| 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 | 35.1 | Very low | 41.3 | Very low | 239 Ų | 239 | 137.4 Ų | 137.4 | 100% | 1.177 | 81% | 0.809 | S | S | * | * | 0 | 123.4 | 0 | -66.2 | -178.7 | -174.4 | 0 | 0 | 106.9 | |||||
| 2 | S | 38.4 | Very low | 42.6 | Very low | 101 Ų | 101 | 136.1 Ų | 136.1 | 71% | 0.706 | 81% | 0.807 | S | S | * | * | cis | -158.7 | 142.3 | -0.8 | -72.7 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 3 | L | 42.3 | Very low | 42.1 | Very low | 171 Ų | 171 | 139.3 Ų | 139.3 | 90% | 0.895 | 81% | 0.809 | S | S | * | * | trans | 51.4 | 125.1 | 149.4 | -54.5 | 176.3 | 0 | 0 | 0 | 122 | ||||
| 4 | S | 41.3 | Very low | 42.1 | Very low | 113 Ų | 113 | 136.9 Ų | 136.9 | 79% | 0.79 | 81% | 0.813 | S | S | * | * | trans | -85.5 | -160.9 | 156.8 | -30.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 5 | P | 60.2 | Low | 41.8 | Very low | 106 Ų | 106 | 133.6 Ų | 133.6 | 69% | 0.688 | 81% | 0.808 | S | S | * | * | cis | -135 | -177.9 | -21.2 | 40.4 | -23.3 | 0 | 0 | 0 | 114.5 | ||||
| 6 | V | 41.5 | Very low | 41.6 | Very low | 138 Ų | 138 | 136.3 Ų | 136.3 | 84% | 0.836 | 82% | 0.816 | S | S | * | * | trans | -149.4 | 113.9 | 165 | 171.3 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 7 | I | 40.3 | Very low | 41.2 | Very low | 149 Ų | 149 | 132.7 Ų | 132.7 | 76% | 0.764 | 81% | 0.814 | S | S | * | * | 63.7 | 122.1 | 59 | -52.7 | 174.8 | 0 | 0 | 0 | 112.6 | |||||
| 8 | G | 37.8 | Very low | 40.7 | Very low | 66 Ų | 66 | 133.9 Ų | 133.9 | 68% | 0.68 | 82% | 0.82 | S | S | * | * | cis | 147.8 | 119.4 | -3.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 9 | T | 42.3 | Very low | 40.5 | Very low | 123 Ų | 123 | 131.8 Ų | 131.8 | 76% | 0.755 | 82% | 0.819 | S | S | * | * | trans | -161.4 | 145.1 | 178.2 | 49.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 10 | E | 35 | Very low | 40.5 | Very low | 177 Ų | 177 | 131.5 Ų | 131.5 | 83% | 0.827 | 82% | 0.816 | S | S | * | * | cis | -178.8 | 176.2 | -35.1 | 57.9 | -159.7 | 132.9 | 0 | 0 | 105.7 | ||||
| 11 | V | 40.8 | Very low | 41.1 | Very low | 128 Ų | 128 | 131.5 Ų | 131.5 | 78% | 0.776 | 82% | 0.818 | S | S | * | * | trans | -133.1 | 146.3 | -159.8 | -176.5 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 12 | P | 55.9 | Low | 41.1 | Very low | 122 Ų | 122 | 126.1 Ų | 126.1 | 79% | 0.792 | 80% | 0.798 | S | S | * | * | -129 | 132.5 | 119.4 | 7.6 | 13.7 | 0 | 0 | 0 | 110.7 | |||||
| 13 | E | 36.5 | Very low | 40.9 | Very low | 178 Ų | 178 | 126.7 Ų | 126.7 | 83% | 0.832 | 80% | 0.802 | S | S | * | * | 76.9 | 104.5 | 63 | -165.2 | -174.5 | 160.6 | 0 | 0 | 113.7 | |||||
| 14 | A | 42 | Very low | 40.5 | Very low | 105 Ų | 105 | 125.1 Ų | 125.1 | 87% | 0.868 | 79% | 0.794 | S | S | * | * | trans | -152 | 124.3 | 155.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 15 | A | 37.1 | Very low | 40.2 | Very low | 88 Ų | 88 | 128 Ų | 128 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | trans | -94.7 | 146.6 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 16 | N | 38.6 | Very low | 38.8 | Very low | 177 Ų | 177 | 130.4 Ų | 130.4 | 95% | 0.947 | 80% | 0.802 | S | S | * | * | trans | -168.2 | 129 | 144.2 | -95.6 | -41.4 | 0 | 0 | 0 | 108.5 | ||||
| 17 | G | 35 | Very low | 38.2 | Very low | 75 Ų | 75 | 127.1 Ų | 127.1 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | trans | -140 | 156.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 18 | V | 32.6 | Very low | 39.2 | Very low | 154 Ų | 154 | 125.5 Ų | 125.5 | 93% | 0.933 | 80% | 0.795 | S | S | * | * | trans | -139 | 143.1 | 161 | 157.9 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 19 | A | 37.2 | Very low | 39 | Very low | 95 Ų | 95 | 132 Ų | 132 | 79% | 0.785 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 150.2 | -157.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 20 | T | 39.5 | Very low | 38.7 | Very low | 125 Ų | 125 | 130.4 Ų | 130.4 | 77% | 0.767 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -103.8 | 145.7 | 150.8 | 47.4 | 0 | 0 | 0 | 0 | 109.5 | ||
| 21 | P | 53.2 | Low | 39.4 | Very low | 132 Ų | 132 | 127.2 Ų | 127.2 | 86% | 0.857 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 144.2 | 179.5 | 32.9 | -33.9 | 0 | 0 | 0 | 112.6 | ||
| 22 | V | 35.6 | Very low | 39.1 | Very low | 125 Ų | 125 | 127.6 Ų | 127.6 | 76% | 0.758 | 80% | 0.804 | S | S | * | * | trans | -136.5 | 139.5 | 174.4 | 173.4 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 23 | S | 33.8 | Very low | 38.1 | Very low | 113 Ų | 113 | 126.4 Ų | 126.4 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | trans | -163.6 | 115.5 | 149.8 | -77.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 24 | L | 34 | Very low | 38 | Very low | 138 Ų | 138 | 123.4 Ų | 123.4 | 72% | 0.723 | 79% | 0.791 | S | S | * | * | 66.8 | 106 | 93.5 | -124.2 | 77.8 | 0 | 0 | 0 | 111.4 | |||||
| 25 | E | 36.4 | Very low | 37.8 | Very low | 174 Ų | 174 | 126.3 Ų | 126.3 | 81% | 0.813 | 79% | 0.785 | S | S | * | * | 60.2 | 114.5 | 55.9 | -165.8 | -179.6 | 168.9 | 0 | 0 | 113.8 | |||||
| 26 | N | 30.1 | Very low | 37.6 | Very low | 156 Ų | 156 | 129.4 Ų | 129.4 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | trans | -168.6 | 152.4 | 144.4 | -105.4 | -69.5 | 0 | 0 | 0 | 109.3 | ||||
| 27 | G | 29.1 | Very low | 37.3 | Very low | 69 Ų | 69 | 124.8 Ų | 124.8 | 71% | 0.711 | 78% | 0.778 | S | S | * | * | trans | -106.7 | -139.7 | -164 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 28 | P | 61.7 | Low | 37.2 | Very low | 116 Ų | 116 | 124.7 Ų | 124.7 | 75% | 0.753 | 78% | 0.777 | S | S | * | * | -131.3 | 149.6 | -123.2 | 37.8 | -21.3 | 0 | 0 | 0 | 116.5 | |||||
| 29 | H | 33.4 | Very low | 37.2 | Very low | 203 Ų | 203 | 122.6 Ų | 122.6 | 94% | 0.94 | 77% | 0.77 | S | S | * | * | trans | -152.4 | 142.7 | 160.3 | -79.6 | -61.9 | 0 | 0 | 0 | 113.4 | ||||
| 30 | A | 35.2 | Very low | 37 | Very low | 88 Ų | 88 | 129.5 Ų | 129.5 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | trans | -104.5 | 176.4 | 156.3 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 31 | P | 49.6 | Very low | 36.9 | Very low | 111 Ų | 111 | 131.1 Ų | 131.1 | 72% | 0.721 | 78% | 0.778 | S | S | * | * | -158.2 | -172.7 | 52.7 | 38.8 | -13.3 | 0 | 0 | 0 | 118.3 | |||||
| 32 | V | 34.4 | Very low | 37.2 | Very low | 136 Ų | 136 | 129.7 Ų | 129.7 | 82% | 0.824 | 77% | 0.769 | S | S | * | * | trans | 59.2 | 158.5 | 161.2 | -104.8 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 33 | S | 35.8 | Very low | 37 | Very low | 97 Ų | 97 | 130.8 Ų | 130.8 | 68% | 0.678 | 77% | 0.771 | S | S | * | * | cis | -163.9 | -168.6 | -6.2 | -155.8 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 34 | V | 33.6 | Very low | 37.1 | Very low | 114 Ų | 114 | 133.1 Ų | 133.1 | 69% | 0.691 | 77% | 0.774 | S | S | * | * | cis | -155.6 | 154.8 | 4.1 | -150.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 35 | K | 39 | Very low | 36.9 | Very low | 166 Ų | 166 | 129.7 Ų | 129.7 | 72% | 0.722 | 77% | 0.773 | S | S | * | * | trans | 63 | 144.1 | 145 | -97.8 | 172 | 156.6 | -137.7 | 0 | 120.8 | ||||
| 36 | H | 31.8 | Very low | 36.9 | Very low | 153 Ų | 153 | 126 Ų | 126 | 71% | 0.708 | 77% | 0.771 | S | S | * | * | cis | -130.7 | -179.3 | 4.7 | -63.1 | 91.4 | 0 | 0 | 0 | 109.4 | ||||
| 37 | G | 31.7 | Very low | 36.9 | Very low | 80 Ų | 80 | 127.7 Ų | 127.7 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | cis | 105 | 127.2 | 5.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 38 | G | 34.3 | Very low | 37.1 | Very low | 74 Ų | 74 | 128.8 Ų | 128.8 | 76% | 0.763 | 77% | 0.771 | S | S | * | * | cis | 173.7 | -155.7 | 4.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 39 | S | 32.3 | Very low | 35.9 | Very low | 110 Ų | 110 | 131.1 Ų | 131.1 | 77% | 0.769 | 77% | 0.774 | S | S | * | * | trans | 81.1 | 136.8 | 179.7 | -164.8 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 40 | R | 33.2 | Very low | 35.7 | Very low | 239 Ų | 239 | 128.4 Ų | 128.4 | 90% | 0.902 | 77% | 0.766 | S | S | * | * | cis | -150.2 | 178.3 | 4 | -131.9 | 170.1 | -140.5 | -133.9 | 3.4 | 113 | ||||
| 41 | L | 36.2 | Very low | 35.6 | Very low | 159 Ų | 159 | 126.9 Ų | 126.9 | 83% | 0.832 | 76% | 0.759 | S | S | * | * | trans | -117.9 | -179.5 | -174.4 | -79.3 | 168.4 | 0 | 0 | 0 | 110.7 | ||||
| 42 | P | 60.6 | Low | 34.9 | Very low | 103 Ų | 103 | 131.9 Ų | 131.9 | 67% | 0.669 | 76% | 0.764 | S | S | * | * | cis | -140 | -133.3 | -36 | 37.4 | -14.2 | 0 | 0 | 0 | 112.2 | ||||
| 43 | D | 31.1 | Very low | 34.9 | Very low | 148 Ų | 148 | 129.8 Ų | 129.8 | 79% | 0.791 | 75% | 0.752 | S | S | * | * | trans | 74.8 | 150.1 | 168.3 | -73.4 | 16.1 | 0 | 0 | 0 | 119.7 | ||||
| 44 | D | 35.2 | Very low | 34.9 | Very low | 161 Ų | 161 | 132.2 Ų | 132.2 | 86% | 0.861 | 75% | 0.752 | S | S | * | * | cis | -168.1 | 174.2 | -35.1 | -164.8 | 13.4 | 0 | 0 | 0 | 108.2 | ||||
| 45 | G | 30.4 | Very low | 34.8 | Very low | 67 Ų | 67 | 133.7 Ų | 133.7 | 69% | 0.691 | 76% | 0.756 | S | S | * | * | trans | 119 | 155.8 | 161.6 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 46 | A | 36.2 | Very low | 34.4 | Very low | 95 Ų | 95 | 133.8 Ų | 133.8 | 79% | 0.785 | 76% | 0.759 | S | S | * | * | trans | -148.8 | -173.6 | -167.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 47 | E | 29.7 | Very low | 34.7 | Very low | 192 Ų | 192 | 132 Ų | 132 | 90% | 0.897 | 76% | 0.758 | S | S | * | * | trans | 71.7 | 164.6 | 171 | -56.7 | -164.8 | 155.5 | 0 | 0 | 116.5 | ||||
| 48 | S | 34.4 | Very low | 34.8 | Very low | 93 Ų | 93 | 134.4 Ų | 134.4 | 65% | 0.65 | 75% | 0.753 | S | S | * | * | cis | -176.1 | 166.8 | -36.7 | -172.2 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 49 | M | 35.6 | Very low | 34.7 | Very low | 164 Ų | 164 | 136.3 Ų | 136.3 | 81% | 0.808 | 75% | 0.75 | S | S | * | * | trans | 64.6 | 165.1 | 171.5 | -58.3 | -86.4 | 75.9 | 0 | 0 | 115.5 | ||||
| 50 | D | 30.5 | Very low | 34.7 | Very low | 146 Ų | 146 | 135.6 Ų | 135.6 | 78% | 0.781 | 75% | 0.75 | S | S | * | * | cis | -165.2 | 172.3 | -28.5 | 175.8 | 38.3 | 0 | 0 | 0 | 107.5 | ||||
| 51 | G | 31.4 | Very low | 34.6 | Very low | 56 Ų | 56 | 132.2 Ų | 132.2 | 58% | 0.577 | 75% | 0.75 | S | S | * | * | trans | 112.6 | 127.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 52 | R | 35.2 | Very low | 34.5 | Very low | 216 Ų | 216 | 134.3 Ų | 134.3 | 82% | 0.815 | 75% | 0.747 | S | S | * | * | cis | 58.4 | 135.3 | 28.6 | -78 | -174.2 | 165.6 | -118.8 | -1.3 | 113.2 | ||||
| 53 | T | 34.3 | Very low | 33 | Very low | 93 Ų | 93 | 135.7 Ų | 135.7 | 57% | 0.571 | 75% | 0.748 | S | S | * | * | cis | -156.9 | 156 | 13.8 | -7.2 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 54 | E | 35.4 | Very low | 32.9 | Very low | 147 Ų | 147 | 135.4 Ų | 135.4 | 69% | 0.687 | 75% | 0.746 | S | S | * | * | trans | 40.6 | 127.7 | 138.7 | -70.3 | 155.4 | -163.3 | 0 | 0 | 123 | ||||
| 55 | N | 32.5 | Very low | 32.5 | Very low | 146 Ų | 146 | 132.4 Ų | 132.4 | 78% | 0.781 | 74% | 0.744 | S | S | * | * | 40.9 | 125.6 | 124.6 | -44.3 | -24.3 | 0 | 0 | 0 | 120.8 | |||||
| 56 | H | 31.4 | Very low | 32.5 | Very low | 168 Ų | 168 | 133.3 Ų | 133.3 | 78% | 0.778 | 75% | 0.745 | S | S | * | * | -159.1 | 161.1 | 101.8 | -150.6 | -95.4 | 0 | 0 | 0 | 112.7 | |||||
| 57 | V | 37.7 | Very low | 32.2 | Very low | 114 Ų | 114 | 137.8 Ų | 137.8 | 69% | 0.691 | 75% | 0.749 | S | S | * | * | trans | -79.4 | 152.9 | 169.6 | -154 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 58 | D | 32.7 | Very low | 32.3 | Very low | 132 Ų | 132 | 133.7 Ų | 133.7 | 71% | 0.706 | 74% | 0.742 | S | S | * | * | -169 | 149.8 | 117.9 | -120.8 | -50.6 | 0 | 0 | 0 | 117.7 | |||||
| 59 | T | 32.1 | Very low | 32.2 | Very low | 114 Ų | 114 | 136.4 Ų | 136.4 | 70% | 0.699 | 75% | 0.749 | S | S | * | * | trans | 34.8 | 105.3 | 145.8 | -65.2 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 60 | A | 32 | Very low | 32 | Very low | 94 Ų | 94 | 135.6 Ų | 135.6 | 78% | 0.777 | 75% | 0.747 | S | S | * | * | trans | 28.7 | 133.8 | 132.9 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 61 | N | 32.4 | Very low | 32 | Very low | 168 Ų | 168 | 134.8 Ų | 134.8 | 90% | 0.898 | 74% | 0.743 | S | S | * | * | -145.8 | 171.2 | 129.8 | -143.7 | -19.9 | 0 | 0 | 0 | 112.7 | |||||
| 62 | R | 32.8 | Very low | 32.1 | Very low | 204 Ų | 204 | 137.5 Ų | 137.5 | 77% | 0.77 | 75% | 0.748 | S | S | * | * | trans | -119.6 | 145 | -166.6 | -146.6 | -166.7 | -176.2 | -138.1 | 2.9 | 110.1 | ||||
| 63 | L | 30.3 | Very low | 32.1 | Very low | 131 Ų | 131 | 135.5 Ų | 135.5 | 69% | 0.686 | 75% | 0.748 | S | S | * | * | trans | 65.9 | 130.6 | 166.3 | -57 | 170.8 | 0 | 0 | 0 | 114.3 | ||||
| 64 | N | 28.5 | Very low | 32.1 | Very low | 142 Ų | 142 | 136.9 Ų | 136.9 | 76% | 0.759 | 76% | 0.757 | S | S | * | * | cis | -168.8 | 161.3 | 40.4 | -97.7 | -40.7 | 0 | 0 | 0 | 112.3 | ||||
| 65 | A | 27.9 | Very low | 31.8 | Very low | 98 Ų | 98 | 137.4 Ų | 137.4 | 81% | 0.81 | 76% | 0.764 | S | S | * | * | trans | 67.7 | 156 | 142.5 | 0 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 66 | A | 28.5 | Very low | 32 | Very low | 86 Ų | 86 | 138.2 Ų | 138.2 | 71% | 0.711 | 77% | 0.768 | S | S | * | * | trans | 74.9 | 98.4 | 157.7 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 67 | E | 31.7 | Very low | 32.1 | Very low | 189 Ų | 189 | 137 Ų | 137 | 88% | 0.883 | 76% | 0.762 | S | S | * | * | 53.3 | 112.6 | 119.9 | -63.2 | 172.1 | 173 | 0 | 0 | 121.9 | |||||
