB-OD2 3.27Å; N830-D833 PolarHBondContact N-OD2 2.97Å; N830-D833 PolarHBondContact ND2-OD2 3.43Å; N830-D833 WeakPolarHBondContact O-CB 3.42Å; N830-D833 PolarHBondContact O-N 3.12Å; N830-L834 PolarHBondContact O-N 3.34Å | ||
| 831 | L | 91.2 | Very high | 81.2 | Confident | 100 Ų | 100 | 110.5 Ų | 110.5 | 52% | 0.524 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -54 | -39.8 | 177.5 | -179.6 | 59.6 | 0 | 0 | 0 | 112.5 | D833 L834 L835 | L831-D833 VanDerWaalsContact C-N 3.26Å; L831-D833 PolarHBondContact O-N 2.76Å; L831-L834 PolarHBondContact O-N 3.31Å; L831-L835 HydrophobicContact CD1-CD1 4.4Å; L831-L835 HydrophobicContact CD1-CD2 4.49Å; L831-L835 HydrophobicContact CD1-CG 4.15Å; L831-L835 HydrophobicContact CD2-CD1 4.5Å; L831-L835 HydrophobicContact CG-CD1 3.91Å; L831-L835 HydrophobicContact CG-CG 4.16Å; L831-L835 VanDerWaalsContact O-CG 3.29Å; L831-L835 WeakPolarHBondContact O-CG 2.84Å; L831-L835 PolarHBondContact O-N 3.04Å |
| 832 | R | 91.1 | Very high | 83.3 | Confident | 213 Ų | 213 | 111.2 Ų | 111.2 | 80% | 0.804 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.8 | -31.7 | 175.4 | -70.7 | -171.7 | 177.7 | -168.6 | -1.9 | 114.1 | N830 L836 | N830-R832 PolarHBondContact O-N 3.22Å; R832-L836 WeakPolarHBondContact O-CB 3.26Å; R832-L836 PolarHBondContact O-N 3.12Å; R832-L836 VanDerWaalsContact O-N 3.1Å |
| 833 | D | 92.6 | Very high | 85.1 | Confident | 8 Ų | 8 | 107.9 Ų | 107.9 | 4% | 0.043 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -73.1 | -38.6 | 179.9 | -51.7 | -34.9 | 0 | 0 | 0 | 109.9 | V691 K695 V829 N830 L831 C837 | V691-D833 HydrophobicContact CG1-CB 3.92Å; K695-D833 IonicContact NZ-OD1 2.92Å; K695-D833 PolarHBondContact NZ-OD1 2.91Å; K695-D833 IonicContact NZ-OD2 2.85Å; K695-D833 PolarHBondContact NZ-OD2 2.85Å; V829-D833 HydrophobicContact CG1-CB 4.07Å; N830-D833 WeakPolarHBondContact CB-OD2 3.27Å; N830-D833 PolarHBondContact N-OD2 2.97Å; N830-D833 PolarHBondContact ND2-OD2 3.43Å; N830-D833 WeakPolarHBondContact O-CB 3.42Å; N830-D833 PolarHBondContact O-N 3.12Å; L831-D833 VanDerWaalsContact C-N 3.26Å; L831-D833 PolarHBondContact O-N 2.76Å; D833-C837 PolarHBondContact O-N 2.96Å; D833-C837 PolarHBondContact O-SG 2.96Å |
| 834 | L | 91.9 | Very high | 86.8 | Confident | 62 Ų | 62 | 97.4 Ų | 97.4 | 33% | 0.325 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -69.2 | -42.5 | 172.7 | 179.6 | 62.7 | 0 | 0 | 0 | 112.4 | L684 N830 L831 L836 C837 L838 | L684-L834 HydrophobicContact CD1-CD1 4.11Å; L684-L834 HydrophobicContact CD2-CD1 3.98Å; L684-L834 HydrophobicContact CG-CD1 3.89Å; N830-L834 PolarHBondContact O-N 3.34Å; L831-L834 PolarHBondContact O-N 3.31Å; L834-L836 VanDerWaalsContact C-N 3.32Å; L834-L836 PolarHBondContact O-N 2.68Å; L834-C837 WeakPolarHBondContact O-CB 3.13Å; L834-C837 PolarHBondContact O-N 2.96Å; L834-C837 VanDerWaalsContact O-N 3.12Å; L834-L838 HydrophobicContact CD1-CG 4.42Å; L834-L838 HydrophobicContact CG-CD1 4.18Å; L834-L838 HydrophobicContact CG-CG 4.48Å; L834-L838 WeakPolarHBondContact O-CG 3.21Å; L834-L838 PolarHBondContact O-N 3.23Å |