| 68 | S | 30.5 | Very low | 32.1 | Very low | 107 Ų | 107 | 140.2 Ų | 140.2 | 75% | 0.748 | 77% | 0.77 | S | S | * | * | -179 | 129.4 | 128.3 | 17.9 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 69 | N | 32 | Very low | 32.3 | Very low | 150 Ų | 150 | 144.4 Ų | 144.4 | 80% | 0.802 | 78% | 0.776 | S | S | * | * | 62 | 129.6 | 89.8 | -63.3 | -34.3 | 0 | 0 | 0 | 114.1 | |||||
| 70 | L | 31.7 | Very low | 32.2 | Very low | 146 Ų | 146 | 145.3 Ų | 145.3 | 76% | 0.764 | 78% | 0.782 | S | S | * | * | cis | -123.6 | -161.4 | -3.3 | -63.4 | 93.4 | 0 | 0 | 0 | 109.2 | ||||
| 71 | D | 30.9 | Very low | 32.2 | Very low | 130 Ų | 130 | 146.3 Ų | 146.3 | 70% | 0.695 | 78% | 0.783 | S | S | * | * | cis | -165.3 | 141.3 | 38.6 | -101.2 | -56.1 | 0 | 0 | 0 | 108.9 | ||||
| 72 | T | 33.6 | Very low | 32.1 | Very low | 112 Ų | 112 | 143.8 Ų | 143.8 | 69% | 0.687 | 78% | 0.778 | S | S | * | * | 67.3 | 125.5 | 87.6 | -49.3 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 73 | E | 34.3 | Very low | 31.9 | Very low | 174 Ų | 174 | 142.8 Ų | 142.8 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | cis | -162.5 | 161.6 | -4.6 | 174 | 168.6 | 103.3 | 0 | 0 | 110.3 | ||||
| 74 | T | 35.7 | Very low | 31.8 | Very low | 122 Ų | 122 | 141.8 Ų | 141.8 | 75% | 0.748 | 79% | 0.791 | S | S | * | * | trans | -42.7 | 163.7 | -170.8 | 57.4 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 75 | D | 29.7 | Very low | 31.8 | Very low | 158 Ų | 158 | 143.1 Ų | 143.1 | 85% | 0.845 | 80% | 0.798 | S | S | * | * | trans | -133.8 | 168.2 | 146.9 | -168.2 | 16.5 | 0 | 0 | 0 | 110.5 | ||||
| 76 | L | 35.4 | Very low | 32 | Very low | 163 Ų | 163 | 147.5 Ų | 147.5 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -103.9 | 163.5 | -157.2 | -67.9 | 166.9 | 0 | 0 | 0 | 116.2 | ||
| 77 | H | 34 | Very low | 32.2 | Very low | 143 Ų | 143 | 146.4 Ų | 146.4 | 66% | 0.662 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -103.5 | 139.5 | -171.5 | 134.9 | -53.7 | 0 | 0 | 0 | 114.3 | ||
| 78 | E | 38.4 | Very low | 32.6 | Very low | 182 Ų | 182 | 144 Ų | 144 | 85% | 0.85 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 144 | 173.3 | -55.6 | 177.3 | 100.3 | 0 | 0 | 113.8 | ||
| 79 | R | 35.3 | Very low | 32.5 | Very low | 219 Ų | 219 | 148.2 Ų | 148.2 | 83% | 0.826 | 81% | 0.806 | S | S | * | * | trans | -166.9 | 109.8 | 143.7 | -116.5 | 163.6 | 176.5 | 161.7 | -2.9 | 116.1 | ||||
| 80 | T | 30.6 | Very low | 32.4 | Very low | 134 Ų | 134 | 147.1 Ų | 147.1 | 82% | 0.822 | 81% | 0.805 | S | S | * | * | trans | -150.5 | 160.1 | 154.3 | 58.6 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 81 | S | 31.1 | Very low | 32.5 | Very low | 115 Ų | 115 | 146.1 Ų | 146.1 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | cis | -162.3 | 143.6 | -25.9 | -93.6 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 82 | S | 31.3 | Very low | 32.3 | Very low | 115 Ų | 115 | 146.6 Ų | 146.6 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | -154.2 | 97.4 | 174.1 | 61.1 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 83 | L | 28.6 | Very low | 32.3 | Very low | 182 Ų | 182 | 148.2 Ų | 148.2 | 95% | 0.953 | 81% | 0.811 | S | S | * | * | trans | -136.9 | 137.6 | 164.6 | -73.2 | 176.9 | 0 | 0 | 0 | 109.3 | ||||
| 84 | S | 27.9 | Very low | 32 | Very low | 110 Ų | 110 | 145.7 Ų | 145.7 | 77% | 0.769 | 81% | 0.812 | S | S | * | * | trans | -126.2 | 137.8 | 178 | -179.3 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 85 | L | 29.8 | Very low | 31.8 | Very low | 171 Ų | 171 | 149.2 Ų | 149.2 | 90% | 0.895 | 82% | 0.818 | S | S | * | * | trans | -133.1 | 125.5 | -178.8 | -76.7 | 170 | 0 | 0 | 0 | 110.2 | ||||
| 86 | H | 31.7 | Very low | 31.8 | Very low | 190 Ų | 190 | 150.2 Ų | 150.2 | 88% | 0.88 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 144 | 175.6 | -120 | -99.1 | 0 | 0 | 0 | 110.6 | ||
| 87 | G | 31.5 | Very low | 31.6 | Very low | 63 Ų | 63 | 149 Ų | 149 | 65% | 0.649 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 161.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 88 | P | 41.3 | Very low | 31.5 | Very low | 138 Ų | 138 | 150 Ų | 150 | 90% | 0.896 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -83 | 151.5 | -177.9 | 33.7 | -35.5 | 0 | 0 | 0 | 113.7 | ||
| 89 | Q | 27.8 | Very low | 31.3 | Very low | 195 Ų | 195 | 145.6 Ų | 145.6 | 91% | 0.911 | 82% | 0.816 | S | S | * | * | trans | -134.7 | 167.9 | 167.7 | -167.9 | 164 | 74.6 | 0 | 0 | 109.3 | ||||
| 90 | V | 30.4 | Very low | 31.2 | Very low | 127 Ų | 127 | 144.2 Ų | 144.2 | 77% | 0.77 | 82% | 0.819 | S | S | * | * | trans | -121 | 159.1 | -160 | -164.9 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 91 | V | 33.6 | Very low | 31.5 | Very low | 125 Ų | 125 | 143.6 Ų | 143.6 | 76% | 0.758 | 82% | 0.815 | S | S | * | * | trans | 78.7 | 140.3 | 175.3 | -162.1 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 92 | D | 25.8 | Very low | 31.5 | Very low | 140 Ų | 140 | 142 Ų | 142 | 75% | 0.749 | 82% | 0.817 | S | S | * | * | cis | -142.7 | -178.1 | 27.8 | -148.7 | -15.4 | 0 | 0 | 0 | 114.8 | ||||
| 93 | L | 33.9 | Very low | 31.6 | Very low | 147 Ų | 147 | 142.8 Ų | 142.8 | 77% | 0.77 | 81% | 0.812 | S | S | * | * | trans | -83.3 | 149.5 | -174.8 | -69.4 | 78.6 | 0 | 0 | 0 | 115.5 | ||||
| 94 | S | 29.2 | Very low | 31.9 | Very low | 121 Ų | 121 | 139.8 Ų | 139.8 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | trans | -155.2 | 154 | 145.1 | 65 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 95 | F | 30.5 | Very low | 32.1 | Very low | 195 Ų | 195 | 143.1 Ų | 143.1 | 86% | 0.855 | 81% | 0.809 | S | S | * | * | trans | -91.8 | 148.9 | -174.2 | -68.9 | -106.8 | 0 | 0 | 0 | 113 | ||||
| 96 | H | 30.7 | Very low | 32.3 | Very low | 180 Ų | 180 | 140.1 Ų | 140.1 | 83% | 0.833 | 80% | 0.803 | S | S | * | * | trans | -156.4 | 148.3 | 131.1 | -144.6 | -83.8 | 0 | 0 | 0 | 112.4 | ||||
| 97 | D | 30.3 | Very low | 32.4 | Very low | 138 Ų | 138 | 139.6 Ų | 139.6 | 74% | 0.738 | 80% | 0.798 | S | S | * | * | trans | -71.5 | 146.3 | 165.5 | -72.1 | -89.7 | 0 | 0 | 0 | 111.5 | ||||
| 98 | D | 32.3 | Very low | 32.4 | Very low | 164 Ų | 164 | 142.7 Ų | 142.7 | 88% | 0.877 | 80% | 0.8 | S | S | * | * | -163.9 | 165.6 | 110.5 | -113.5 | -46.1 | 0 | 0 | 0 | 111.2 | |||||
| 99 | A | 34.3 | Very low | 32 | Very low | 88 Ų | 88 | 141.6 Ų | 141.6 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | -102.7 | 154.7 | -165.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 100 | E | 32.9 | Very low | 32.2 | Very low | 190 Ų | 190 | 139.5 Ų | 139.5 | 89% | 0.888 | 79% | 0.786 | S | S | * | * | -163.3 | 169 | 116.3 | -111.2 | -154.1 | 125.8 | 0 | 0 | 115.8 | |||||
| 101 | T | 35.8 | Very low | 32.5 | Very low | 122 Ų | 122 | 141 Ų | 141 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | trans | -75.2 | 138.8 | -171.1 | -46.8 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 102 | G | 32.6 | Very low | 33.2 | Very low | 81 Ų | 81 | 140.7 Ų | 140.7 | 84% | 0.835 | 79% | 0.789 | S | S | * | * | trans | -157 | 58 | -175.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 103 | N | 32.2 | Very low | 33.5 | Very low | 131 Ų | 131 | 143.2 Ų | 143.2 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | trans | -70.9 | 132.8 | 178.6 | 52 | -75.3 | 0 | 0 | 0 | 114.1 | ||||
| 104 | S | 36.1 | Very low | 33.2 | Very low | 119 Ų | 119 | 139.9 Ų | 139.9 | 83% | 0.832 | 80% | 0.797 | S | S | * | * | 178.5 | 157.1 | 121.4 | -76.7 | 0 | 0 | 0 | 0 | 115 | |||||
| 105 | E | 30.5 | Very low | 33.4 | Very low | 180 Ų | 180 | 139.3 Ų | 139.3 | 84% | 0.841 | 79% | 0.793 | S | S | * | * | trans | -80.7 | 172.4 | -172.7 | -172 | -178.9 | 105.8 | 0 | 0 | 114.9 | ||||
| 106 | S | 34.8 | Very low | 33.4 | Very low | 109 Ų | 109 | 139 Ų | 139 | 76% | 0.762 | 79% | 0.791 | S | S | * | * | trans | 80 | 152.1 | 159.5 | 87.1 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 107 | K | 33.1 | Very low | 33.5 | Very low | 179 Ų | 179 | 134.6 Ų | 134.6 | 78% | 0.778 | 79% | 0.785 | S | S | * | * | cis | -165.6 | 158.3 | -13 | 154 | 179.6 | 179.5 | -175.5 | 0 | 111.8 | ||||
| 108 | D | 31.8 | Very low | 33.6 | Very low | 128 Ų | 128 | 136.8 Ų | 136.8 | 68% | 0.684 | 79% | 0.791 | S | S | * | * | trans | -22.2 | 149.2 | 171.9 | -60 | -64.8 | 0 | 0 | 0 | 122.6 | ||||
| 109 | T | 33.8 | Very low | 33.6 | Very low | 114 Ų | 114 | 135.6 Ų | 135.6 | 70% | 0.699 | 79% | 0.785 | S | S | * | * | trans | 84.5 | 138.9 | 136 | 42 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 110 | D | 30.9 | Very low | 33.4 | Very low | 151 Ų | 151 | 139.5 Ų | 139.5 | 81% | 0.807 | 79% | 0.793 | S | S | * | * | trans | 84.4 | 126.8 | 144.6 | -62.2 | -12.5 | 0 | 0 | 0 | 123.4 | ||||
| 111 | I | 37.8 | Very low | 33.2 | Very low | 159 Ų | 159 | 135.5 Ų | 135.5 | 82% | 0.815 | 78% | 0.781 | S | S | * | * | trans | -96.5 | 155.7 | 163.9 | -30.5 | 176.4 | 0 | 0 | 0 | 107 | ||||
| 112 | P | 47.7 | Very low | 33 | Very low | 119 Ų | 119 | 136.5 Ų | 136.5 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | -145.6 | 173.3 | 106.2 | 33.8 | -16.2 | 0 | 0 | 0 | 116.3 | |||||
| 113 | E | 32.1 | Very low | 32.7 | Very low | 193 Ų | 193 | 140.7 Ų | 140.7 | 90% | 0.902 | 78% | 0.781 | S | S | * | * | trans | -41.5 | 162 | -179.7 | -56.3 | 164.2 | 104.5 | 0 | 0 | 118.6 | ||||
| 114 | G | 28.1 | Very low | 32.7 | Very low | 76 Ų | 76 | 145.2 Ų | 145.2 | 78% | 0.784 | 79% | 0.788 | S | S | * | * | trans | -170.2 | 51.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 115 | S | 33.3 | Very low | 32.1 | Very low | 110 Ų | 110 | 146.2 Ų | 146.2 | 77% | 0.769 | 78% | 0.784 | S | S | * | * | trans | -29.7 | 138.8 | 177.3 | 59.4 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 116 | K | 29.7 | Very low | 32.3 | Very low | 189 Ų | 189 | 142 Ų | 142 | 82% | 0.822 | 78% | 0.775 | S | S | * | * | -172.4 | 153.2 | 109.2 | -103.4 | -179.1 | 179 | -161.8 | 0 | 112.8 | |||||
| 117 | A | 33.3 | Very low | 32 | Very low | 86 Ų | 86 | 141.3 Ų | 141.3 | 71% | 0.711 | 78% | 0.775 | S | S | * | * | trans | -100.6 | 156.1 | 160.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 118 | E | 32.1 | Very low | 32.6 | Very low | 185 Ų | 185 | 138.3 Ų | 138.3 | 86% | 0.864 | 77% | 0.774 | S | S | * | * | trans | -157.6 | 151.2 | 139.1 | -110.2 | 152.8 | -126.5 | 0 | 0 | 109 | ||||
| 119 | D | 32.7 | Very low | 32.4 | Very low | 139 Ų | 139 | 141.5 Ų | 141.5 | 74% | 0.743 | 79% | 0.785 | S | S | * | * | trans | -101.9 | 132.2 | -172.2 | 172.2 | 30.6 | 0 | 0 | 0 | 109.3 | ||||
| 120 | L | 29.4 | Very low | 32.2 | Very low | 170 Ų | 170 | 139.6 Ų | 139.6 | 89% | 0.89 | 78% | 0.781 | S | S | * | * | trans | -151.9 | 110.2 | 166.3 | -142.4 | 101.4 | 0 | 0 | 0 | 113 | ||||
| 121 | V | 29.3 | Very low | 32 | Very low | 106 Ų | 106 | 140 Ų | 140 | 64% | 0.642 | 78% | 0.777 | S | S | * | * | trans | -70.6 | 142.2 | 163.8 | -173.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 122 | L | 31.6 | Very low | 31.7 | Very low | 143 Ų | 143 | 137.7 Ų | 137.7 | 75% | 0.749 | 77% | 0.773 | S | S | * | * | 160.3 | 133.2 | 125.3 | -83.4 | 169 | 0 | 0 | 0 | 115.1 | |||||
| 123 | M | 27.6 | Very low | 31.1 | Very low | 168 Ų | 168 | 137.8 Ų | 137.8 | 83% | 0.828 | 77% | 0.772 | S | S | * | * | trans | 71.1 | 167 | 139.5 | -71.6 | 176.7 | 67.4 | 0 | 0 | 122 | ||||
| 124 | W | 31.4 | Very low | 30.8 | Very low | 227 Ų | 227 | 136 Ų | 136 | 86% | 0.86 | 77% | 0.768 | S | S | * | * | trans | -152.4 | 136.2 | -158.4 | 174.8 | -41.1 | 0 | 0 | 0 | 107.4 | ||||
| 125 | D | 24.4 | Very low | 30.8 | Very low | 140 Ų | 140 | 138 Ų | 138 | 75% | 0.749 | 77% | 0.765 | S | S | * | * | trans | -155.3 | 130.8 | 159.9 | -106.1 | -36.4 | 0 | 0 | 0 | 107.2 | ||||
| 126 | S | 33.5 | Very low | 30.7 | Very low | 92 Ų | 92 | 138.8 Ų | 138.8 | 64% | 0.643 | 77% | 0.769 | S | S | * | * | 74.3 | 136.9 | 76 | -57.4 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 127 | A | 28.7 | Very low | 30.7 | Very low | 93 Ų | 93 | 138.8 Ų | 138.8 | 77% | 0.769 | 77% | 0.772 | S | S | * | * | cis | -150.5 | -110.3 | -13 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 128 | P | 45.1 | Very low | 30.4 | Very low | 116 Ų | 116 | 144.5 Ų | 144.5 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | -130.4 | 171.5 | -119 | 38.8 | -22.1 | 0 | 0 | 0 | 117.5 | |||||
| 129 | H | 27.6 | Very low | 30.1 | Very low | 195 Ų | 195 | 139.4 Ų | 139.4 | 90% | 0.903 | 78% | 0.782 | S | S | * | * | trans | -158.1 | 169.3 | 131.8 | -137.6 | -94.2 | 0 | 0 | 0 | 113.4 | ||||
| 130 | A | 30.4 | Very low | 30 | Very low | 75 Ų | 75 | 136.4 Ų | 136.4 | 62% | 0.62 | 78% | 0.783 | S | S | * | * | trans | -121.7 | 172.7 | -161.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 131 | E | 26.2 | Very low | 30.8 | Very low | 158 Ų | 158 | 134.6 Ų | 134.6 | 74% | 0.738 | 78% | 0.782 | S | S | * | * | trans | 67.9 | 161.1 | 160.4 | -77.9 | -74.6 | 102.9 | 0 | 0 | 117.8 | ||||
| 132 | P | 31.5 | Very low | 30.8 | Very low | 111 Ų | 111 | 136.9 Ų | 136.9 | 72% | 0.721 | 79% | 0.79 | S | S | * | * | cis | -122.6 | 173.4 | 6.4 | 42.2 | -29 | 0 | 0 | 0 | 116.6 | ||||
| 133 | T | 34.5 | Very low | 30.9 | Very low | 122 Ų | 122 | 137.7 Ų | 137.7 | 75% | 0.748 | 79% | 0.794 | S | S | * | * | trans | -86.8 | 136.1 | 162.5 | -56.5 | 0 | 0 | 0 | 0 | 111 | ||||
| 134 | D | 26.2 | Very low | 31.1 | Very low | 154 Ų | 154 | 134.6 Ų | 134.6 | 82% | 0.824 | 80% | 0.795 | S | S | * | * | trans | -147.3 | 159.4 | 166.8 | -151.5 | -12.4 | 0 | 0 | 0 | 112.4 | ||||
| 135 | V | 27.6 | Very low | 30.9 | Very low | 120 Ų | 120 | 130.9 Ų | 130.9 | 73% | 0.727 | 79% | 0.787 | S | S | * | * | trans | -104.8 | 125.2 | -161.1 | 177.6 | 0 | 0 | 0 | 0 | 113.1 | Q137 | V135-Q137 PolarHBondContact O-N 2.77Š| ||
| 136 | C | 31.2 | Very low | 31.2 | Very low | 125 Ų | 125 | 134.6 Ų | 134.6 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | trans | -77.3 | 116.7 | 171.9 | -73 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 137 | Q | 29.8 | Very low | 31 | Very low | 190 Ų | 190 | 139 Ų | 139 | 89% | 0.888 | 80% | 0.801 | S | S | * | * | trans | -146.4 | 124.3 | 149.6 | -77.1 | -156.6 | 53.6 | 0 | 0 | 112.1 | V135 | V135-Q137 PolarHBondContact O-N 2.77Š| ||
| 138 | Q | 27.7 | Very low | 31.8 | Very low | 205 Ų | 205 | 139.8 Ų | 139.8 | 96% | 0.958 | 80% | 0.797 | S | S | * | * | trans | -157.1 | 132.2 | 169.1 | -172.4 | 173.9 | 9.7 | 0 | 0 | 108 | ||||
| 139 | G | 26.5 | Very low | 31 | Very low | 79 Ų | 79 | 141.1 Ų | 141.1 | 81% | 0.814 | 80% | 0.804 | S | S | * | * | trans | -178.6 | -28.8 | -177.9 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 140 | G | 29.5 | Very low | 31.2 | Very low | 76 Ų | 76 | 140.9 Ų | 140.9 | 78% | 0.784 | 80% | 0.803 | S | S | * | * | trans | 75.8 | 172.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 141 | P | 46.3 | Very low | 31.4 | Very low | 131 Ų | 131 | 142.3 Ų | 142.3 | 85% | 0.851 | 82% | 0.815 | S | S | * | * | trans | -117.8 | 170.8 | -166.5 | 41.9 | -31.4 | 0 | 0 | 0 | 115 | ||||
| 142 | D | 29.5 | Very low | 31.7 | Very low | 155 Ų | 155 | 144.1 Ų | 144.1 | 83% | 0.829 | 82% | 0.823 | S | S | * | * | trans | -141.6 | 167.3 | 160.1 | -143.8 | -26.4 | 0 | 0 | 0 | 111.3 | ||||
| 143 | I | 33.2 | Very low | 31.5 | Very low | 160 Ų | 160 | 144.1 Ų | 144.1 | 82% | 0.821 | 83% | 0.826 | S | S | * | * | trans | -124.7 | 135.7 | -152.1 | 23.6 | 171.2 | 0 | 0 | 0 | 115.7 | ||||
| 144 | A | 31.4 | Very low | 31.5 | Very low | 102 Ų | 102 | 146.7 Ų | 146.7 | 84% | 0.843 | 83% | 0.83 | S | S | * | * | trans | -157.3 | 154.4 | 163.5 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 145 | E | 28.6 | Very low | 31.9 | Very low | 150 Ų | 150 | 146.1 Ų | 146.1 | 70% | 0.701 | 82% | 0.822 | S | S | * | * | trans | -69.5 | 169.3 | 173.4 | -43.4 | -175.9 | 144.3 | 0 | 0 | 111.6 | ||||
| 146 | R | 30.1 | Very low | 32.1 | Very low | 218 Ų | 218 | 151.6 Ų | 151.6 | 82% | 0.823 | 83% | 0.829 | S | S | * | * | cis | -169.9 | 178.6 | 46 | -146.7 | 166.6 | -125.2 | -158.8 | -3 | 113.9 | ||||
| 147 | H | 29.7 | Very low | 32.3 | Very low | 185 Ų | 185 | 155.4 Ų | 155.4 | 86% | 0.856 | 83% | 0.826 | S | S | * | * | trans | -78.4 | 166.2 | -169.2 | -96.3 | -99.4 | 0 | 0 | 0 | 116.9 | ||||
| 148 | P | 44.4 | Very low | 32.6 | Very low | 108 Ų | 108 | 153.8 Ų | 153.8 | 70% | 0.701 | 82% | 0.823 | S | S | * | * | trans | -102.6 | -176.9 | -164.8 | 42.2 | -38 | 0 | 0 | 0 | 114.9 | ||||
| 149 | T | 29.8 | Very low | 32.8 | Very low | 145 Ų | 145 | 151.3 Ų | 151.3 | 89% | 0.89 | 82% | 0.816 | S | S | * | * | trans | -143.5 | 144.6 | 161 | -19 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 150 | E | 31.9 | Very low | 33.3 | Very low | 190 Ų | 190 | 156.2 Ų | 156.2 | 89% | 0.888 | 81% | 0.81 | S | S | * | * | trans | -96.4 | 153.6 | 178.5 | -58.4 | 156.3 | 129.7 | 0 | 0 | 111.7 | ||||
| 151 | A | 33.5 | Very low | 33.7 | Very low | 104 Ų | 104 | 161.7 Ų | 161.7 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | trans | -166.8 | 124.8 | 153.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 152 | E | 32.4 | Very low | 33.1 | Very low | 196 Ų | 196 | 161.4 Ų | 161.4 | 92% | 0.916 | 79% | 0.794 | S | S | * | * | trans | -92.5 | 157.2 | 165.9 | -57.2 | 171.9 | 110.1 | 0 | 0 | 110.3 | ||||
| 153 | S | 28 | Very low | 33.9 | Very low | 112 Ų | 112 | 161 Ų | 161 | 78% | 0.783 | 79% | 0.788 | S | S | * | * | trans | 179.4 | 122.5 | 134 | -172 | 0 | 0 | 0 | 0 | 114 | ||||
| 154 | E | 34.1 | Very low | 33.9 | Very low | 176 Ų | 176 | 161 Ų | 161 | 82% | 0.822 | 79% | 0.789 | S | S | * | * | trans | 18.6 | 130.1 | 147.4 | -57.4 | -172 | 140.2 | 0 | 0 | 125 | ||||
| 155 | E | 34.3 | Very low | 34.6 | Very low | 141 Ų | 141 | 165.9 Ų | 165.9 | 66% | 0.659 | 79% | 0.794 | S | S | * | * | 26.5 | 129 | 127.2 | -172.3 | 171.2 | -168.8 | 0 | 0 | 121.7 | R157 | E155-R157 IonicContact OE1-CZ 3.59Å; E155-R157 IonicContact OE1-NE 2.68Å; E155-R157 PolarHBondContact OE1-NE 2.66Å | |||
| 156 | R | 32.5 | Very low | 35 | Very low | 235 Ų | 235 | 166.1 Ų | 166.1 | 89% | 0.887 | 80% | 0.8 | S | S | * | * | trans | -148.3 | 131.9 | 134.2 | -151.8 | 174 | -175.2 | -168.9 | 0.3 | 114.5 | ||||
| 157 | R | 36.1 | Very low | 35.4 | Very low | 206 Ų | 206 | 159 Ų | 159 | 78% | 0.777 | 80% | 0.796 | S | S | * | * | trans | -87.4 | 154.1 | 170.4 | -63.9 | 169.7 | 174.4 | 171.3 | -3.2 | 112.5 | E155 | E155-R157 IonicContact OE1-CZ 3.59Å; E155-R157 IonicContact OE1-NE 2.68Å; E155-R157 PolarHBondContact OE1-NE 2.66Å | ||
| 158 | L | 35.8 | Very low | 35.8 | Very low | 155 Ų | 155 | 158.7 Ų | 158.7 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | trans | -179.7 | 106.2 | 149.2 | -96.8 | 165.3 | 0 | 0 | 0 | 105.1 | ||||
| 159 | D | 31.4 | Very low | 35.9 | Very low | 153 Ų | 153 | 163.4 Ų | 163.4 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | 95.9 | 161.4 | 51.5 | -158.4 | 16.9 | 0 | 0 | 0 | 112.7 | |||||
| 160 | R | 35.9 | Very low | 36.2 | Very low | 182 Ų | 182 | 163.8 Ų | 163.8 | 69% | 0.687 | 80% | 0.795 | S | S | * | * | trans | -112.2 | 153.2 | -139 | -177.6 | -175.9 | -174.6 | -171 | -3.7 | 113.4 | E162 | R160-E162 IonicContact CZ-OE1 3.49Å; R160-E162 IonicContact CZ-OE2 3.97Å; R160-E162 IonicContact NE-OE1 3.43Å; R160-E162 PolarHBondContact NE-OE1 2.91Å; R160-E162 IonicContact NE-OE2 2.66Å; R160-E162 IonicContact NH2-OE1 2.7Å; R160-E162 PolarHBondContact NH2-OE1 2.84Å; R160-E162 IonicContact NH2-OE2 3.72Å; R160-E162 PolarHBondContact NH2-OE2 3.18Å | ||
| 161 | R | 37.9 | Very low | 36.9 | Very low | 191 Ų | 191 | 162.9 Ų | 162.9 | 72% | 0.721 | 79% | 0.789 | S | S | * | * | trans | -149.4 | 114.7 | 158.3 | -156.5 | 161.9 | -169 | -92 | -11.9 | 112.6 | E163 | R161-E163 VanDerWaalsContact CZ-CD 3.46Å; R161-E163 IonicContact CZ-OE1 3.87Å; R161-E163 IonicContact CZ-OE2 2.71Å; R161-E163 IonicContact NH1-OE1 3.79Å; R161-E163 PolarHBondContact NH1-OE1 3.23Å; R161-E163 IonicContact NH1-OE2 2.82Å; R161-E163 PolarHBondContact NH1-OE2 2.71Å; R161-E163 IonicContact NH2-OE1 3.34Å; R161-E163 PolarHBondContact NH2-OE1 2.82Å; R161-E163 IonicContact NH2-OE2 2.61Å | ||
| 162 | E | 34 | Very low | 37.1 | Very low | 125 Ų | 125 | 167.4 Ų | 167.4 | 58% | 0.584 | 79% | 0.792 | S | S | * | * | trans | -104.4 | 151.3 | 162.3 | -76.3 | 147.1 | -138.7 | 0 | 0 | 107.3 | R160 | R160-E162 IonicContact CZ-OE1 3.49Å; R160-E162 IonicContact CZ-OE2 3.97Å; R160-E162 IonicContact NE-OE1 3.43Å; R160-E162 PolarHBondContact NE-OE1 2.91Å; R160-E162 IonicContact NE-OE2 2.66Å; R160-E162 IonicContact NH2-OE1 2.7Å; R160-E162 PolarHBondContact NH2-OE1 2.84Å; R160-E162 IonicContact NH2-OE2 3.72Å; R160-E162 PolarHBondContact NH2-OE2 3.18Å | ||
| 163 | E | 46.5 | Very low | 37.6 | Very low | 148 Ų | 148 | 166 Ų | 166 | 69% | 0.692 | 79% | 0.791 | S | S | * | * | trans | -135.8 | 109.5 | 167.1 | -81.5 | -177.3 | 135.7 | 0 | 0 | 108.5 | R161 | R161-E163 VanDerWaalsContact CZ-CD 3.46Å; R161-E163 IonicContact CZ-OE1 3.87Å; R161-E163 IonicContact CZ-OE2 2.71Å; R161-E163 IonicContact NH1-OE1 3.79Å; R161-E163 PolarHBondContact NH1-OE1 3.23Å; R161-E163 IonicContact NH1-OE2 2.82Å; R161-E163 PolarHBondContact NH1-OE2 2.71Å; R161-E163 IonicContact NH2-OE1 3.34Å; R161-E163 PolarHBondContact NH2-OE1 2.82Å; R161-E163 IonicContact NH2-OE2 2.61Å | ||
| 164 | D | 34.7 | Very low | 38.3 | Very low | 159 Ų | 159 | 168.7 Ų | 168.7 | 85% | 0.85 | 79% | 0.793 | S | S | * | * | trans | -81.2 | 149.7 | 163.3 | -56.9 | -68.5 | 0 | 0 | 0 | 109.5 | ||||
| 165 | E | 45.4 | Very low | 38.8 | Very low | 205 Ų | 205 | 169.4 Ų | 169.4 | 96% | 0.958 | 80% | 0.796 | S | S | * | * | trans | -140.5 | 146.5 | 154.2 | -151.8 | 168.9 | -144.4 | 0 | 0 | 110.7 | ||||
| 166 | D | 37 | Very low | 39.1 | Very low | 154 Ų | 154 | 168.9 Ų | 168.9 | 82% | 0.824 | 80% | 0.803 | S | S | * | * | trans | -105.5 | 160.2 | -159.6 | 173.5 | 35 | 0 | 0 | 0 | 112.6 | ||||
| 167 | G | 38.9 | Very low | 39.6 | Very low | 70 Ų | 70 | 165.2 Ų | 165.2 | 72% | 0.722 | 80% | 0.801 | S | S | * | * | trans | 172.6 | 46.1 | -179 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 168 | E | 38.1 | Very low | 39.9 | Very low | 178 Ų | 178 | 161.8 Ų | 161.8 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | trans | -62.7 | 135.1 | 167.8 | -68.4 | -163.5 | 149.4 | 0 | 0 | 112.8 | ||||
| 169 | K | 45.4 | Very low | 40.3 | Very low | 206 Ų | 206 | 162.3 Ų | 162.3 | 90% | 0.896 | 79% | 0.79 | S | S | * | * | trans | -151.5 | 97.6 | 143.8 | -73.1 | -151.1 | 177 | -177.8 | 0 | 114.6 | ||||
| 170 | E | 36.5 | Very low | 40.6 | Very low | 154 Ų | 154 | 161.6 Ų | 161.6 | 72% | 0.72 | 79% | 0.785 | S | S | * | * | trans | 27.6 | 109.5 | 137.4 | -168 | 153 | -131.9 | 0 | 0 | 121.8 | ||||
| 171 | K | 46.6 | Very low | 40.6 | Very low | 171 Ų | 171 | 160.2 Ų | 160.2 | 74% | 0.743 | 79% | 0.787 | S | S | * | * | trans | 38.3 | 128.6 | 134.9 | -52.5 | 169.1 | -161.3 | 140.9 | 0 | 121 | ||||
| 172 | Q | 36.6 | Very low | 40.5 | Very low | 198 Ų | 198 | 157 Ų | 157 | 93% | 0.925 | 78% | 0.784 | S | S | * | * | -162.2 | 146.5 | 111.6 | -110.7 | 169.8 | 28.3 | 0 | 0 | 111.9 | |||||
| 173 | D | 43.9 | Very low | 40.4 | Very low | 167 Ų | 167 | 162.4 Ų | 162.4 | 89% | 0.893 | 80% | 0.799 | S | S | * | * | trans | -78.6 | 138.6 | 177 | -56.5 | -72.7 | 0 | 0 | 0 | 112.1 | ||||
| 174 | M | 42.3 | Very low | 39.7 | Very low | 169 Ų | 169 | 167.3 Ų | 167.3 | 83% | 0.833 | 81% | 0.811 | S | S | * | * | trans | -158.7 | 119.1 | 139.7 | -154.7 | 170.8 | -179.5 | 0 | 0 | 111.5 | ||||
| 175 | E | 45 | Very low | 39.6 | Very low | 190 Ų | 190 | 171.2 Ų | 171.2 | 89% | 0.888 | 81% | 0.814 | S | S | * | * | trans | -68.6 | 131.1 | 162.1 | -69.1 | -177.3 | 123.8 | 0 | 0 | 109.7 | ||||
| 176 | T | 39.9 | Very low | 38.7 | Very low | 131 Ų | 131 | 169.3 Ų | 169.3 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | -145.4 | 136.6 | 148.4 | 17.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 177 | D | 43.6 | Very low | 38.3 | Very low | 157 Ų | 157 | 168.8 Ų | 168.8 | 84% | 0.84 | 81% | 0.813 | S | S | * | * | trans | -91.7 | -179.5 | -172.5 | -169.3 | 15.7 | 0 | 0 | 0 | 112 | ||||
| 178 | E | 42.9 | Very low | 37.8 | Very low | 135 Ų | 135 | 169.6 Ų | 169.6 | 63% | 0.631 | 82% | 0.822 | S | S | * | * | trans | 81.4 | 96.1 | 163.8 | -64.9 | -128.1 | 105.1 | 0 | 0 | 118.6 | ||||
| 179 | K | 44.4 | Very low | 37.4 | Very low | 166 Ų | 166 | 164.7 Ų | 164.7 | 72% | 0.722 | 82% | 0.819 | S | S | * | * | 82.3 | 96.6 | 114.6 | -164.6 | 176.5 | -96.8 | 128.1 | 0 | 116.4 | |||||
| 180 | N | 36.2 | Very low | 36.7 | Very low | 137 Ų | 137 | 166.8 Ų | 166.8 | 73% | 0.733 | 82% | 0.821 | S | S | * | * | trans | -67.7 | 145.3 | 178.6 | 53.6 | -19.6 | 0 | 0 | 0 | 115.7 | ||||
| 181 | E | 36.2 | Very low | 36.4 | Very low | 153 Ų | 153 | 164 Ų | 164 | 72% | 0.715 | 82% | 0.824 | S | S | * | * | trans | 46 | 107.5 | 132.7 | -57.5 | -159 | 100.1 | 0 | 0 | 119.1 | ||||
| 182 | N | 36 | Very low | 35.9 | Very low | 123 Ų | 123 | 165.6 Ų | 165.6 | 66% | 0.658 | 83% | 0.831 | S | S | * | * | 71.8 | 135.6 | 76.9 | 94.8 | 47 | 0 | 0 | 0 | 114.4 | |||||
| 183 | R | 32.7 | Very low | 35.7 | Very low | 240 Ų | 240 | 166.3 Ų | 166.3 | 91% | 0.906 | 83% | 0.831 | S | S | * | * | trans | -149.5 | 81 | -175.8 | -170 | -172.7 | -177.9 | -152.7 | 3 | 111.1 | ||||
| 184 | W | 32 | Very low | 35.1 | Very low | 250 Ų | 250 | 167.1 Ų | 167.1 | 95% | 0.947 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -82.4 | 162.5 | 168.2 | -76.2 | -8.8 | 0 | 0 | 0 | 112.1 | ||
| 185 | R | 32.7 | Very low | 35 | Very low | 241 Ų | 241 | 164.7 Ų | 164.7 | 91% | 0.909 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 138.7 | -165.7 | -63.4 | 179.7 | -175.3 | -113.7 | 1.7 | 111.5 | ||
| 186 | N | 26.8 | Very low | 34.3 | Very low | 165 Ų | 165 | 160.8 Ų | 160.8 | 88% | 0.882 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 133.5 | 174.5 | -73.1 | -37 | 0 | 0 | 0 | 112.8 | ||
| 187 | T | 28.4 | Very low | 34 | Very low | 144 Ų | 144 | 163 Ų | 163 | 88% | 0.883 | 82% | 0.821 | S | S | * | * | trans | -145.6 | 117.9 | 154.1 | 50.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 188 | G | 28.7 | Very low | 33.5 | Very low | 87 Ų | 87 | 163.9 Ų | 163.9 | 90% | 0.897 | 82% | 0.82 | S | S | * | * | trans | 111.2 | 127.8 | 155.6 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 189 | G | 29.3 | Very low | 33 | Very low | 75 Ų | 75 | 168 Ų | 168 | 77% | 0.773 | 83% | 0.831 | S | S | * | * | 110.3 | 50.9 | 121.9 | 0 | 0 | 0 | 0 | 0 | 122.4 | |||||
| 190 | R | 29.8 | Very low | 32.7 | Very low | 250 Ų | 250 | 165.3 Ų | 165.3 | 94% | 0.943 | 83% | 0.834 | S | S | * | * | 36.8 | 107.1 | 127.3 | -176.3 | -159.3 | -165.2 | -143.7 | 7.9 | 119.2 | |||||
| 191 | A | 29.6 | Very low | 32.5 | Very low | 94 Ų | 94 | 164.2 Ų | 164.2 | 78% | 0.777 | 84% | 0.837 | S | S | * | * | 174.3 | 124.9 | 118.9 | 0 | 0 | 0 | 0 | 0 | 117.3 | |||||
| 192 | K | 36.5 | Very low | 32.4 | Very low | 206 Ų | 206 | 162.7 Ų | 162.7 | 90% | 0.896 | 84% | 0.843 | S | S | * | * | trans | 44.4 | 113.8 | 143.4 | -62.4 | -172.7 | 174.1 | -170 | 0 | 122.3 | ||||