| 835 | L | 93.1 | Very high | 88.5 | Confident | 20 Ų | 20 | 90 Ų | 90 | 11% | 0.105 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -60.4 | -42.2 | 177.7 | -70.6 | 170.8 | 0 | 0 | 0 | 111.3 | L831 C837 L838 E839 L850 L854 | L831-L835 HydrophobicContact CD1-CD1 4.4Å; L831-L835 HydrophobicContact CD1-CD2 4.49Å; L831-L835 HydrophobicContact CD1-CG 4.15Å; L831-L835 HydrophobicContact CD2-CD1 4.5Å; L831-L835 HydrophobicContact CG-CD1 3.91Å; L831-L835 HydrophobicContact CG-CG 4.16Å; L831-L835 VanDerWaalsContact O-CG 3.29Å; L831-L835 WeakPolarHBondContact O-CG 2.84Å; L831-L835 PolarHBondContact O-N 3.04Å; L835-C837 VanDerWaalsContact C-N 3.3Å; L835-C837 PolarHBondContact O-N 2.74Å; L835-L838 PolarHBondContact O-N 3.44Å; L835-E839 WeakPolarHBondContact O-CB 3.18Å; L835-E839 PolarHBondContact O-N 3Å; L835-L850 HydrophobicContact CB-CD1 4.42Å; L835-L850 HydrophobicContact CD2-CD1 3.86Å; L835-L854 HydrophobicContact CD1-CD2 4.45Å |
| 836 | L | 92.6 | Very high | 89.6 | Confident | 73 Ų | 73 | 87.7 Ų | 87.7 | 38% | 0.382 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -62.5 | -36 | 174.8 | -174.8 | 64.9 | 0 | 0 | 0 | 112.1 | V691 R832 L834 E839 N840 | V691-L836 HydrophobicContact CG1-CD2 3.93Å; V691-L836 HydrophobicContact CG2-CD2 4.37Å; R832-L836 WeakPolarHBondContact O-CB 3.26Å; R832-L836 PolarHBondContact O-N 3.12Å; R832-L836 VanDerWaalsContact O-N 3.1Å; L834-L836 VanDerWaalsContact C-N 3.32Å; L834-L836 PolarHBondContact O-N 2.68Å; L836-E839 PolarHBondContact O-N 3.37Å; L836-N840 WeakPolarHBondContact CD1-ND2 3.46Å; L836-N840 PolarHBondContact O-N 3.09Å; L836-N840 VanDerWaalsContact O-N 3.13Å; L836-N840 PolarHBondContact O-ND2 3.08Å |
| 837 | C | 92.9 | Very high | 90 | Very high | 11 Ų | 11 | 82 Ų | 82 | 7% | 0.074 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -69.4 | -40.3 | 175.2 | -62.7 | 0 | 0 | 0 | 0 | 112.1 | L684 N687 A688 D833 L834 L835 E839 N840 D841 | L684-C837 HydrophobicContact CD1-CB 3.8Å; N687-C837 VanDerWaalsContact C-SG 3.56Å; N687-C837 HydrophobicContact CB-CB 4.49Å; A688-C837 WeakPolarHBondContact CA-SG 3.48Å; A688-C837 PolarHBondContact N-SG 3.35Å; A688-C837 VanDerWaalsContact N-SG 3.4Å; D833-C837 PolarHBondContact O-N 2.96Å; D833-C837 PolarHBondContact O-SG 2.96Å; L834-C837 WeakPolarHBondContact O-CB 3.13Å; L834-C837 PolarHBondContact O-N 2.96Å; L834-C837 VanDerWaalsContact O-N 3.12Å; L835-C837 VanDerWaalsContact C-N 3.3Å; L835-C837 PolarHBondContact O-N 2.74Å; C837-E839 VanDerWaalsContact C-N 3.33Å; C837-N840 PolarHBondContact O-N 3.37Å; C837-D841 WeakPolarHBondContact O-CB 3.45Å; C837-D841 PolarHBondContact O-N 3.2Å |