| 193 | K | 31.9 | Very low | 32.4 | Very low | 213 Ų | 213 | 161.5 Ų | 161.5 | 93% | 0.926 | 85% | 0.85 | S | S | * | * | -165.8 | 151.5 | 118.1 | -114.3 | -178.1 | 179.2 | -175.9 | 0 | 112.7 | |||||
| 194 | E | 32.3 | Very low | 32.9 | Very low | 184 Ų | 184 | 156.3 Ų | 156.3 | 86% | 0.86 | 85% | 0.847 | S | S | * | * | trans | -96.3 | 178.1 | 163.4 | -88 | -178 | 109.3 | 0 | 0 | 109.8 | ||||
| 195 | P | 40.4 | Very low | 33 | Very low | 118 Ų | 118 | 147.7 Ų | 147.7 | 77% | 0.766 | 84% | 0.836 | S | S | * | * | cis | -129.5 | -178.1 | 1.3 | 41.9 | -27.1 | 0 | 0 | 0 | 114.4 | ||||
| 196 | S | 29.9 | Very low | 33.5 | Very low | 108 Ų | 108 | 142.4 Ų | 142.4 | 76% | 0.755 | 83% | 0.833 | S | S | * | * | 178.2 | 159 | 129.2 | -165.2 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 197 | Q | 33.8 | Very low | 33.8 | Very low | 178 Ų | 178 | 140.4 Ų | 140.4 | 83% | 0.832 | 83% | 0.832 | S | S | * | * | trans | -94 | 143.7 | 174.1 | -63.7 | 175.3 | -15.8 | 0 | 0 | 111.4 | ||||
| 198 | H | 33.3 | Very low | 34 | Very low | 174 Ų | 174 | 139.8 Ų | 139.8 | 81% | 0.806 | 83% | 0.828 | S | S | * | * | trans | -140 | 134.3 | 158.9 | -81.5 | -81.5 | 0 | 0 | 0 | 110.9 | ||||
| 199 | Y | 32.9 | Very low | 34.2 | Very low | 222 Ų | 222 | 141.6 Ų | 141.6 | 87% | 0.871 | 82% | 0.822 | S | S | * | * | trans | -63.1 | 151.9 | 165.3 | -93.2 | -119.4 | 0 | 0 | 0 | 110.1 | ||||
| 200 | S | 36.5 | Very low | 34.2 | Very low | 110 Ų | 110 | 142.5 Ų | 142.5 | 77% | 0.769 | 82% | 0.816 | S | S | * | * | trans | -141.9 | 94.3 | 169.4 | -72.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 201 | S | 32.8 | Very low | 34.2 | Very low | 114 Ų | 114 | 135.9 Ų | 135.9 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | trans | -71 | 145.1 | 165.2 | -56.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 202 | S | 34.2 | Very low | 34.1 | Very low | 121 Ų | 121 | 136.8 Ų | 136.8 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | trans | -148.9 | 94 | 171.3 | -74.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 203 | A | 36.9 | Very low | 33.8 | Very low | 97 Ų | 97 | 132 Ų | 132 | 80% | 0.802 | 80% | 0.801 | S | S | * | * | trans | -109.7 | 129 | 167.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 204 | P | 43 | Very low | 34 | Very low | 132 Ų | 132 | 127.4 Ų | 127.4 | 86% | 0.857 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 141.4 | 176.3 | 30.8 | -33 | 0 | 0 | 0 | 111.2 | ||
| 205 | G | 34 | Very low | 34.2 | Very low | 68 Ų | 68 | 125 Ų | 125 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 168.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 206 | P | 43.5 | Very low | 33.8 | Very low | 130 Ų | 130 | 127.7 Ų | 127.7 | 84% | 0.844 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 160.1 | -175.3 | 34.1 | -36.4 | 0 | 0 | 0 | 113.5 | ||
| 207 | S | 32.4 | Very low | 34 | Very low | 124 Ų | 124 | 128 Ų | 128 | 87% | 0.867 | 79% | 0.794 | S | S | * | * | trans | -148.8 | 118.9 | 161.7 | -71.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 208 | T | 32 | Very low | 33.8 | Very low | 131 Ų | 131 | 124.8 Ų | 124.8 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | -75.8 | 159.3 | 164.6 | 40.6 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 209 | T | 33.1 | Very low | 33.7 | Very low | 124 Ų | 124 | 123.7 Ų | 123.7 | 76% | 0.761 | 80% | 0.797 | S | S | * | * | cis | -146.3 | 174.2 | -13.9 | 40.2 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 210 | S | 30.1 | Very low | 33.6 | Very low | 95 Ų | 95 | 120.6 Ų | 120.6 | 66% | 0.664 | 79% | 0.794 | S | S | * | * | cis | -167.5 | 171.2 | 37.7 | -42 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 211 | S | 29.2 | Very low | 33.1 | Very low | 111 Ų | 111 | 121.7 Ų | 121.7 | 78% | 0.776 | 80% | 0.796 | S | S | * | * | trans | 92.4 | 127.3 | 149.6 | -56.5 | 0 | 0 | 0 | 0 | 121 | ||||
| 212 | S | 28.3 | Very low | 33.2 | Very low | 113 Ų | 113 | 121.4 Ų | 121.4 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | trans | 89 | 126.1 | 155.8 | 74.4 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 213 | S | 30.4 | Very low | 33.1 | Very low | 104 Ų | 104 | 122.5 Ų | 122.5 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | 51.8 | 109.5 | 149.4 | 46.6 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 214 | T | 35.7 | Very low | 33.2 | Very low | 118 Ų | 118 | 124.5 Ų | 124.5 | 72% | 0.724 | 79% | 0.788 | S | S | * | * | trans | -17.4 | 134.8 | 141.9 | 48.8 | 0 | 0 | 0 | 0 | 116.8 | Q216 | T214-Q216 PolarHBondContact O-N 3.45Š| ||
| 215 | P | 35.3 | Very low | 33.1 | Very low | 134 Ų | 134 | 123.8 Ų | 123.8 | 87% | 0.87 | 78% | 0.781 | S | S | * | * | trans | -74.3 | 108.7 | 167 | 30.8 | -32.3 | 0 | 0 | 0 | 110.8 | ||||
| 216 | Q | 32.3 | Very low | 33.7 | Very low | 173 Ų | 173 | 125.5 Ų | 125.5 | 81% | 0.808 | 78% | 0.78 | S | S | * | * | trans | -77.9 | 154.4 | 160 | -79.1 | -169.3 | -31 | 0 | 0 | 110.2 | T214 | T214-Q216 PolarHBondContact O-N 3.45Š| ||
| 217 | P | 35 | Very low | 34 | Very low | 116 Ų | 116 | 124.9 Ų | 124.9 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | trans | -62.9 | 137.8 | 178.8 | 26.5 | -35.1 | 0 | 0 | 0 | 111.4 | L219 | P217-L219 PolarHBondContact O-N 3.13Å; P217-L219 VanDerWaalsContact O-N 3.14Å | ||
| 218 | A | 29.3 | Very low | 34.8 | Very low | 110 Ų | 110 | 121.7 Ų | 121.7 | 91% | 0.909 | 75% | 0.754 | S | S | * | * | trans | -67.2 | 111.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 219 | L | 30.3 | Very low | 35.8 | Very low | 150 Ų | 150 | 122 Ų | 122 | 79% | 0.785 | 76% | 0.758 | S | S | * | * | trans | -100.4 | 152.6 | 166.1 | -83.9 | 169.1 | 0 | 0 | 0 | 110.2 | P217 | P217-L219 PolarHBondContact O-N 3.13Å; P217-L219 VanDerWaalsContact O-N 3.14Å | ||
| 220 | L | 30.7 | Very low | 36.7 | Very low | 158 Ų | 158 | 120 Ų | 120 | 83% | 0.827 | 74% | 0.74 | S | S | * | * | trans | 70.6 | 133.2 | 178.2 | -40 | -178.2 | 0 | 0 | 0 | 112.7 | ||||
| 221 | T | 27.5 | Very low | 37.8 | Very low | 132 Ų | 132 | 119.4 Ų | 119.4 | 81% | 0.81 | 73% | 0.732 | S | S | * | * | cis | -104.9 | 119.9 | 27.2 | 45.3 | 0 | 0 | 0 | 0 | 115 | ||||
| 222 | S | 34 | Very low | 39 | Very low | 108 Ų | 108 | 121.8 Ų | 121.8 | 76% | 0.755 | 73% | 0.733 | S | S | * | * | trans | -82 | 120.7 | 149.2 | -174.8 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 223 | D | 32.3 | Very low | 40 | Very low | 145 Ų | 145 | 120.3 Ų | 120.3 | 78% | 0.775 | 73% | 0.727 | S | S | * | * | trans | -72 | 139.7 | 175.2 | -119.3 | -42.7 | 0 | 0 | 0 | 110.3 | T225 | D223-T225 PolarHBondContact O-N 3.45Å; D223-T225 VanDerWaalsContact O-N 3.16Å | ||
| 224 | D | 38.1 | Very low | 41 | Very low | 138 Ų | 138 | 121.8 Ų | 121.8 | 74% | 0.738 | 72% | 0.723 | S | S | * | * | trans | -88.3 | 86.4 | -168.5 | -172.7 | 12 | 0 | 0 | 0 | 111.5 | ||||
| 225 | T | 41.6 | Very low | 41.6 | Very low | 117 Ų | 117 | 121.7 Ų | 121.7 | 72% | 0.718 | 72% | 0.722 | S | S | * | * | trans | -100.4 | 109 | 159.1 | 54.5 | 0 | 0 | 0 | 0 | 109.3 | D223 C227 | D223-T225 PolarHBondContact O-N 3.45Å; D223-T225 VanDerWaalsContact O-N 3.16Å; T225-C227 PolarHBondContact O-N 3.08Å | ||
| 226 | P | 47.1 | Very low | 41.9 | Very low | 105 Ų | 105 | 124 Ų | 124 | 68% | 0.682 | 71% | 0.714 | S | S | * | * | trans | -63.1 | 106.1 | -177.9 | -26.5 | 35.9 | 0 | 0 | 0 | 112.3 | P228 | P226-P228 WeakPolarHBondContact O-CD 3.46Å; P226-P228 VanDerWaalsContact O-N 3.13Å | ||
| 227 | C | 50.3 | Low | 42.7 | Very low | 116 Ų | 116 | 121.6 Ų | 121.6 | 78% | 0.784 | 71% | 0.71 | S | S | * | * | trans | -53.8 | 114.7 | 174.8 | -71 | 0 | 0 | 0 | 0 | 110.6 | T225 | T225-C227 PolarHBondContact O-N 3.08Š| ||
| 228 | P | 48.3 | Very low | 43.2 | Very low | 57 Ų | 57 | 126.1 Ų | 126.1 | 37% | 0.37 | 71% | 0.712 | S | S | . | * | trans | -64.1 | 131.7 | 179.4 | -21.3 | 33.8 | 0 | 0 | 0 | 109.9 | P226 H230 | P226-P228 WeakPolarHBondContact O-CD 3.46Å; P226-P228 VanDerWaalsContact O-N 3.13Å; P228-H230 VanDerWaalsContact CB-CE1 3.41Å; P228-H230 WeakPolarHBondContact CB-CE1 3.33Å; P228-H230 PolarHBondContact O-N 2.61Å | ||
| 229 | P | 52 | Low | 44.1 | Very low | 137 Ų | 137 | 127.7 Ų | 127.7 | 89% | 0.89 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.1 | 34.9 | -165.7 | 31.3 | -38.2 | 0 | 0 | 0 | 114.5 | ||
| 230 | H | 53.1 | Low | 44.7 | Very low | 84 Ų | 84 | 126.3 Ų | 126.3 | 39% | 0.389 | 70% | 0.699 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -144.4 | 15.3 | -173.4 | 57.9 | -95.6 | 0 | 0 | 0 | 114.4 | P228 M232 I298 L302 | P228-H230 VanDerWaalsContact CB-CE1 3.41Å; P228-H230 WeakPolarHBondContact CB-CE1 3.33Å; P228-H230 PolarHBondContact O-N 2.61Å; H230-M232 PolarHBondContact O-N 3.34Å; H230-M232 VanDerWaalsContact O-N 3.08Å; H230-I298 WeakPolarHBondContact NE2-CG2 3.49Å; H230-L302 HydrophobicContact CB-CD2 4.39Å |
| 231 | V | 53.3 | Low | 45.8 | Very low | 82 Ų | 82 | 130.6 Ų | 130.6 | 50% | 0.497 | 70% | 0.704 | S | S | . | * | trans | -73.8 | 96.3 | 170.7 | -178.3 | 0 | 0 | 0 | 0 | 109.4 | Q234 | V231-Q234 HydrophobicContact CG1-CG 4.23Š| ||
| 232 | M | 53.7 | Low | 46.7 | Very low | 161 Ų | 161 | 127.5 Ų | 127.5 | 79% | 0.793 | 70% | 0.699 | S | S | * | * | trans | -97.8 | -9.9 | -177 | -65.6 | -157.5 | 71.4 | 0 | 0 | 115.2 | H230 | H230-M232 PolarHBondContact O-N 3.34Å; H230-M232 VanDerWaalsContact O-N 3.08Å | ||
| 233 | A | 50.6 | Low | 47.1 | Very low | 81 Ų | 81 | 131 Ų | 131 | 67% | 0.669 | 71% | 0.705 | S | S | * | * | trans | -153.2 | 145.3 | 176 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 234 | Q | 50.8 | Low | 48 | Very low | 135 Ų | 135 | 132.6 Ų | 132.6 | 63% | 0.631 | 71% | 0.708 | S | S | * | * | trans | -126.9 | 123.3 | 171.2 | -65.7 | 172.5 | 4.1 | 0 | 0 | 107.3 | V231 | V231-Q234 HydrophobicContact CG1-CG 4.23Š| ||
| 235 | V | 47.4 | Very low | 48.5 | Very low | 117 Ų | 117 | 132.9 Ų | 132.9 | 71% | 0.709 | 71% | 0.709 | S | S | * | * | trans | -108.7 | 109.9 | -173.4 | 179.9 | 0 | 0 | 0 | 0 | 110 | V237 | V235-V237 PolarHBondContact O-N 2.75Š| ||
| 236 | W | 42.6 | Very low | 48.6 | Very low | 183 Ų | 183 | 132.3 Ų | 132.3 | 69% | 0.693 | 71% | 0.71 | S | S | * | * | trans | -81.9 | 98 | 179.9 | -60.2 | 85.5 | 0 | 0 | 0 | 110.6 | R238 L294 | W236-R238 VanDerWaalsContact C-N 3.28Å; W236-R238 PolarHBondContact O-N 3.35Å; W236-L294 HydrophobicContact CD2-CD2 4.45Å; W236-L294 HydrophobicContact CE3-CD2 3.91Å; W236-L294 HydrophobicContact CZ3-CD1 4.47Å; W236-L294 HydrophobicContact CZ3-CD2 4.04Å | ||
| 237 | V | 49.6 | Very low | 48.7 | Very low | 121 Ų | 121 | 136 Ų | 136 | 73% | 0.733 | 72% | 0.716 | S | S | * | * | trans | -75.8 | 84.8 | 169.6 | -176 | 0 | 0 | 0 | 0 | 108.6 | V235 N239 | V235-V237 PolarHBondContact O-N 2.75Å; V237-N239 VanDerWaalsContact C-N 3.34Å; V237-N239 PolarHBondContact O-N 3.33Å | ||
| 238 | R | 43.8 | Very low | 48.7 | Very low | 212 Ų | 212 | 134 Ų | 134 | 80% | 0.8 | 70% | 0.703 | S | S | * | * | trans | -65.4 | 93.4 | 174.1 | -175.4 | -177.6 | -179.8 | 155 | 3.2 | 109.5 | W236 N240 | W236-R238 VanDerWaalsContact C-N 3.28Å; W236-R238 PolarHBondContact O-N 3.35Å; R238-N240 PolarHBondContact O-N 2.96Å | ||
| 239 | N | 49.4 | Very low | 48.7 | Very low | 142 Ų | 142 | 138.3 Ų | 138.3 | 76% | 0.759 | 72% | 0.722 | S | S | * | * | trans | -68.2 | 103.2 | 173.6 | -167 | 6.2 | 0 | 0 | 0 | 108.9 | V237 R241 | V237-N239 VanDerWaalsContact C-N 3.34Å; V237-N239 PolarHBondContact O-N 3.33Å; N239-R241 VanDerWaalsContact C-N 3.34Å; N239-R241 PolarHBondContact O-N 3.41Å | ||
| 240 | N | 42.2 | Very low | 48.7 | Very low | 122 Ų | 122 | 137.6 Ų | 137.6 | 65% | 0.652 | 71% | 0.711 | S | S | * | * | trans | -71.8 | 88.6 | -177 | -76.1 | -24.7 | 0 | 0 | 0 | 109.9 | R238 G242 | R238-N240 PolarHBondContact O-N 2.96Å; N240-G242 VanDerWaalsContact C-N 3.26Å; N240-G242 PolarHBondContact O-N 3.35Å | ||
| 241 | R | 53.4 | Low | 48.6 | Very low | 247 Ų | 247 | 140.4 Ų | 140.4 | 93% | 0.932 | 72% | 0.724 | S | S | * | * | trans | -59.3 | 83.5 | 174 | -178.5 | -177 | -80.1 | -107.7 | 1.9 | 110.4 | N239 | N239-R241 VanDerWaalsContact C-N 3.34Å; N239-R241 PolarHBondContact O-N 3.41Å | ||
| 242 | G | 47.8 | Very low | 48.3 | Very low | 68 Ų | 68 | 142.5 Ų | 142.5 | 70% | 0.701 | 73% | 0.731 | S | S | * | * | trans | -128.2 | 12.5 | -168.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | N240 | N240-G242 VanDerWaalsContact C-N 3.26Å; N240-G242 PolarHBondContact O-N 3.35Å | ||
| 243 | M | 41.1 | Very low | 48.1 | Very low | 181 Ų | 181 | 140.1 Ų | 140.1 | 89% | 0.892 | 73% | 0.73 | S | S | * | * | trans | -150.5 | 147.8 | 165.1 | -104.4 | 145.8 | 62.3 | 0 | 0 | 108.8 | ||||
| 244 | Q | 52.9 | Low | 48 | Very low | 178 Ų | 178 | 144 Ų | 144 | 83% | 0.832 | 74% | 0.735 | S | S | * | * | trans | -95 | -163.5 | 174.9 | -66 | -168 | 3.2 | 0 | 0 | 109.9 | ||||
| 245 | D | 48.3 | Very low | 47.7 | Very low | 144 Ų | 144 | 141.6 Ų | 141.6 | 77% | 0.77 | 74% | 0.738 | S | S | * | * | trans | 50 | 66.1 | 161.4 | 56 | -72.6 | 0 | 0 | 0 | 118.8 | ||||
| 246 | S | 42.3 | Very low | 47.8 | Very low | 106 Ų | 106 | 142.3 Ų | 142.3 | 74% | 0.741 | 75% | 0.747 | S | S | * | * | -158 | 117.8 | 129.1 | -87.2 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 247 | K | 50.3 | Low | 47.8 | Very low | 183 Ų | 183 | 136.9 Ų | 136.9 | 80% | 0.796 | 75% | 0.748 | S | S | * | * | 16.9 | 123.2 | 128.8 | -52.9 | 165.5 | -166.8 | 170.5 | 0 | 116.6 | |||||