| 838 | L | 92.6 | Very high | 90.3 | Very high | 9 Ų | 9 | 85.8 Ų | 85.8 | 5% | 0.047 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -67.1 | -31.9 | 175 | -67.7 | 172.2 | 0 | 0 | 0 | 112.4 | L684 L834 L835 S844 S845 L849 L850 | L684-L838 HydrophobicContact CD1-CD2 4.13Å; L684-L838 HydrophobicContact CD2-CD2 3.99Å; L834-L838 HydrophobicContact CD1-CG 4.42Å; L834-L838 HydrophobicContact CG-CD1 4.18Å; L834-L838 HydrophobicContact CG-CG 4.48Å; L834-L838 WeakPolarHBondContact O-CG 3.21Å; L834-L838 PolarHBondContact O-N 3.23Å; L835-L838 PolarHBondContact O-N 3.44Å; L838-S844 WeakPolarHBondContact CD2-OG 3.43Å; L838-S844 CarbonylContact O-C 3.51Å; L838-S844 PolarHBondContact O-OG 2.96Å; L838-S845 WeakPolarHBondContact O-CA 3.25Å; L838-S845 PolarHBondContact O-N 2.83Å; L838-L849 HydrophobicContact CD1-CD2 4.26Å; L838-L849 HydrophobicContact CD1-CG 4.34Å; L838-L850 HydrophobicContact CB-CB 4.43Å; L838-L850 HydrophobicContact CB-CD1 4.05Å |
| 839 | E | 93.4 | Very high | 90.2 | Very high | 109 Ų | 109 | 82.1 Ų | 82.1 | 51% | 0.509 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -71.5 | -38 | 176.4 | -176.5 | 173.3 | -152.7 | 0 | 0 | 112.4 | L835 L836 C837 S845 L850 | L835-E839 WeakPolarHBondContact O-CB 3.18Å; L835-E839 PolarHBondContact O-N 3Å; L836-E839 PolarHBondContact O-N 3.37Å; C837-E839 VanDerWaalsContact C-N 3.33Å; E839-S845 VanDerWaalsContact O-CB 3.31Å; E839-S845 WeakPolarHBondContact O-CB 3.25Å; E839-L850 HydrophobicContact CB-CD2 4.18Å |
| 840 | N | 90.8 | Very high | 90.3 | Very high | 124 Ų | 124 | 79.4 Ų | 79.4 | 66% | 0.663 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -83.8 | -23.2 | 179.4 | -72.7 | -71.3 | 0 | 0 | 0 | 114 | L836 C837 R842 | L836-N840 WeakPolarHBondContact CD1-ND2 3.46Å; L836-N840 PolarHBondContact O-N 3.09Å; L836-N840 VanDerWaalsContact O-N 3.13Å; L836-N840 PolarHBondContact O-ND2 3.08Å; C837-N840 PolarHBondContact O-N 3.37Å; N840-R842 PolarHBondContact O-N 3.16Å |
| 841 | D | 89.9 | Confident | 90.3 | Very high | 45 Ų | 45 | 81.5 Ų | 81.5 | 24% | 0.241 | 39% | 0.386 | C | S | . | . | trans | -72.7 | 118.4 | 175 | 168.5 | 25.2 | 0 | 0 | 0 | 111.1 | R680 C837 D843 S844 S845 | R680-D841 IonicContact CZ-OD2 3.72Å; R680-D841 IonicContact NE-OD2 3.93Å; R680-D841 IonicContact NH2-OD1 3.98Å; R680-D841 IonicContact NH2-OD2 2.71Å; R680-D841 PolarHBondContact NH2-OD2 3.41Å; C837-D841 WeakPolarHBondContact O-CB 3.45Å; C837-D841 PolarHBondContact O-N 3.2Å; D841-D843 PolarHBondContact O-N 3.46Å; D841-D843 VanDerWaalsContact O-N 3.09Å; D841-D843 PolarHBondContact OD1-N 2.84Å; D841-S844 WeakPolarHBondContact CB-OG 3.5Å; D841-S844 PolarHBondContact O-N 3.44Å; D841-S844 VanDerWaalsContact O-N 3.08Å; D841-S844 WeakPolarHBondContact OD2-CB 3.11Å; D841-S844 PolarHBondContact OD2-N 3.33Å; D841-S844 PolarHBondContact OD2-OG 3.37Å; D841-S845 WeakPolarHBondContact O-CB 3.22Å; D841-S845 PolarHBondContact O-N 3.37Å; D841-S845 PolarHBondContact O-OG 2.86Å; D841-S845 VanDerWaalsContact O-OG 3.12Å | ||