| 248 | S | 50 | Low | 47.3 | Very low | 74 Ų | 74 | 134.9 Ų | 134.9 | 52% | 0.517 | 75% | 0.751 | S | S | . | * | trans | -15.5 | 120.4 | 168 | 47.9 | 0 | 0 | 0 | 0 | 117.7 | D250 | S248-D250 WeakPolarHBondContact CB-OD2 3.37Å; S248-D250 PolarHBondContact O-N 2.98Å | ||
| 249 | L | 48.8 | Very low | 47 | Very low | 146 Ų | 146 | 128.2 Ų | 128.2 | 76% | 0.764 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -69.9 | -10.3 | 170.7 | -78.3 | 172.5 | 0 | 0 | 0 | 113.8 | E251 I252 | L249-E251 PolarHBondContact O-N 2.81Å; L249-I252 HydrophobicContact CD2-CD1 3.79Å |
| 250 | D | 52.2 | Low | 46.8 | Very low | 123 Ų | 123 | 128.3 Ų | 128.3 | 66% | 0.658 | 76% | 0.757 | S | S | * | * | G | 310 helix | trans | -62.7 | -26.3 | 179.7 | -50.7 | -84.5 | 0 | 0 | 0 | 113.4 | S248 I252 S253 | S248-D250 WeakPolarHBondContact CB-OD2 3.37Å; S248-D250 PolarHBondContact O-N 2.98Å; D250-I252 VanDerWaalsContact C-N 3.31Å; D250-I252 PolarHBondContact O-N 3.13Å; D250-S253 WeakPolarHBondContact O-CB 3.21Å; D250-S253 PolarHBondContact O-N 3.34Å |
| 251 | E | 49.8 | Very low | 47 | Very low | 142 Ų | 142 | 126.1 Ų | 126.1 | 66% | 0.664 | 76% | 0.763 | S | S | * | * | G | 310 helix | trans | -67.7 | -29 | -174.7 | -164.1 | 168.1 | -160.4 | 0 | 0 | 112.7 | L249 S253 Q254 | L249-E251 PolarHBondContact O-N 2.81Å; E251-S253 PolarHBondContact O-N 3.48Å; E251-Q254 PolarHBondContact O-N 3.49Å |
| 252 | I | 47.7 | Very low | 46.3 | Very low | 127 Ų | 127 | 118.9 Ų | 118.9 | 65% | 0.651 | 76% | 0.756 | S | S | * | * | G | 310 helix | trans | -67.3 | -21.5 | 179.5 | -36.4 | 178.1 | 0 | 0 | 0 | 111.6 | L249 D250 Q254 | L249-I252 HydrophobicContact CD2-CD1 3.79Å; D250-I252 VanDerWaalsContact C-N 3.31Å; D250-I252 PolarHBondContact O-N 3.13Å; I252-Q254 VanDerWaalsContact C-N 3.34Å; I252-Q254 PolarHBondContact O-N 2.89Å |
| 253 | S | 48.4 | Very low | 46.2 | Very low | 110 Ų | 110 | 127.9 Ų | 127.9 | 77% | 0.769 | 77% | 0.769 | S | S | * | * | G | 310 helix | trans | -74.7 | -21.2 | -178.2 | -155.2 | 0 | 0 | 0 | 0 | 113.5 | D250 E251 | D250-S253 WeakPolarHBondContact O-CB 3.21Å; D250-S253 PolarHBondContact O-N 3.34Å; E251-S253 PolarHBondContact O-N 3.48Å |
| 254 | Q | 48.2 | Very low | 46 | Very low | 163 Ų | 163 | 123 Ų | 123 | 76% | 0.762 | 76% | 0.764 | S | S | * | * | G | 310 helix | trans | -92.8 | -9.5 | -175.3 | -69.2 | -172 | 62.1 | 0 | 0 | 114.7 | E251 I252 C256 | E251-Q254 PolarHBondContact O-N 3.49Å; I252-Q254 VanDerWaalsContact C-N 3.34Å; I252-Q254 PolarHBondContact O-N 2.89Å; Q254-C256 PolarHBondContact O-N 3.4Å; Q254-C256 VanDerWaalsContact O-N 3.07Å |
| 255 | A | 46.2 | Very low | 45.4 | Very low | 84 Ų | 84 | 118.7 Ų | 118.7 | 69% | 0.694 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | -11.9 | -173.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 256 | C | 48.4 | Very low | 44.7 | Very low | 133 Ų | 133 | 115.8 Ų | 115.8 | 90% | 0.899 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.3 | 43.9 | -175.2 | -69.8 | 0 | 0 | 0 | 0 | 112.8 | Q254 | Q254-C256 PolarHBondContact O-N 3.4Å; Q254-C256 VanDerWaalsContact O-N 3.07Å |
| 257 | G | 42.6 | Very low | 45 | Very low | 69 Ų | 69 | 121.6 Ų | 121.6 | 71% | 0.711 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -142.5 | 40.5 | -162.5 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||
| 258 | G | 39.3 | Very low | 44.8 | Very low | 79 Ų | 79 | 118.3 Ų | 118.3 | 81% | 0.814 | 78% | 0.778 | S | S | * | * | trans | 95.7 | 116.2 | 159.7 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 259 | G | 38.4 | Very low | 44.4 | Very low | 71 Ų | 71 | 118.4 Ų | 118.4 | 73% | 0.732 | 79% | 0.791 | S | S | * | * | trans | -77.7 | 153.2 | 163.5 | 0 | 0 | 0 | 0 | 0 | 112 | G261 | G259-G261 PolarHBondContact O-N 2.66Š| ||
| 260 | P | 44.8 | Very low | 44.6 | Very low | 145 Ų | 145 | 120.7 Ų | 120.7 | 94% | 0.942 | 80% | 0.797 | S | S | * | * | S | Bend | trans | -78.8 | 103.2 | -172.5 | 30.6 | -34.7 | 0 | 0 | 0 | 112.5 | ||
| 261 | G | 45.2 | Very low | 44.2 | Very low | 76 Ų | 76 | 119 Ų | 119 | 78% | 0.784 | 80% | 0.795 | S | S | * | * | trans | 166.3 | 67.5 | 168.3 | 0 | 0 | 0 | 0 | 0 | 119.4 | G259 | G259-G261 PolarHBondContact O-N 2.66Š| ||
| 262 | A | 39.5 | Very low | 44.4 | Very low | 95 Ų | 95 | 121 Ų | 121 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | trans | -170.3 | 98.5 | 148.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | G264 | A262-G264 PolarHBondContact O-N 3.29Š| ||
| 263 | R | 46.2 | Very low | 44.6 | Very low | 257 Ų | 257 | 118.7 Ų | 118.7 | 97% | 0.97 | 81% | 0.812 | S | S | * | * | 15.3 | 104.7 | 126.8 | -177.9 | -172.9 | -178.5 | 179.4 | 0.8 | 117.3 | |||||
| 264 | G | 35.5 | Very low | 44.6 | Very low | 77 Ų | 77 | 123.9 Ų | 123.9 | 79% | 0.794 | 81% | 0.814 | S | S | * | * | trans | 162.4 | 122.3 | 161.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | A262 | A262-G264 PolarHBondContact O-N 3.29Š| ||
| 265 | G | 40.6 | Very low | 44.6 | Very low | 89 Ų | 89 | 127.5 Ų | 127.5 | 92% | 0.918 | 82% | 0.821 | S | S | * | * | trans | -96.5 | 149.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 266 | G | 34.8 | Very low | 45 | Very low | 82 Ų | 82 | 127.8 Ų | 127.8 | 85% | 0.845 | 82% | 0.823 | S | S | * | * | trans | -164.5 | 139.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 267 | R | 48.7 | Very low | 46 | Very low | 228 Ų | 228 | 125.5 Ų | 125.5 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | trans | -88.2 | 152.5 | 174.5 | -63.7 | 168.6 | 74.4 | -114.5 | 9.9 | 109.6 | ||||
| 268 | S | 45.3 | Very low | 47.1 | Very low | 115 Ų | 115 | 129 Ų | 129 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | 50.2 | 109.4 | 155.4 | 56.6 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 269 | G | 41.1 | Very low | 48.4 | Very low | 76 Ų | 76 | 127.1 Ų | 127.1 | 78% | 0.784 | 78% | 0.781 | S | S | * | * | trans | -165.2 | 136.2 | 163.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 270 | Q | 52.9 | Low | 49.9 | Very low | 193 Ų | 193 | 125.6 Ų | 125.6 | 90% | 0.902 | 76% | 0.759 | S | S | * | * | trans | -72.5 | 140.5 | 174.1 | -67.8 | 166.5 | -90.2 | 0 | 0 | 109.9 | ||||
| 271 | S | 44.6 | Very low | 51.1 | Low | 87 Ų | 87 | 121.4 Ų | 121.4 | 61% | 0.608 | 74% | 0.737 | S | S | * | * | trans | -126.2 | 70.1 | 166.1 | 68.2 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 272 | E | 53.2 | Low | 52.5 | Low | 186 Ų | 186 | 120.2 Ų | 120.2 | 87% | 0.869 | 71% | 0.712 | S | S | * | * | trans | -50.6 | 137.7 | 157.5 | -171.2 | 174.7 | 158.5 | 0 | 0 | 109.1 | ||||
| 273 | G | 53.3 | Low | 54.2 | Low | 78 Ų | 78 | 120.8 Ų | 120.8 | 80% | 0.804 | 70% | 0.699 | S | S | * | * | trans | 125.2 | 4.7 | -172.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 274 | R | 47.5 | Very low | 55.6 | Low | 218 Ų | 218 | 115.4 Ų | 115.4 | 82% | 0.823 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -82.4 | 139.5 | 160.4 | -60.8 | -173 | -173.6 | -153.4 | -0.3 | 108.8 | A276 | R274-A276 PolarHBondContact O-N 2.99Š|
| 275 | R | 47.6 | Very low | 57.6 | Low | 239 Ų | 239 | 116.3 Ų | 116.3 | 90% | 0.902 | 67% | 0.672 | S | S | * | * | trans | -55.2 | 126 | -178.2 | -66.1 | 174.2 | 178.7 | -94.6 | 0.6 | 109.7 | T277 | R275-T277 PolarHBondContact O-N 3.39Š| ||
| 276 | A | 54.9 | Low | 59.8 | Low | 90 Ų | 90 | 112.1 Ų | 112.1 | 74% | 0.744 | 63% | 0.629 | S | S | * | * | trans | -60.4 | 110.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | R274 | R274-A276 PolarHBondContact O-N 2.99Š| ||
| 277 | T | 70.3 | Confident | 62.1 | Low | 86 Ų | 86 | 112.3 Ų | 112.3 | 53% | 0.528 | 61% | 0.614 | S | S | . | * | trans | -77.6 | 157.9 | 171.8 | 57.7 | 0 | 0 | 0 | 0 | 109.2 | R275 S279 S280 A281 | R275-T277 PolarHBondContact O-N 3.39Å; T277-S279 PolarHBondContact O-N 3.2Å; T277-S280 PolarHBondContact N-OG 2.97Å; T277-S280 PolarHBondContact O-N 3.46Å; T277-S280 PolarHBondContact O-OG 2.79Å; T277-S280 PolarHBondContact OG1-N 3.47Å; T277-A281 PolarHBondContact O-N 3.32Å | ||
| 278 | I | 65.8 | Low | 63.8 | Low | 142 Ų | 142 | 102.7 Ų | 102.7 | 73% | 0.728 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -57.7 | -38.9 | 179.4 | -60.4 | 173.3 | 0 | 0 | 0 | 110.4 | S280 A281 L282 | I278-S280 PolarHBondContact O-N 3.07Å; I278-A281 PolarHBondContact O-N 3.23Å; I278-L282 HydrophobicContact CG2-CD1 4.01Å; I278-L282 HydrophobicContact CG2-CG 4.38Å; I278-L282 WeakPolarHBondContact O-CG 3.45Å; I278-L282 PolarHBondContact O-N 2.84Å |
| 279 | S | 66.4 | Low | 65.6 | Low | 40 Ų | 40 | 100.1 Ų | 100.1 | 28% | 0.28 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -55 | -48.1 | 172.5 | -43.3 | 0 | 0 | 0 | 0 | 112.6 | T277 A281 L282 E283 | T277-S279 PolarHBondContact O-N 3.2Å; S279-A281 VanDerWaalsContact C-N 3.27Å; S279-A281 PolarHBondContact O-N 2.96Å; S279-L282 CarbonylContact O-C 3.6Å; S279-L282 PolarHBondContact O-N 3Å; S279-E283 VanDerWaalsContact O-CG 3.31Å; S279-E283 WeakPolarHBondContact O-CG 3.45Å; S279-E283 PolarHBondContact O-N 3.08Å |
| 280 | S | 68.8 | Low | 67.8 | Low | 39 Ų | 39 | 101.5 Ų | 101.5 | 27% | 0.273 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.1 | -28.7 | 179.8 | 68.9 | 0 | 0 | 0 | 0 | 113.9 | T277 I278 | T277-S280 PolarHBondContact N-OG 2.97Å; T277-S280 PolarHBondContact O-N 3.46Å; T277-S280 PolarHBondContact O-OG 2.79Å; T277-S280 PolarHBondContact OG1-N 3.47Å; I278-S280 PolarHBondContact O-N 3.07Å |
| 281 | A | 70.3 | Confident | 69.2 | Low | 57 Ų | 57 | 98.7 Ų | 98.7 | 47% | 0.471 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -74.5 | -39.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | T277 I278 S279 L284 E285 | T277-A281 PolarHBondContact O-N 3.32Å; I278-A281 PolarHBondContact O-N 3.23Å; S279-A281 VanDerWaalsContact C-N 3.27Å; S279-A281 PolarHBondContact O-N 2.96Å; A281-L284 PolarHBondContact O-N 3.38Å; A281-E285 PolarHBondContact O-N 3.26Å |
| 282 | L | 75.2 | Confident | 71.1 | Confident | 51 Ų | 51 | 97.9 Ų | 97.9 | 27% | 0.267 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -69 | -38 | 176.2 | -67.6 | 172.7 | 0 | 0 | 0 | 112.1 | I278 S279 L284 E285 G286 V288 F297 | I278-L282 HydrophobicContact CG2-CD1 4.01Å; I278-L282 HydrophobicContact CG2-CG 4.38Å; I278-L282 WeakPolarHBondContact O-CG 3.45Å; I278-L282 PolarHBondContact O-N 2.84Å; S279-L282 CarbonylContact O-C 3.6Å; S279-L282 PolarHBondContact O-N 3Å; L282-L284 PolarHBondContact O-N 3.1Å; L282-E285 CarbonylContact O-C 3.55Å; L282-E285 PolarHBondContact O-N 2.94Å; L282-G286 PolarHBondContact O-N 2.93Å; L282-V288 HydrophobicContact CB-CG2 3.53Å; L282-F297 HydrophobicContact CB-CD2 4.06Å; L282-F297 HydrophobicContact CB-CE2 3.81Å; L282-F297 HydrophobicContact CB-CZ 4.4Å; L282-F297 HydrophobicContact CD2-CD1 4.32Å; L282-F297 HydrophobicContact CD2-CD2 4.37Å; L282-F297 HydrophobicContact CD2-CE1 3.98Å; L282-F297 HydrophobicContact CD2-CE2 4.04Å; L282-F297 HydrophobicContact CD2-CG 4.5Å; L282-F297 HydrophobicContact CD2-CZ 3.83Å; L282-F297 HydrophobicContact CG-CE2 4.47Å; L282-F297 WeakPolarHBondContact O-CE2 3.32Å |
| 283 | E | 75.1 | Confident | 72.6 | Confident | 107 Ų | 107 | 96.8 Ų | 96.8 | 50% | 0.5 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.4 | -28.5 | 175.9 | -73.6 | 159.7 | -141.1 | 0 | 0 | 113.2 | S279 G286 V288 K300 | S279-E283 VanDerWaalsContact O-CG 3.31Å; S279-E283 WeakPolarHBondContact O-CG 3.45Å; S279-E283 PolarHBondContact O-N 3.08Å; E283-G286 CarbonylContact C-O 3.53Å; E283-V288 HydrophobicContact CG-CB 4.24Å; E283-V288 HydrophobicContact CG-CG2 3.99Å; E283-K300 PolarHBondContact O-NZ 2.92Å |
| 284 | L | 75.6 | Confident | 73.9 | Confident | 144 Ų | 144 | 96.2 Ų | 96.2 | 75% | 0.754 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -67.7 | -48.1 | 169.8 | -70.8 | 162.1 | 0 | 0 | 0 | 110.7 | A281 L282 K300 | A281-L284 PolarHBondContact O-N 3.38Å; L282-L284 PolarHBondContact O-N 3.1Å; L284-K300 PolarHBondContact O-NZ 3.42Å |
| 285 | E | 78.3 | Confident | 75.6 | Confident | 95 Ų | 95 | 89.7 Ų | 89.7 | 44% | 0.444 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -79 | -23.3 | -175.5 | -173.4 | 171.5 | 160 | 0 | 0 | 114.9 | A281 L282 F297 K300 K305 | A281-E285 PolarHBondContact O-N 3.26Å; L282-E285 CarbonylContact O-C 3.55Å; L282-E285 PolarHBondContact O-N 2.94Å; E285-F297 HydrophobicContact CB-CZ 4.33Å; E285-F297 HydrophobicContact CG-CZ 4.34Å; E285-K300 WeakPolarHBondContact O-CB 3.46Å; E285-K300 WeakPolarHBondContact O-CD 3.46Å; E285-K300 PolarHBondContact O-N 3.21Å; E285-K305 VanDerWaalsContact CD-NZ 3.35Å; E285-K305 IonicContact OE1-NZ 2.66Å; E285-K305 PolarHBondContact OE1-NZ 3.38Å |
| 286 | G | 85.6 | Confident | 77.3 | Confident | 2 Ų | 2 | 81.8 Ų | 81.8 | 2% | 0.021 | 48% | 0.479 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -159.2 | -155.9 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113 | L282 E283 I298 K300 | L282-G286 PolarHBondContact O-N 2.93Å; E283-G286 CarbonylContact C-O 3.53Å; G286-I298 CarbonylContact C-O 3.41Å; G286-I298 WeakPolarHBondContact CA-O 3.37Å; G286-K300 VanDerWaalsContact O-CE 3.26Å; G286-K300 WeakPolarHBondContact O-CE 3.43Å; G286-K300 PolarHBondContact O-NZ 3.34Å |
| 287 | T | 83.9 | Confident | 78.8 | Confident | 86 Ų | 86 | 81.2 Ų | 81.2 | 53% | 0.528 | 46% | 0.46 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 126.8 | 169.5 | -55.9 | 0 | 0 | 0 | 0 | 107.8 | F297 I298 | T287-F297 WeakPolarHBondContact O-CA 3.33Å; T287-I298 PolarHBondContact N-O 3.46Å; T287-I298 PolarHBondContact O-N 2.86Å |
| 288 | V | 83.3 | Confident | 79.7 | Confident | 25 Ų | 25 | 80.3 Ų | 80.3 | 15% | 0.152 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100 | 138.3 | 171.9 | -176.1 | 0 | 0 | 0 | 0 | 108.3 | L282 E283 T295 N296 F297 | L282-V288 HydrophobicContact CB-CG2 3.53Å; E283-V288 HydrophobicContact CG-CB 4.24Å; E283-V288 HydrophobicContact CG-CG2 3.99Å; V288-T295 HydrophobicContact CG1-CG2 3.94Å; V288-N296 WeakPolarHBondContact CA-O 3.49Å; V288-F297 HydrophobicContact CG2-CD2 3.93Å; V288-F297 HydrophobicContact CG2-CE2 4.46Å |
| 289 | S | 85.1 | Confident | 80.6 | Confident | 62 Ų | 62 | 74.9 Ų | 74.9 | 43% | 0.434 | 42% | 0.424 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.1 | 144.4 | 168.5 | -175.3 | 0 | 0 | 0 | 0 | 109.6 | N296 | S289-N296 PolarHBondContact N-O 3.24Å; S289-N296 PolarHBondContact O-N 3.05Å |
| 290 | H | 85.4 | Confident | 81.6 | Confident | 105 Ų | 105 | 77.7 Ų | 77.7 | 49% | 0.486 | 43% | 0.432 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 125.1 | -179.9 | -68.3 | -78 | 0 | 0 | 0 | 109.4 | L294 T295 | H290-L294 WeakPolarHBondContact CA-O 3.5Å; H290-T295 VanDerWaalsContact CE1-CG2 3.43Å; H290-T295 WeakPolarHBondContact CE1-CG2 3.45Å; H290-T295 PolarHBondContact CE1-OG1 3.43Å; H290-T295 VanDerWaalsContact CE1-OG1 3.26Å; H290-T295 PolarHBondContact ND1-OG1 3.39Å |
| 291 | E | 82.4 | Confident | 82.3 | Confident | 134 Ų | 134 | 81.2 Ų | 81.2 | 63% | 0.626 | 45% | 0.448 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -128.1 | 94.3 | -177.4 | -171.7 | 59.6 | -97.7 | 0 | 0 | 108.6 | D293 L294 | E291-D293 PolarHBondContact O-N 2.93Å; E291-L294 PolarHBondContact N-O 3.1Å; E291-L294 WeakPolarHBondContact O-CB 3.44Å; E291-L294 PolarHBondContact O-N 3.19Å |
| 292 | G | 84.7 | Confident | 83.1 | Confident | 70 Ų | 70 | 81.1 Ų | 81.1 | 72% | 0.722 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.2 | -125.9 | -165.9 | 0 | 0 | 0 | 0 | 0 | 112 | L294 | G292-L294 VanDerWaalsContact C-N 3.28Å; G292-L294 PolarHBondContact O-N 3.48Å |
| 293 | D | 84.7 | Confident | 83.5 | Confident | 163 Ų | 163 | 85.3 Ų | 85.3 | 87% | 0.872 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.3 | -7.5 | 175.7 | -70.1 | -36.6 | 0 | 0 | 0 | 113.6 | E291 | E291-D293 PolarHBondContact O-N 2.93Š|
| 294 | L | 80.6 | Confident | 83.9 | Confident | 65 Ų | 65 | 85.9 Ų | 85.9 | 34% | 0.34 | 46% | 0.46 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.8 | 134.3 | -177.5 | -63.4 | 170.2 | 0 | 0 | 0 | 111.6 | W236 H290 E291 G292 | W236-L294 HydrophobicContact CD2-CD2 4.45Å; W236-L294 HydrophobicContact CE3-CD2 3.91Å; W236-L294 HydrophobicContact CZ3-CD1 4.47Å; W236-L294 HydrophobicContact CZ3-CD2 4.04Å; H290-L294 WeakPolarHBondContact CA-O 3.5Å; E291-L294 PolarHBondContact N-O 3.1Å; E291-L294 WeakPolarHBondContact O-CB 3.44Å; E291-L294 PolarHBondContact O-N 3.19Å; G292-L294 VanDerWaalsContact C-N 3.28Å; G292-L294 PolarHBondContact O-N 3.48Å |
| 295 | T | 84.1 | Confident | 84.5 | Confident | 82 Ų | 82 | 82.9 Ų | 82.9 | 50% | 0.503 | 44% | 0.441 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.9 | 109.4 | 172.7 | -58.2 | 0 | 0 | 0 | 0 | 109.7 | V288 H290 | V288-T295 HydrophobicContact CG1-CG2 3.94Å; H290-T295 VanDerWaalsContact CE1-CG2 3.43Å; H290-T295 WeakPolarHBondContact CE1-CG2 3.45Å; H290-T295 PolarHBondContact CE1-OG1 3.43Å; H290-T295 VanDerWaalsContact CE1-OG1 3.26Å; H290-T295 PolarHBondContact ND1-OG1 3.39Å |
| 296 | N | 83.1 | Confident | 84.7 | Confident | 72 Ų | 72 | 82.2 Ų | 82.2 | 39% | 0.385 | 44% | 0.439 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.8 | 130.4 | 176.5 | -66.2 | -67.4 | 0 | 0 | 0 | 109.7 | V288 S289 | V288-N296 WeakPolarHBondContact CA-O 3.49Å; S289-N296 PolarHBondContact N-O 3.24Å; S289-N296 PolarHBondContact O-N 3.05Å |
| 297 | F | 87.3 | Confident | 84.7 | Confident | 78 Ų | 78 | 88.6 Ų | 88.6 | 34% | 0.342 | 47% | 0.466 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.8 | 121.4 | 176.3 | 177 | -119.4 | 0 | 0 | 0 | 111.5 | L282 E285 T287 V288 | L282-F297 HydrophobicContact CB-CD2 4.06Å; L282-F297 HydrophobicContact CB-CE2 3.81Å; L282-F297 HydrophobicContact CB-CZ 4.4Å; L282-F297 HydrophobicContact CD2-CD1 4.32Å; L282-F297 HydrophobicContact CD2-CD2 4.37Å; L282-F297 HydrophobicContact CD2-CE1 3.98Å; L282-F297 HydrophobicContact CD2-CE2 4.04Å; L282-F297 HydrophobicContact CD2-CG 4.5Å; L282-F297 HydrophobicContact CD2-CZ 3.83Å; L282-F297 HydrophobicContact CG-CE2 4.47Å; L282-F297 WeakPolarHBondContact O-CE2 3.32Å; E285-F297 HydrophobicContact CB-CZ 4.33Å; E285-F297 HydrophobicContact CG-CZ 4.34Å; T287-F297 WeakPolarHBondContact O-CA 3.33Å; V288-F297 HydrophobicContact CG2-CD2 3.93Å; V288-F297 HydrophobicContact CG2-CE2 4.46Å |
| 298 | I | 87.3 | Confident | 84.3 | Confident | 68 Ų | 68 | 89.7 Ų | 89.7 | 35% | 0.349 | 47% | 0.467 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.8 | 101.3 | 178.4 | -56.7 | 177.9 | 0 | 0 | 0 | 108.3 | H230 G286 T287 | H230-I298 WeakPolarHBondContact NE2-CG2 3.49Å; G286-I298 CarbonylContact C-O 3.41Å; G286-I298 WeakPolarHBondContact CA-O 3.37Å; T287-I298 PolarHBondContact N-O 3.46Å; T287-I298 PolarHBondContact O-N 2.86Å |
| 299 | T | 85.6 | Confident | 83.8 | Confident | 27 Ų | 27 | 93 Ų | 93 | 17% | 0.166 | 49% | 0.491 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.4 | 139.2 | -179.9 | -166.4 | 0 | 0 | 0 | 0 | 112.1 | L302 K305 | T299-L302 HydrophobicContact CG2-CB 3.89Å; T299-L302 HydrophobicContact CG2-CD1 3.75Å; T299-L302 HydrophobicContact CG2-CG 4.37Å; T299-K305 HydrophobicContact CG2-CD 3.85Å; T299-K305 WeakPolarHBondContact OG1-CD 3.39Å; T299-K305 WeakPolarHBondContact OG1-CE 3.38Å |
| 300 | K | 86.8 | Confident | 83.2 | Confident | 99 Ų | 99 | 94 Ų | 94 | 43% | 0.43 | 50% | 0.498 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.9 | 139 | 174.4 | -67.5 | 146.9 | -171.4 | 148.2 | 0 | 109.1 | E283 L284 E285 G286 K305 | E283-K300 PolarHBondContact O-NZ 2.92Å; L284-K300 PolarHBondContact O-NZ 3.42Å; E285-K300 WeakPolarHBondContact O-CB 3.46Å; E285-K300 WeakPolarHBondContact O-CD 3.46Å; E285-K300 PolarHBondContact O-N 3.21Å; G286-K300 VanDerWaalsContact O-CE 3.26Å; G286-K300 WeakPolarHBondContact O-CE 3.43Å; G286-K300 PolarHBondContact O-NZ 3.34Å; K300-K305 WeakPolarHBondContact O-CE 3.27Å |
| 301 | N | 84.6 | Confident | 82.4 | Confident | 114 Ų | 114 | 95.2 Ų | 95.2 | 61% | 0.61 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.7 | 47.7 | -179.3 | -83.7 | -61.9 | 0 | 0 | 0 | 114.6 | E303 Q304 K305 | N301-E303 VanDerWaalsContact C-N 3.3Å; N301-E303 PolarHBondContact O-N 2.91Å; N301-Q304 HydrophobicContact CB-CB 4.05Å; N301-Q304 PolarHBondContact O-N 3.43Å; N301-Q304 VanDerWaalsContact O-N 3.1Å; N301-K305 PolarHBondContact O-N 3.3Å |
| 302 | L | 86.9 | Confident | 81.2 | Confident | 55 Ų | 55 | 94 Ų | 94 | 29% | 0.288 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -50.8 | -43.6 | 175.5 | 178.5 | 59.6 | 0 | 0 | 0 | 113.3 | H230 T299 Q304 K305 I306 | H230-L302 HydrophobicContact CB-CD2 4.39Å; T299-L302 HydrophobicContact CG2-CB 3.89Å; T299-L302 HydrophobicContact CG2-CD1 3.75Å; T299-L302 HydrophobicContact CG2-CG 4.37Å; L302-Q304 PolarHBondContact O-N 3.36Å; L302-K305 PolarHBondContact O-N 3.31Å; L302-I306 HydrophobicContact CD1-CD1 3.83Å; L302-I306 HydrophobicContact CD1-CG1 4.11Å; L302-I306 HydrophobicContact CG-CD1 3.84Å; L302-I306 WeakPolarHBondContact O-CG1 3.42Å; L302-I306 PolarHBondContact O-N 3.18Å |
| 303 | E | 83.6 | Confident | 79.6 | Confident | 139 Ų | 139 | 96.2 Ų | 96.2 | 65% | 0.65 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -58.6 | -47.1 | 176.9 | -168.6 | -154.8 | 137.8 | 0 | 0 | 111.5 | N301 K305 I306 K307 | N301-E303 VanDerWaalsContact C-N 3.3Å; N301-E303 PolarHBondContact O-N 2.91Å; E303-K305 VanDerWaalsContact C-N 3.31Å; E303-K305 PolarHBondContact O-N 3.26Å; E303-I306 PolarHBondContact O-N 3.39Å; E303-K307 WeakPolarHBondContact O-CB 3.38Å; E303-K307 PolarHBondContact O-N 2.91Å |
| 304 | Q | 84 | Confident | 78.3 | Confident | 118 Ų | 118 | 94.8 Ų | 94.8 | 55% | 0.551 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.7 | -37.6 | 178.5 | -169.4 | -176.2 | -2.6 | 0 | 0 | 111.6 | N301 L302 K307 M308 | N301-Q304 HydrophobicContact CB-CB 4.05Å; N301-Q304 PolarHBondContact O-N 3.43Å; N301-Q304 VanDerWaalsContact O-N 3.1Å; L302-Q304 PolarHBondContact O-N 3.36Å; Q304-K307 PolarHBondContact O-N 2.92Å; Q304-M308 WeakPolarHBondContact O-CB 3.48Å; Q304-M308 VanDerWaalsContact O-CG 3.28Å; Q304-M308 WeakPolarHBondContact O-CG 3.35Å; Q304-M308 PolarHBondContact O-N 3.33Å |
| 305 | K | 86.8 | Confident | 76.6 | Confident | 82 Ų | 82 | 99.2 Ų | 99.2 | 36% | 0.357 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.2 | -47.8 | 176 | -73.3 | 167.3 | 177 | -80 | 0 | 111.1 | E285 T299 K300 N301 L302 E303 K307 M308 S309 | E285-K305 VanDerWaalsContact CD-NZ 3.35Å; E285-K305 IonicContact OE1-NZ 2.66Å; E285-K305 PolarHBondContact OE1-NZ 3.38Å; T299-K305 HydrophobicContact CG2-CD 3.85Å; T299-K305 WeakPolarHBondContact OG1-CD 3.39Å; T299-K305 WeakPolarHBondContact OG1-CE 3.38Å; K300-K305 WeakPolarHBondContact O-CE 3.27Å; N301-K305 PolarHBondContact O-N 3.3Å; L302-K305 PolarHBondContact O-N 3.31Å; E303-K305 VanDerWaalsContact C-N 3.31Å; E303-K305 PolarHBondContact O-N 3.26Å; K305-K307 VanDerWaalsContact C-N 3.32Å; K305-K307 PolarHBondContact O-N 3.07Å; K305-M308 PolarHBondContact O-N 3.48Å; K305-M308 VanDerWaalsContact O-N 3.14Å; K305-S309 PolarHBondContact O-N 3.43Å; K305-S309 PolarHBondContact O-OG 2.94Å |
| 306 | I | 82.1 | Confident | 74.7 | Confident | 81 Ų | 81 | 101.3 Ų | 101.3 | 42% | 0.415 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.9 | -40.5 | 174.2 | -67.4 | 167.8 | 0 | 0 | 0 | 111.3 | L302 E303 M308 S309 S310 | L302-I306 HydrophobicContact CD1-CD1 3.83Å; L302-I306 HydrophobicContact CD1-CG1 4.11Å; L302-I306 HydrophobicContact CG-CD1 3.84Å; L302-I306 WeakPolarHBondContact O-CG1 3.42Å; L302-I306 PolarHBondContact O-N 3.18Å; E303-I306 PolarHBondContact O-N 3.39Å; I306-M308 PolarHBondContact O-N 3.21Å; I306-S309 WeakPolarHBondContact CA-OG 3.34Å; I306-S309 PolarHBondContact O-N 3.17Å; I306-S309 PolarHBondContact O-OG 3.43Å; I306-S310 VanDerWaalsContact O-CB 3.3Å; I306-S310 WeakPolarHBondContact O-CB 3.28Å; I306-S310 PolarHBondContact O-N 3.07Å; I306-S310 PolarHBondContact O-OG 3.45Å |
| 307 | K | 86.1 | Confident | 72.9 | Confident | 136 Ų | 136 | 102.7 Ų | 102.7 | 59% | 0.591 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -69.8 | -18.8 | 177.8 | -166.3 | 171.3 | -169.5 | 165.9 | 0 | 113.7 | E303 Q304 K305 S310 | E303-K307 WeakPolarHBondContact O-CB 3.38Å; E303-K307 PolarHBondContact O-N 2.91Å; Q304-K307 PolarHBondContact O-N 2.92Å; K305-K307 VanDerWaalsContact C-N 3.32Å; K305-K307 PolarHBondContact O-N 3.07Å; K307-S310 WeakPolarHBondContact CA-OG 3.34Å |
| 308 | M | 75.6 | Confident | 70.8 | Confident | 108 Ų | 108 | 106.8 Ų | 106.8 | 53% | 0.532 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -90.9 | -39.1 | 171.4 | -72.4 | -68.6 | -72.7 | 0 | 0 | 111.8 | Q304 K305 I306 S310 K311 | Q304-M308 WeakPolarHBondContact O-CB 3.48Å; Q304-M308 VanDerWaalsContact O-CG 3.28Å; Q304-M308 WeakPolarHBondContact O-CG 3.35Å; Q304-M308 PolarHBondContact O-N 3.33Å; K305-M308 PolarHBondContact O-N 3.48Å; K305-M308 VanDerWaalsContact O-N 3.14Å; I306-M308 PolarHBondContact O-N 3.21Å; M308-S310 VanDerWaalsContact C-N 3.3Å; M308-S310 PolarHBondContact O-N 2.98Å; M308-K311 WeakPolarHBondContact O-CB 3.47Å; M308-K311 PolarHBondContact O-N 3.48Å; M308-K311 HydrophobicContact SD-CD 4.3Å; M308-K311 PolarHBondContact SD-NZ 2.7Å |
| 309 | S | 73.9 | Confident | 69 | Low | 95 Ų | 95 | 108.8 Ų | 108.8 | 66% | 0.664 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -74.5 | -16.9 | 177.4 | 69.1 | 0 | 0 | 0 | 0 | 114.2 | K305 I306 K311 | K305-S309 PolarHBondContact O-N 3.43Å; K305-S309 PolarHBondContact O-OG 2.94Å; I306-S309 WeakPolarHBondContact CA-OG 3.34Å; I306-S309 PolarHBondContact O-N 3.17Å; I306-S309 PolarHBondContact O-OG 3.43Å; S309-K311 VanDerWaalsContact C-N 3.33Å |
| 310 | S | 71.8 | Confident | 67 | Low | 84 Ų | 84 | 115 Ų | 115 | 59% | 0.587 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | -0.3 | 173.4 | 50.1 | 0 | 0 | 0 | 0 | 114 | I306 K307 M308 | I306-S310 VanDerWaalsContact O-CB 3.3Å; I306-S310 WeakPolarHBondContact O-CB 3.28Å; I306-S310 PolarHBondContact O-N 3.07Å; I306-S310 PolarHBondContact O-OG 3.45Å; K307-S310 WeakPolarHBondContact CA-OG 3.34Å; M308-S310 VanDerWaalsContact C-N 3.3Å; M308-S310 PolarHBondContact O-N 2.98Å |
| 311 | K | 68 | Low | 64.8 | Low | 129 Ų | 129 | 116.4 Ų | 116.4 | 56% | 0.561 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -72.2 | 124.3 | 163.6 | -66.5 | 176.9 | 176.7 | 176.7 | 0 | 108.4 | M308 S309 S313 | M308-K311 WeakPolarHBondContact O-CB 3.47Å; M308-K311 PolarHBondContact O-N 3.48Å; M308-K311 HydrophobicContact SD-CD 4.3Å; M308-K311 PolarHBondContact SD-NZ 2.7Å; S309-K311 VanDerWaalsContact C-N 3.33Å; K311-S313 PolarHBondContact O-N 3.14Å |
| 312 | P | 57.9 | Low | 63.1 | Low | 109 Ų | 109 | 117.3 Ų | 117.3 | 71% | 0.708 | 67% | 0.671 | S | S | * | * | trans | -61.3 | 133.8 | 167.4 | 27.5 | -33 | 0 | 0 | 0 | 108.5 | L314 | P312-L314 VanDerWaalsContact C-N 3.25Å; P312-L314 PolarHBondContact O-N 3.48Å | ||
| 313 | S | 51.9 | Low | 61 | Low | 116 Ų | 116 | 117.8 Ų | 117.8 | 81% | 0.811 | 69% | 0.69 | S | S | * | * | trans | -71.8 | 79.8 | 179.1 | 56 | 0 | 0 | 0 | 0 | 110.5 | K311 D315 | K311-S313 PolarHBondContact O-N 3.14Å; S313-D315 PolarHBondContact O-N 2.91Å; S313-D315 VanDerWaalsContact O-N 3.08Å | ||