| 842 | R | 87 | Confident | 90.2 | Very high | 219 Ų | 219 | 83 Ų | 83 | 83% | 0.826 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -48.8 | -38.9 | 176.6 | -84.9 | -176.3 | 54.9 | 171.5 | -4.9 | 113.2 | N840 S845 | N840-R842 PolarHBondContact O-N 3.16Å; R842-S845 PolarHBondContact O-OG 2.8Å; R842-S845 VanDerWaalsContact O-OG 3.05Å |
| 843 | D | 85 | Confident | 90 | Very high | 120 Ų | 120 | 73.4 Ų | 73.4 | 64% | 0.642 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93 | 3 | -172 | -66.2 | -10.6 | 0 | 0 | 0 | 113 | R680 D841 | R680-D843 VanDerWaalsContact NH2-C 3.33Å; R680-D843 VanDerWaalsContact NH2-CB 3.29Å; R680-D843 PolarHBondContact NH2-O 3.27Å; D841-D843 PolarHBondContact O-N 3.46Å; D841-D843 VanDerWaalsContact O-N 3.09Å; D841-D843 PolarHBondContact OD1-N 2.84Å |
| 844 | S | 86.2 | Confident | 89.8 | Confident | 8 Ų | 8 | 77.5 Ų | 77.5 | 6% | 0.056 | 38% | 0.376 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -135.5 | -8.2 | 173.2 | 63.1 | 0 | 0 | 0 | 0 | 115.7 | L838 D841 H846 S847 | L838-S844 WeakPolarHBondContact CD2-OG 3.43Å; L838-S844 CarbonylContact O-C 3.51Å; L838-S844 PolarHBondContact O-OG 2.96Å; D841-S844 WeakPolarHBondContact CB-OG 3.5Å; D841-S844 PolarHBondContact O-N 3.44Å; D841-S844 VanDerWaalsContact O-N 3.08Å; D841-S844 WeakPolarHBondContact OD2-CB 3.11Å; D841-S844 PolarHBondContact OD2-N 3.33Å; D841-S844 PolarHBondContact OD2-OG 3.37Å; S844-H846 PolarHBondContact O-N 2.95Å; S844-H846 VanDerWaalsContact O-N 3.13Å; S844-S847 WeakPolarHBondContact O-CB 3.42Å; S844-S847 PolarHBondContact O-N 2.92Å; S844-S847 PolarHBondContact O-OG 3.21Å |
| 845 | S | 88.8 | Confident | 89.5 | Confident | 25 Ų | 25 | 81.7 Ų | 81.7 | 18% | 0.175 | 40% | 0.399 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | -25 | 171.2 | 53.7 | 0 | 0 | 0 | 0 | 114.7 | L838 E839 D841 R842 L850 | L838-S845 WeakPolarHBondContact O-CA 3.25Å; L838-S845 PolarHBondContact O-N 2.83Å; E839-S845 VanDerWaalsContact O-CB 3.31Å; E839-S845 WeakPolarHBondContact O-CB 3.25Å; D841-S845 WeakPolarHBondContact O-CB 3.22Å; D841-S845 PolarHBondContact O-N 3.37Å; D841-S845 PolarHBondContact O-OG 2.86Å; D841-S845 VanDerWaalsContact O-OG 3.12Å; R842-S845 PolarHBondContact O-OG 2.8Å; R842-S845 VanDerWaalsContact O-OG 3.05Å; S845-L850 WeakPolarHBondContact O-CD2 3.37Å |