| 314 | L | 56.1 | Low | 59.4 | Low | 133 Ų | 133 | 117.5 Ų | 117.5 | 70% | 0.696 | 70% | 0.7 | S | S | * | * | trans | -85.7 | 46.3 | -177.9 | -146 | 168.8 | 0 | 0 | 0 | 111 | P312 | P312-L314 VanDerWaalsContact C-N 3.25Å; P312-L314 PolarHBondContact O-N 3.48Å | ||
| 315 | D | 45 | Very low | 57.9 | Low | 159 Ų | 159 | 119.6 Ų | 119.6 | 85% | 0.85 | 71% | 0.713 | S | S | * | * | trans | -129.9 | 55.9 | 179 | -79.6 | -55.3 | 0 | 0 | 0 | 110 | S313 | S313-D315 PolarHBondContact O-N 2.91Å; S313-D315 VanDerWaalsContact O-N 3.08Å | ||
| 316 | C | 45.2 | Very low | 55.7 | Low | 126 Ų | 126 | 125.5 Ų | 125.5 | 85% | 0.851 | 74% | 0.735 | S | S | * | * | trans | -143.6 | 59.2 | 164.5 | -91.9 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 317 | S | 45.3 | Very low | 54.3 | Low | 101 Ų | 101 | 133.1 Ų | 133.1 | 71% | 0.706 | 76% | 0.759 | S | S | * | * | trans | -144.5 | 53.1 | -177.5 | -66.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 318 | D | 43.3 | Very low | 52.1 | Low | 163 Ų | 163 | 131.1 Ų | 131.1 | 87% | 0.872 | 76% | 0.761 | S | S | * | * | trans | -97.3 | 84.8 | 161.2 | -167.8 | 14.1 | 0 | 0 | 0 | 108.3 | ||||
| 319 | S | 48.3 | Very low | 51 | Low | 110 Ų | 110 | 138.6 Ų | 138.6 | 77% | 0.769 | 78% | 0.784 | S | S | * | * | trans | -166 | 102.2 | 173.8 | -172.9 | 0 | 0 | 0 | 0 | 108.6 | C321 | S319-C321 PolarHBondContact O-N 3Š| ||
| 320 | D | 44.5 | Very low | 49.5 | Very low | 158 Ų | 158 | 136.7 Ų | 136.7 | 85% | 0.845 | 78% | 0.779 | S | S | * | * | trans | -61 | 122.7 | -174.1 | -73.8 | -65 | 0 | 0 | 0 | 113.2 | ||||
| 321 | C | 39.2 | Very low | 48.6 | Very low | 129 Ų | 129 | 140.9 Ų | 140.9 | 87% | 0.872 | 79% | 0.794 | S | S | * | * | trans | -154.3 | 105.1 | 155 | -139.8 | 0 | 0 | 0 | 0 | 111.5 | S319 | S319-C321 PolarHBondContact O-N 3Š| ||
| 322 | S | 50.6 | Low | 47.6 | Very low | 132 Ų | 132 | 139.9 Ų | 139.9 | 92% | 0.923 | 80% | 0.803 | S | S | * | * | trans | -72.1 | 126 | -179.7 | -71.5 | 0 | 0 | 0 | 0 | 112 | ||||
| 323 | G | 42.8 | Very low | 47.2 | Very low | 66 Ų | 66 | 145.1 Ų | 145.1 | 68% | 0.68 | 81% | 0.809 | S | S | * | * | trans | -149.7 | 136 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 324 | P | 49.8 | Very low | 47 | Very low | 132 Ų | 132 | 148.4 Ų | 148.4 | 86% | 0.857 | 80% | 0.804 | S | S | * | * | trans | -76.2 | 154.9 | -172.6 | 30.4 | -35.3 | 0 | 0 | 0 | 113.6 | Y326 | P324-Y326 PolarHBondContact O-N 3.12Š| ||
| 325 | I | 52.6 | Low | 46.8 | Very low | 162 Ų | 162 | 147.4 Ų | 147.4 | 83% | 0.831 | 81% | 0.805 | S | S | * | * | trans | -62.5 | 121.9 | -173.8 | -59.9 | 171.5 | 0 | 0 | 0 | 111.8 | ||||
| 326 | Y | 39.9 | Very low | 47.3 | Very low | 207 Ų | 207 | 142.8 Ų | 142.8 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | trans | -119 | 131.9 | 155.8 | -146.2 | -96.2 | 0 | 0 | 0 | 110.4 | P324 S328 | P324-Y326 PolarHBondContact O-N 3.12Å; Y326-S328 VanDerWaalsContact C-N 3.31Å; Y326-S328 PolarHBondContact O-N 3.4Å | ||
| 327 | R | 51.6 | Low | 48 | Very low | 241 Ų | 241 | 143.1 Ų | 143.1 | 91% | 0.909 | 78% | 0.782 | S | S | * | * | trans | -77.3 | 77 | -179.2 | -72.5 | -176.3 | 179.6 | -103.2 | 5.7 | 111.1 | ||||
| 328 | S | 40.6 | Very low | 48.9 | Very low | 93 Ų | 93 | 144.1 Ų | 144.1 | 65% | 0.65 | 78% | 0.778 | S | S | * | * | trans | -98.2 | 107.9 | 174.5 | -69.7 | 0 | 0 | 0 | 0 | 111.4 | Y326 G330 | Y326-S328 VanDerWaalsContact C-N 3.31Å; Y326-S328 PolarHBondContact O-N 3.4Å; S328-G330 PolarHBondContact O-N 3.05Å | ||
| 329 | R | 53.4 | Low | 50.4 | Low | 265 Ų | 265 | 141.2 Ų | 141.2 | 100% | 1 | 77% | 0.768 | S | S | * | * | trans | -69.5 | 69.8 | 166.9 | -172.1 | -164.2 | -154.7 | -174.3 | 7.4 | 109.4 | ||||
| 330 | G | 42.1 | Very low | 51.7 | Low | 55 Ų | 55 | 142.1 Ų | 142.1 | 57% | 0.567 | 77% | 0.772 | S | S | * | * | trans | -123.8 | 107.2 | -173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | S328 S332 | S328-G330 PolarHBondContact O-N 3.05Å; G330-S332 PolarHBondContact O-N 2.68Å | ||
| 331 | L | 52.1 | Low | 53.4 | Low | 173 Ų | 173 | 140.4 Ų | 140.4 | 91% | 0.906 | 76% | 0.761 | S | S | * | * | trans | -73.3 | 51.1 | 158.9 | -78.7 | 168.1 | 0 | 0 | 0 | 110.3 | R333 | L331-R333 PolarHBondContact O-N 3.36Š| ||
| 332 | S | 47.8 | Very low | 55.7 | Low | 107 Ų | 107 | 138.1 Ų | 138.1 | 75% | 0.748 | 74% | 0.74 | S | S | * | * | trans | -73.7 | 71.1 | 160.7 | -164.6 | 0 | 0 | 0 | 0 | 107.6 | G330 R334 | G330-S332 PolarHBondContact O-N 2.68Å; S332-R334 PolarHBondContact O-N 3.24Å | ||
| 333 | R | 48.9 | Very low | 57.4 | Low | 219 Ų | 219 | 136 Ų | 136 | 83% | 0.826 | 72% | 0.723 | S | S | * | * | trans | -52.8 | 123 | 140.2 | -68.8 | -172.5 | 179.5 | -150.2 | 1.3 | 104 | L331 P335 | L331-R333 PolarHBondContact O-N 3.36Å; R333-P335 VanDerWaalsContact O-N 3.14Å | ||
| 334 | R | 47 | Very low | 59.6 | Low | 186 Ų | 186 | 136.3 Ų | 136.3 | 70% | 0.702 | 71% | 0.712 | S | S | * | * | trans | -37.8 | 126 | 158.8 | 163.4 | 177.6 | 170 | 159.8 | -2.4 | 106.3 | S332 A336 D337 | S332-R334 PolarHBondContact O-N 3.24Å; R334-A336 PolarHBondContact O-N 3.27Å; R334-D337 IonicContact CZ-OD2 3.44Å; R334-D337 IonicContact NE-OD2 3.36Å; R334-D337 PolarHBondContact NE-OD2 2.94Å; R334-D337 IonicContact NH2-OD2 2.71Å; R334-D337 PolarHBondContact NH2-OD2 3.5Å | ||
| 335 | P | 53.6 | Low | 61.7 | Low | 111 Ų | 111 | 134.1 Ų | 134.1 | 72% | 0.721 | 70% | 0.696 | S | S | * | * | trans | -48.8 | 113.4 | 173.1 | -25.9 | 34.3 | 0 | 0 | 0 | 106.2 | R333 D337 | R333-P335 VanDerWaalsContact O-N 3.14Å; P335-D337 PolarHBondContact O-N 3.42Å | ||
| 336 | A | 55.4 | Low | 63.6 | Low | 62 Ų | 62 | 131 Ų | 131 | 51% | 0.512 | 68% | 0.681 | S | S | . | * | trans | -60 | 144.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 106.7 | R334 I338 | R334-A336 PolarHBondContact O-N 3.27Å; A336-I338 HydrophobicContact CB-CD1 3.71Å; A336-I338 HydrophobicContact CB-CG1 3.77Å; A336-I338 PolarHBondContact O-N 3.27Å | ||
| 337 | D | 58.7 | Low | 66.2 | Low | 134 Ų | 134 | 126.4 Ų | 126.4 | 72% | 0.717 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -73 | 54 | -179.9 | -66 | -77.2 | 0 | 0 | 0 | 110.6 | R334 P335 | R334-D337 IonicContact CZ-OD2 3.44Å; R334-D337 IonicContact NE-OD2 3.36Å; R334-D337 PolarHBondContact NE-OD2 2.94Å; R334-D337 IonicContact NH2-OD2 2.71Å; R334-D337 PolarHBondContact NH2-OD2 3.5Å; P335-D337 PolarHBondContact O-N 3.42Å |
| 338 | I | 64.8 | Low | 68.3 | Low | 121 Ų | 121 | 117.9 Ų | 117.9 | 62% | 0.621 | 64% | 0.642 | S | S | * | * | P | Polyproline II helix | trans | -93.1 | 117.5 | 173.3 | -59.4 | 172.4 | 0 | 0 | 0 | 104.8 | A336 | A336-I338 HydrophobicContact CB-CD1 3.71Å; A336-I338 HydrophobicContact CB-CG1 3.77Å; A336-I338 PolarHBondContact O-N 3.27Å |
| 339 | P | 74.8 | Confident | 70.9 | Confident | 103 Ų | 103 | 118.6 Ų | 118.6 | 67% | 0.669 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 148.9 | 174.1 | 26 | -33.7 | 0 | 0 | 0 | 110 | I341 | P339-I341 PolarHBondContact O-N 3.09Š|
| 340 | P | 75.4 | Confident | 72.9 | Confident | 129 Ų | 129 | 111 Ų | 111 | 84% | 0.838 | 61% | 0.614 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 126.7 | -178.3 | 23.4 | -33.7 | 0 | 0 | 0 | 110.2 | D342 | P340-D342 PolarHBondContact O-N 3.41Š|
| 341 | I | 79.2 | Confident | 75.5 | Confident | 121 Ų | 121 | 113.1 Ų | 113.1 | 62% | 0.621 | 61% | 0.605 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 125.3 | -179 | -59 | 173.4 | 0 | 0 | 0 | 108.2 | P339 P343 L346 | P339-I341 PolarHBondContact O-N 3.09Å; I341-P343 WeakPolarHBondContact O-CD 3.47Å; I341-L346 HydrophobicContact CG2-CD1 3.93Å; I341-L346 HydrophobicContact CG2-CD2 4.35Å; I341-L346 HydrophobicContact CG2-CG 4.02Å |
| 342 | D | 87.9 | Confident | 77.7 | Confident | 82 Ų | 82 | 109.1 Ų | 109.1 | 44% | 0.439 | 58% | 0.581 | S | S | . | * | P | Polyproline II helix | trans | -64.5 | 119.7 | 177.3 | -168.3 | -33.9 | 0 | 0 | 0 | 109.8 | P340 T344 V345 | P340-D342 PolarHBondContact O-N 3.41Å; D342-T344 PolarHBondContact O-N 3.18Å; D342-T344 WeakPolarHBondContact OD1-CB 3.49Å; D342-T344 WeakPolarHBondContact OD1-CG2 3.39Å; D342-T344 PolarHBondContact OD1-N 2.86Å; D342-T344 PolarHBondContact OD1-OG1 3.4Å; D342-T344 PolarHBondContact OD2-OG1 3.12Å; D342-V345 HydrophobicContact CB-CG2 4.09Å; D342-V345 PolarHBondContact O-N 3.12Å |
| 343 | P | 87.1 | Confident | 80 | Confident | 86 Ų | 86 | 108.1 Ų | 108.1 | 56% | 0.558 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -66.2 | -21.7 | -179.7 | 28.2 | -35.5 | 0 | 0 | 0 | 112.8 | I341 L346 L347 | I341-P343 WeakPolarHBondContact O-CD 3.47Å; P343-L346 PolarHBondContact O-N 2.99Å; P343-L347 WeakPolarHBondContact O-CG 3.44Å; P343-L347 PolarHBondContact O-N 3.35Å; P343-L347 VanDerWaalsContact O-N 3.13Å |
| 344 | T | 89.1 | Confident | 82.3 | Confident | 73 Ų | 73 | 103.2 Ų | 103.2 | 45% | 0.448 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.7 | -44.5 | 176.6 | 63.2 | 0 | 0 | 0 | 0 | 111 | D342 L346 L347 D348 | D342-T344 PolarHBondContact O-N 3.18Å; D342-T344 WeakPolarHBondContact OD1-CB 3.49Å; D342-T344 WeakPolarHBondContact OD1-CG2 3.39Å; D342-T344 PolarHBondContact OD1-N 2.86Å; D342-T344 PolarHBondContact OD1-OG1 3.4Å; D342-T344 PolarHBondContact OD2-OG1 3.12Å; T344-L346 VanDerWaalsContact C-N 3.26Å; T344-L346 PolarHBondContact O-N 3.42Å; T344-L347 PolarHBondContact O-N 2.68Å; T344-L347 VanDerWaalsContact O-N 3.08Å; T344-D348 PolarHBondContact O-N 3.42Å |
| 345 | V | 93.2 | Very high | 84.7 | Confident | 87 Ų | 87 | 98.9 Ų | 98.9 | 53% | 0.527 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.6 | -33 | 178.1 | -179.7 | 0 | 0 | 0 | 0 | 111.9 | D342 L349 | D342-V345 HydrophobicContact CB-CG2 4.09Å; D342-V345 PolarHBondContact O-N 3.12Å; V345-L349 VanDerWaalsContact O-CB 3.27Å; V345-L349 WeakPolarHBondContact O-CB 3.37Å; V345-L349 PolarHBondContact O-N 2.96Å |
| 346 | L | 92.8 | Very high | 86.9 | Confident | 96 Ų | 96 | 98 Ų | 98 | 50% | 0.503 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -70.1 | -39.9 | 174.1 | -68.2 | 174.9 | 0 | 0 | 0 | 112.2 | I341 P343 T344 Q350 | I341-L346 HydrophobicContact CG2-CD1 3.93Å; I341-L346 HydrophobicContact CG2-CD2 4.35Å; I341-L346 HydrophobicContact CG2-CG 4.02Å; P343-L346 PolarHBondContact O-N 2.99Å; T344-L346 VanDerWaalsContact C-N 3.26Å; T344-L346 PolarHBondContact O-N 3.42Å; L346-Q350 WeakPolarHBondContact O-CB 3.46Å; L346-Q350 PolarHBondContact O-N 3.38Å |
| 347 | L | 94.3 | Very high | 88.9 | Confident | 110 Ų | 110 | 97.9 Ų | 97.9 | 58% | 0.576 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -69.7 | -37.9 | 175.4 | -67.8 | 171 | 0 | 0 | 0 | 111.9 | P343 T344 Q350 R351 | P343-L347 WeakPolarHBondContact O-CG 3.44Å; P343-L347 PolarHBondContact O-N 3.35Å; P343-L347 VanDerWaalsContact O-N 3.13Å; T344-L347 PolarHBondContact O-N 2.68Å; T344-L347 VanDerWaalsContact O-N 3.08Å; L347-Q350 PolarHBondContact O-N 3.44Å; L347-R351 WeakPolarHBondContact O-CB 3.03Å; L347-R351 PolarHBondContact O-N 2.96Å |
| 348 | D | 95.7 | Very high | 90.8 | Very high | 62 Ų | 62 | 96.8 Ų | 96.8 | 33% | 0.332 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.9 | -46.3 | 173.5 | -73.5 | -26.5 | 0 | 0 | 0 | 111.3 | T344 Q350 R351 H352 | T344-D348 PolarHBondContact O-N 3.42Å; D348-Q350 VanDerWaalsContact C-N 3.32Å; D348-Q350 PolarHBondContact O-N 3.46Å; D348-R351 PolarHBondContact O-N 3.2Å; D348-R351 IonicContact OD1-CZ 3.17Å; D348-R351 IonicContact OD1-NH1 2.68Å; D348-R351 PolarHBondContact OD1-NH1 2.68Å; D348-R351 IonicContact OD1-NH2 2.77Å; D348-R351 PolarHBondContact OD1-NH2 3.14Å; D348-H352 PolarHBondContact O-CD2 3.45Å; D348-H352 PolarHBondContact O-N 2.9Å |
| 349 | L | 95.8 | Very high | 92.4 | Very high | 108 Ų | 108 | 94.3 Ų | 94.3 | 57% | 0.565 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.5 | -40.5 | 174.8 | 179.9 | 62 | 0 | 0 | 0 | 111.7 | V345 T353 | V345-L349 VanDerWaalsContact O-CB 3.27Å; V345-L349 WeakPolarHBondContact O-CB 3.37Å; V345-L349 PolarHBondContact O-N 2.96Å; L349-T353 WeakPolarHBondContact O-CB 3.27Å; L349-T353 PolarHBondContact O-N 2.85Å; L349-T353 PolarHBondContact O-OG1 2.96Å |
| 350 | Q | 95.1 | Very high | 93.5 | Very high | 105 Ų | 105 | 92.8 Ų | 92.8 | 49% | 0.491 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.8 | -48.7 | 174.1 | -179.5 | -177.8 | -31.5 | 0 | 0 | 111.1 | L346 L347 D348 T353 Q354 | L346-Q350 WeakPolarHBondContact O-CB 3.46Å; L346-Q350 PolarHBondContact O-N 3.38Å; L347-Q350 PolarHBondContact O-N 3.44Å; D348-Q350 VanDerWaalsContact C-N 3.32Å; D348-Q350 PolarHBondContact O-N 3.46Å; Q350-T353 PolarHBondContact O-N 3.42Å; Q350-Q354 WeakPolarHBondContact O-CG 3.45Å; Q350-Q354 PolarHBondContact O-N 3.47Å |
| 351 | R | 97.3 | Very high | 94.6 | Very high | 100 Ų | 100 | 91.2 Ų | 91.2 | 38% | 0.377 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -57.7 | -51.7 | 178 | -178.4 | -171.5 | 59 | -109.5 | -8.3 | 110.9 | L347 D348 T353 Q354 E355 | L347-R351 WeakPolarHBondContact O-CB 3.03Å; L347-R351 PolarHBondContact O-N 2.96Å; D348-R351 PolarHBondContact O-N 3.2Å; D348-R351 IonicContact OD1-CZ 3.17Å; D348-R351 IonicContact OD1-NH1 2.68Å; D348-R351 PolarHBondContact OD1-NH1 2.68Å; D348-R351 IonicContact OD1-NH2 2.77Å; D348-R351 PolarHBondContact OD1-NH2 3.14Å; R351-T353 VanDerWaalsContact C-N 3.28Å; R351-T353 PolarHBondContact O-N 2.94Å; R351-Q354 CarbonylContact O-C 3.59Å; R351-Q354 WeakPolarHBondContact O-CA 3.31Å; R351-Q354 WeakPolarHBondContact O-CB 3.46Å; R351-Q354 PolarHBondContact O-N 3.22Å; R351-E355 WeakPolarHBondContact CD-OE1 3.41Å; R351-E355 HydrophobicContact CG-CG 4.36Å; R351-E355 VanDerWaalsContact CG-OE1 3.28Å; R351-E355 WeakPolarHBondContact CG-OE1 3.49Å; R351-E355 IonicContact NE-OE1 3.56Å; R351-E355 WeakPolarHBondContact O-CG 3.31Å; R351-E355 PolarHBondContact O-N 2.77Å |