| 846 | H | 89.1 | Confident | 88 | Confident | 152 Ų | 152 | 91.7 Ų | 91.7 | 70% | 0.704 | 44% | 0.441 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -109.1 | 10.9 | 177.3 | -62.4 | 71.3 | 0 | 0 | 0 | 112.3 | S844 | S844-H846 PolarHBondContact O-N 2.95Å; S844-H846 VanDerWaalsContact O-N 3.13Å |
| 847 | S | 89.2 | Confident | 87.8 | Confident | 30 Ų | 30 | 92.7 Ų | 92.7 | 21% | 0.21 | 44% | 0.444 | C | S | . | . | trans | -77.7 | 145 | -174.6 | 72.3 | 0 | 0 | 0 | 0 | 112.7 | S844 L849 L850 Y851 | S844-S847 WeakPolarHBondContact O-CB 3.42Å; S844-S847 PolarHBondContact O-N 2.92Å; S844-S847 PolarHBondContact O-OG 3.21Å; S847-L849 PolarHBondContact O-N 3.3Å; S847-L849 VanDerWaalsContact O-N 3.09Å; S847-L850 PolarHBondContact O-N 2.99Å; S847-L850 VanDerWaalsContact O-N 3.14Å; S847-L850 PolarHBondContact OG-N 3.3Å; S847-Y851 WeakPolarHBondContact O-CD2 3.42Å; S847-Y851 PolarHBondContact O-N 3.49Å | ||
| 848 | Q | 88.4 | Confident | 87.5 | Confident | 137 Ų | 137 | 96.9 Ų | 96.9 | 64% | 0.64 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -58.8 | -21.3 | 169.3 | -66.4 | -168.3 | 12 | 0 | 0 | 113.1 | K852 | Q848-K852 VanDerWaalsContact O-CB 3.26Å; Q848-K852 WeakPolarHBondContact O-CB 3.39Å; Q848-K852 WeakPolarHBondContact O-CD 3.32Å; Q848-K852 VanDerWaalsContact O-CG 3.24Å; Q848-K852 WeakPolarHBondContact O-CG 3.37Å; Q848-K852 PolarHBondContact O-N 2.8Å |
| 849 | L | 87.8 | Confident | 87.2 | Confident | 120 Ų | 120 | 101.8 Ų | 101.8 | 63% | 0.628 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -68.2 | -46.3 | 176.1 | -179.2 | 62.6 | 0 | 0 | 0 | 111 | L838 S847 K852 G853 | L838-L849 HydrophobicContact CD1-CD2 4.26Å; L838-L849 HydrophobicContact CD1-CG 4.34Å; S847-L849 PolarHBondContact O-N 3.3Å; S847-L849 VanDerWaalsContact O-N 3.09Å; L849-K852 PolarHBondContact O-N 2.77Å; L849-G853 PolarHBondContact O-N 2.68Å |
| 850 | L | 91.1 | Very high | 86.9 | Confident | 5 Ų | 5 | 101.4 Ų | 101.4 | 3% | 0.026 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -61.6 | -50.9 | 175.2 | 178.6 | 61.1 | 0 | 0 | 0 | 110.8 | L835 L838 E839 S845 S847 K852 G853 L854 | L835-L850 HydrophobicContact CB-CD1 4.42Å; L835-L850 HydrophobicContact CD2-CD1 3.86Å; L838-L850 HydrophobicContact CB-CB 4.43Å; L838-L850 HydrophobicContact CB-CD1 4.05Å; E839-L850 HydrophobicContact CB-CD2 4.18Å; S845-L850 WeakPolarHBondContact O-CD2 3.37Å; S847-L850 PolarHBondContact O-N 2.99Å; S847-L850 VanDerWaalsContact O-N 3.14Å; S847-L850 PolarHBondContact OG-N 3.3Å; L850-K852 PolarHBondContact O-N 2.88Å; L850-G853 CarbonylContact O-C 3.41Å; L850-G853 WeakPolarHBondContact O-CA 3.22Å; L850-G853 PolarHBondContact O-N 3.25Å; L850-L854 HydrophobicContact CD1-CD1 3.99Å; L850-L854 HydrophobicContact CD1-CD2 4.49Å; L850-L854 HydrophobicContact CD1-CG 4.03Å; L850-L854 HydrophobicContact CG-CD1 3.91Å; L850-L854 HydrophobicContact CG-CG 4.36Å; L850-L854 WeakPolarHBondContact O-CG 3.4Å; L850-L854 PolarHBondContact O-N 2.83Å |
| 851 | Y | 90.9 | Very high | 86.6 | Confident | 122 Ų | 122 | 100 Ų | 100 | 48% | 0.478 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -58.7 | -43.8 | 178.9 | -64.6 | -61.4 | 0 | 0 | 0 | 112.7 | S847 G853 L854 L855 | S847-Y851 WeakPolarHBondContact O-CD2 3.42Å; S847-Y851 PolarHBondContact O-N 3.49Å; Y851-G853 PolarHBondContact O-N 3.13Å; Y851-L854 PolarHBondContact O-N 3.12Å; Y851-L855 WeakPolarHBondContact O-CD1 3.3Å; Y851-L855 PolarHBondContact O-N 3.26Å |
| 852 | K | 89.6 | Confident | 86.4 | Confident | 132 Ų | 132 | 103.7 Ų | 103.7 | 57% | 0.574 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -67.7 | -20 | 174.9 | -74.6 | 168.6 | 176.5 | 161.8 | 0 | 113.6 | Q848 L849 L850 | Q848-K852 VanDerWaalsContact O-CB 3.26Å; Q848-K852 WeakPolarHBondContact O-CB 3.39Å; Q848-K852 WeakPolarHBondContact O-CD 3.32Å; Q848-K852 VanDerWaalsContact O-CG 3.24Å; Q848-K852 WeakPolarHBondContact O-CG 3.37Å; Q848-K852 PolarHBondContact O-N 2.8Å; L849-K852 PolarHBondContact O-N 2.77Å; L850-K852 PolarHBondContact O-N 2.88Å |
| 853 | G | 87.1 | Confident | 86.4 | Confident | 11 Ų | 11 | 95.4 Ų | 95.4 | 11% | 0.113 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -85.7 | -29.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114 | L849 L850 Y851 | L849-G853 PolarHBondContact O-N 2.68Å; L850-G853 CarbonylContact O-C 3.41Å; L850-G853 WeakPolarHBondContact O-CA 3.22Å; L850-G853 PolarHBondContact O-N 3.25Å; Y851-G853 PolarHBondContact O-N 3.13Å |
| 854 | L | 88.6 | Confident | 86.5 | Confident | 93 Ų | 93 | 93.5 Ų | 93.5 | 49% | 0.487 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -79.9 | -20.6 | 174.7 | -67.9 | 171.8 | 0 | 0 | 0 | 113.3 | L835 L850 Y851 K856 | L835-L854 HydrophobicContact CD1-CD2 4.45Å; L850-L854 HydrophobicContact CD1-CD1 3.99Å; L850-L854 HydrophobicContact CD1-CD2 4.49Å; L850-L854 HydrophobicContact CD1-CG 4.03Å; L850-L854 HydrophobicContact CG-CD1 3.91Å; L850-L854 HydrophobicContact CG-CG 4.36Å; L850-L854 WeakPolarHBondContact O-CG 3.4Å; L850-L854 PolarHBondContact O-N 2.83Å; Y851-L854 PolarHBondContact O-N 3.12Å; L854-K856 PolarHBondContact O-N 3.2Å |
| 855 | L | 85.6 | Confident | 86.5 | Confident | 151 Ų | 151 | 100.7 Ų | 100.7 | 79% | 0.791 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | 21.6 | 175.5 | -94.8 | 66.6 | 0 | 0 | 0 | 113.5 | Y851 | Y851-L855 WeakPolarHBondContact O-CD1 3.3Å; Y851-L855 PolarHBondContact O-N 3.26Å |
| 856 | K | 61.8 | Low | 86.3 | Confident | 230 Ų | 230 | 107.5 Ų | 107.5 | 100% | 1 | 51% | 0.514 | S | S | * | . | trans | -134.7 | 0 | -177.7 | -80.7 | -172.6 | 171.9 | -176.3 | 0 | 113.2 | L854 | L854-K856 PolarHBondContact O-N 3.2Š|
Retrieved 856 of 856 residues in 948.1 ms
(Link to these results)