| 352 | H | 97.1 | Very high | 95.5 | Very high | 89 Ų | 89 | 90.3 Ų | 90.3 | 41% | 0.412 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.9 | -32.9 | 179.6 | -66.5 | -47.7 | 0 | 0 | 0 | 112.8 | D348 E355 V356 | D348-H352 PolarHBondContact O-CD2 3.45Å; D348-H352 PolarHBondContact O-N 2.9Å; H352-E355 IonicContact CE1-OE2 3.62Å; H352-E355 IonicContact CG-OE2 3.19Å; H352-E355 IonicContact ND1-OE1 3.72Å; H352-E355 IonicContact ND1-OE2 2.84Å; H352-E355 PolarHBondContact ND1-OE2 3.43Å; H352-V356 WeakPolarHBondContact O-CB 3.45Å; H352-V356 VanDerWaalsContact O-CG2 3.3Å; H352-V356 WeakPolarHBondContact O-CG2 3.25Å; H352-V356 PolarHBondContact O-N 3.39Å |
| 353 | T | 96.9 | Very high | 95.9 | Very high | 87 Ų | 87 | 92.4 Ų | 92.4 | 53% | 0.534 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.6 | -38.9 | 172.1 | -56.2 | 0 | 0 | 0 | 0 | 111.7 | L349 Q350 R351 A357 | L349-T353 WeakPolarHBondContact O-CB 3.27Å; L349-T353 PolarHBondContact O-N 2.85Å; L349-T353 PolarHBondContact O-OG1 2.96Å; Q350-T353 PolarHBondContact O-N 3.42Å; R351-T353 VanDerWaalsContact C-N 3.28Å; R351-T353 PolarHBondContact O-N 2.94Å; T353-A357 WeakPolarHBondContact O-CB 3.13Å; T353-A357 PolarHBondContact O-N 2.63Å |
| 354 | Q | 97.7 | Very high | 96.5 | Very high | 115 Ų | 115 | 94.5 Ų | 94.5 | 54% | 0.537 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.4 | -41.5 | 175.6 | -71.5 | 175.5 | -27.7 | 0 | 0 | 112.2 | Q350 R351 A357 H358 | Q350-Q354 WeakPolarHBondContact O-CG 3.45Å; Q350-Q354 PolarHBondContact O-N 3.47Å; R351-Q354 CarbonylContact O-C 3.59Å; R351-Q354 WeakPolarHBondContact O-CA 3.31Å; R351-Q354 WeakPolarHBondContact O-CB 3.46Å; R351-Q354 PolarHBondContact O-N 3.22Å; Q354-A357 PolarHBondContact O-N 3.25Å; Q354-H358 WeakPolarHBondContact O-CB 3.34Å; Q354-H358 PolarHBondContact O-N 2.86Å |
| 355 | E | 97.8 | Very high | 96.9 | Very high | 96 Ų | 96 | 96.3 Ų | 96.3 | 45% | 0.449 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58.7 | -46.8 | 174.1 | -72 | 165.9 | 180 | 0 | 0 | 111.4 | R351 H352 H358 S359 | R351-E355 WeakPolarHBondContact CD-OE1 3.41Å; R351-E355 HydrophobicContact CG-CG 4.36Å; R351-E355 VanDerWaalsContact CG-OE1 3.28Å; R351-E355 WeakPolarHBondContact CG-OE1 3.49Å; R351-E355 IonicContact NE-OE1 3.56Å; R351-E355 WeakPolarHBondContact O-CG 3.31Å; R351-E355 PolarHBondContact O-N 2.77Å; H352-E355 IonicContact CE1-OE2 3.62Å; H352-E355 IonicContact CG-OE2 3.19Å; H352-E355 IonicContact ND1-OE1 3.72Å; H352-E355 IonicContact ND1-OE2 2.84Å; H352-E355 PolarHBondContact ND1-OE2 3.43Å; E355-H358 PolarHBondContact O-N 3.26Å; E355-S359 WeakPolarHBondContact O-CB 3.48Å; E355-S359 PolarHBondContact O-N 2.98Å |
| 356 | V | 98.2 | Very high | 97.2 | Very high | 93 Ų | 93 | 96 Ų | 96 | 56% | 0.564 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65 | -44 | 176.4 | 170.1 | 0 | 0 | 0 | 0 | 111.4 | H352 H358 S359 V360 | H352-V356 WeakPolarHBondContact O-CB 3.45Å; H352-V356 VanDerWaalsContact O-CG2 3.3Å; H352-V356 WeakPolarHBondContact O-CG2 3.25Å; H352-V356 PolarHBondContact O-N 3.39Å; V356-H358 PolarHBondContact O-N 3.27Å; V356-S359 WeakPolarHBondContact O-CB 3.42Å; V356-S359 PolarHBondContact O-N 3.03Å; V356-V360 WeakPolarHBondContact O-CG2 3.42Å; V356-V360 PolarHBondContact O-N 3.48Å |
| 357 | A | 98.1 | Very high | 97.4 | Very high | 59 Ų | 59 | 96.4 Ų | 96.4 | 49% | 0.488 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.6 | -45.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112 | T353 Q354 V360 E361 | T353-A357 WeakPolarHBondContact O-CB 3.13Å; T353-A357 PolarHBondContact O-N 2.63Å; Q354-A357 PolarHBondContact O-N 3.25Å; A357-V360 PolarHBondContact O-N 3.41Å; A357-E361 PolarHBondContact O-N 2.95Å |
| 358 | H | 98.3 | Very high | 97.6 | Very high | 110 Ų | 110 | 95 Ų | 95 | 51% | 0.509 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.3 | -39.7 | 175.5 | -178.5 | -89.6 | 0 | 0 | 0 | 112.1 | Q354 E355 V356 V360 E361 M362 | Q354-H358 WeakPolarHBondContact O-CB 3.34Å; Q354-H358 PolarHBondContact O-N 2.86Å; E355-H358 PolarHBondContact O-N 3.26Å; V356-H358 PolarHBondContact O-N 3.27Å; H358-V360 PolarHBondContact O-N 2.94Å; H358-E361 PolarHBondContact O-N 3.42Å; H358-M362 WeakPolarHBondContact O-CB 3.43Å; H358-M362 VanDerWaalsContact O-CG 3.28Å; H358-M362 WeakPolarHBondContact O-CG 3.39Å; H358-M362 PolarHBondContact O-N 2.92Å |
| 359 | S | 97.8 | Very high | 97.7 | Very high | 69 Ų | 69 | 93.7 Ų | 93.7 | 48% | 0.483 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.4 | -44.6 | 175.2 | -173.2 | 0 | 0 | 0 | 0 | 111.9 | E355 V356 M362 M363 | E355-S359 WeakPolarHBondContact O-CB 3.48Å; E355-S359 PolarHBondContact O-N 2.98Å; V356-S359 WeakPolarHBondContact O-CB 3.42Å; V356-S359 PolarHBondContact O-N 3.03Å; S359-M362 PolarHBondContact O-N 3.01Å; S359-M363 WeakPolarHBondContact O-CB 3.39Å; S359-M363 PolarHBondContact O-N 3.41Å |
| 360 | V | 98.4 | Very high | 97.8 | Very high | 72 Ų | 72 | 91.8 Ų | 91.8 | 44% | 0.436 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.7 | -41.9 | 174.8 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | V356 A357 H358 M362 M363 M364 | V356-V360 WeakPolarHBondContact O-CG2 3.42Å; V356-V360 PolarHBondContact O-N 3.48Å; A357-V360 PolarHBondContact O-N 3.41Å; H358-V360 PolarHBondContact O-N 2.94Å; V360-M362 PolarHBondContact O-N 3.38Å; V360-M363 WeakPolarHBondContact O-CB 3.34Å; V360-M363 PolarHBondContact O-N 3.05Å; V360-M364 HydrophobicContact CG1-CG 4.41Å; V360-M364 HydrophobicContact CG1-SD 4.28Å; V360-M364 WeakPolarHBondContact O-CG 3.4Å; V360-M364 PolarHBondContact O-N 3.49Å |
| 361 | E | 98.1 | Very high | 98 | Very high | 96 Ų | 96 | 90.7 Ų | 90.7 | 45% | 0.449 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.7 | -44 | 177.4 | -164.4 | -168.1 | 160 | 0 | 0 | 111.9 | A357 H358 M364 K365 | A357-E361 PolarHBondContact O-N 2.95Å; H358-E361 PolarHBondContact O-N 3.42Å; E361-M364 PolarHBondContact O-N 3.42Å; E361-K365 VanDerWaalsContact CD-NZ 3.32Å; E361-K365 HydrophobicContact CG-CD 4.48Å; E361-K365 WeakPolarHBondContact O-CG 3.31Å; E361-K365 PolarHBondContact O-N 2.95Å; E361-K365 WeakPolarHBondContact OE1-CE 3.44Å; E361-K365 IonicContact OE1-NZ 2.91Å; E361-K365 PolarHBondContact OE1-NZ 3.07Å |
| 362 | M | 98 | Very high | 98.1 | Very high | 101 Ų | 101 | 91.5 Ų | 91.5 | 50% | 0.498 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.4 | -37.9 | 175.6 | -67.9 | -67.8 | -86 | 0 | 0 | 111.9 | H358 S359 V360 K365 S366 | H358-M362 WeakPolarHBondContact O-CB 3.43Å; H358-M362 VanDerWaalsContact O-CG 3.28Å; H358-M362 WeakPolarHBondContact O-CG 3.39Å; H358-M362 PolarHBondContact O-N 2.92Å; S359-M362 PolarHBondContact O-N 3.01Å; V360-M362 PolarHBondContact O-N 3.38Å; M362-K365 PolarHBondContact O-N 3.46Å; M362-K365 HydrophobicContact SD-CD 4.36Å; M362-S366 WeakPolarHBondContact O-CB 3.43Å; M362-S366 PolarHBondContact O-N 3.47Å |
| 363 | M | 98.3 | Very high | 98.1 | Very high | 127 Ų | 127 | 91.9 Ų | 91.9 | 63% | 0.626 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63.9 | -43.5 | 173.6 | -170.4 | -173.3 | -60.6 | 0 | 0 | 111.8 | S359 V360 S366 L367 | S359-M363 WeakPolarHBondContact O-CB 3.39Å; S359-M363 PolarHBondContact O-N 3.41Å; V360-M363 WeakPolarHBondContact O-CB 3.34Å; V360-M363 PolarHBondContact O-N 3.05Å; M363-S366 PolarHBondContact O-N 2.9Å; M363-L367 WeakPolarHBondContact O-CB 3.43Å; M363-L367 PolarHBondContact O-N 2.7Å |
| 364 | M | 98.3 | Very high | 98.2 | Very high | 130 Ų | 130 | 92.6 Ų | 92.6 | 64% | 0.64 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.2 | -41.7 | 176.6 | -72.5 | -174.7 | 72.1 | 0 | 0 | 112.2 | V360 E361 L367 N368 | V360-M364 HydrophobicContact CG1-CG 4.41Å; V360-M364 HydrophobicContact CG1-SD 4.28Å; V360-M364 WeakPolarHBondContact O-CG 3.4Å; V360-M364 PolarHBondContact O-N 3.49Å; E361-M364 PolarHBondContact O-N 3.42Å; M364-L367 PolarHBondContact O-N 3.49Å; M364-N368 WeakPolarHBondContact O-CB 3.27Å; M364-N368 PolarHBondContact O-N 3.2Å |
| 365 | K | 98.4 | Very high | 98.2 | Very high | 110 Ų | 110 | 90.9 Ų | 90.9 | 48% | 0.478 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.9 | -46.2 | 173.6 | -73.5 | 168.3 | -177.4 | 167.5 | 0 | 111.5 | E361 M362 N368 G369 | E361-K365 VanDerWaalsContact CD-NZ 3.32Å; E361-K365 HydrophobicContact CG-CD 4.48Å; E361-K365 WeakPolarHBondContact O-CG 3.31Å; E361-K365 PolarHBondContact O-N 2.95Å; E361-K365 WeakPolarHBondContact OE1-CE 3.44Å; E361-K365 IonicContact OE1-NZ 2.91Å; E361-K365 PolarHBondContact OE1-NZ 3.07Å; M362-K365 PolarHBondContact O-N 3.46Å; M362-K365 HydrophobicContact SD-CD 4.36Å; K365-N368 PolarHBondContact O-N 3.24Å; K365-G369 PolarHBondContact O-N 2.79Å |
| 366 | S | 98.1 | Very high | 98.2 | Very high | 81 Ų | 81 | 89.2 Ų | 89.2 | 57% | 0.566 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.6 | -47.3 | 177.7 | -176.8 | 0 | 0 | 0 | 0 | 112.5 | M362 M363 N368 G369 T370 | M362-S366 WeakPolarHBondContact O-CB 3.43Å; M362-S366 PolarHBondContact O-N 3.47Å; M363-S366 PolarHBondContact O-N 2.9Å; S366-N368 PolarHBondContact O-N 3.43Å; S366-G369 PolarHBondContact O-N 2.89Å; S366-T370 PolarHBondContact O-N 3.25Å; S366-T370 PolarHBondContact O-OG1 3.26Å |
| 367 | L | 98.4 | Very high | 98.2 | Very high | 105 Ų | 105 | 89 Ų | 89 | 55% | 0.55 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.3 | -45.5 | 176.6 | 178.3 | 61.2 | 0 | 0 | 0 | 111.7 | M363 M364 G369 T370 I371 | M363-L367 WeakPolarHBondContact O-CB 3.43Å; M363-L367 PolarHBondContact O-N 2.7Å; M364-L367 PolarHBondContact O-N 3.49Å; L367-G369 PolarHBondContact O-N 2.81Å; L367-T370 PolarHBondContact O-N 3.26Å; L367-I371 HydrophobicContact CD1-CD1 4.1Å; L367-I371 HydrophobicContact CD1-CG1 4.44Å; L367-I371 HydrophobicContact CG-CD1 4Å; L367-I371 WeakPolarHBondContact O-CG1 3.25Å; L367-I371 PolarHBondContact O-N 3.03Å |
| 368 | N | 98.1 | Very high | 98.2 | Very high | 81 Ų | 81 | 89.2 Ų | 89.2 | 43% | 0.433 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.2 | -43.6 | 175.8 | 178.6 | 81.2 | 0 | 0 | 0 | 111.8 | M364 K365 S366 T370 I371 Q372 | M364-N368 WeakPolarHBondContact O-CB 3.27Å; M364-N368 PolarHBondContact O-N 3.2Å; K365-N368 PolarHBondContact O-N 3.24Å; S366-N368 PolarHBondContact O-N 3.43Å; N368-T370 VanDerWaalsContact C-N 3.32Å; N368-T370 PolarHBondContact O-N 3.01Å; N368-I371 PolarHBondContact O-N 2.88Å; N368-Q372 VanDerWaalsContact ND2-CD 3.28Å; N368-Q372 PolarHBondContact ND2-NE2 3.32Å; N368-Q372 PolarHBondContact ND2-OE1 3.05Å; N368-Q372 WeakPolarHBondContact O-CB 3.37Å; N368-Q372 WeakPolarHBondContact O-CG 3.27Å; N368-Q372 PolarHBondContact O-N 3.42Å |
| 369 | G | 98.3 | Very high | 98.3 | Very high | 33 Ų | 33 | 87.3 Ų | 87.3 | 34% | 0.34 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.9 | -39.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | K365 S366 L367 Q372 N373 | K365-G369 PolarHBondContact O-N 2.79Å; S366-G369 PolarHBondContact O-N 2.89Å; L367-G369 PolarHBondContact O-N 2.81Å; G369-Q372 PolarHBondContact O-N 2.97Å; G369-N373 WeakPolarHBondContact O-CB 3.26Å; G369-N373 PolarHBondContact O-N 2.86Å |
| 370 | T | 98.1 | Very high | 98.3 | Very high | 69 Ų | 69 | 85 Ų | 85 | 42% | 0.423 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.1 | -42.8 | 175.5 | -52.6 | 0 | 0 | 0 | 0 | 111.5 | S366 L367 N368 N373 M374 | S366-T370 PolarHBondContact O-N 3.25Å; S366-T370 PolarHBondContact O-OG1 3.26Å; L367-T370 PolarHBondContact O-N 3.26Å; N368-T370 VanDerWaalsContact C-N 3.32Å; N368-T370 PolarHBondContact O-N 3.01Å; T370-N373 PolarHBondContact O-N 3.1Å; T370-M374 HydrophobicContact CG2-CE 4.28Å; T370-M374 WeakPolarHBondContact O-CG 3.2Å; T370-M374 PolarHBondContact O-N 3.01Å |
| 371 | I | 98.4 | Very high | 98.3 | Very high | 81 Ų | 81 | 89.5 Ų | 89.5 | 42% | 0.415 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.3 | -41.8 | 176.3 | -68.3 | 166.2 | 0 | 0 | 0 | 111.4 | L367 N368 M374 T375 | L367-I371 HydrophobicContact CD1-CD1 4.1Å; L367-I371 HydrophobicContact CD1-CG1 4.44Å; L367-I371 HydrophobicContact CG-CD1 4Å; L367-I371 WeakPolarHBondContact O-CG1 3.25Å; L367-I371 PolarHBondContact O-N 3.03Å; N368-I371 PolarHBondContact O-N 2.88Å; I371-M374 HydrophobicContact CG1-CE 4.08Å; I371-M374 PolarHBondContact O-N 3.47Å; I371-T375 WeakPolarHBondContact O-CB 3.1Å; I371-T375 PolarHBondContact O-N 2.84Å; I371-T375 PolarHBondContact O-OG1 3.04Å |
| 372 | Q | 98.4 | Very high | 98.3 | Very high | 117 Ų | 117 | 90.8 Ų | 90.8 | 55% | 0.547 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63 | -41.6 | 175.1 | -73.9 | 177.4 | -11 | 0 | 0 | 111.5 | N368 G369 T375 A376 | N368-Q372 VanDerWaalsContact ND2-CD 3.28Å; N368-Q372 PolarHBondContact ND2-NE2 3.32Å; N368-Q372 PolarHBondContact ND2-OE1 3.05Å; N368-Q372 WeakPolarHBondContact O-CB 3.37Å; N368-Q372 WeakPolarHBondContact O-CG 3.27Å; N368-Q372 PolarHBondContact O-N 3.42Å; G369-Q372 PolarHBondContact O-N 2.97Å; Q372-T375 PolarHBondContact O-N 2.99Å; Q372-A376 WeakPolarHBondContact O-CB 3.26Å; Q372-A376 PolarHBondContact O-N 3.03Å |
| 373 | N | 98.3 | Very high | 98.4 | Very high | 97 Ų | 97 | 90.8 Ų | 90.8 | 52% | 0.519 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.3 | -48.5 | 174.2 | -172.1 | 16.1 | 0 | 0 | 0 | 112.1 | G369 T370 T375 A376 L377 | G369-N373 WeakPolarHBondContact O-CB 3.26Å; G369-N373 PolarHBondContact O-N 2.86Å; T370-N373 PolarHBondContact O-N 3.1Å; N373-T375 PolarHBondContact O-N 3.27Å; N373-A376 PolarHBondContact O-N 2.76Å; N373-A376 VanDerWaalsContact O-N 3.16Å; N373-L377 WeakPolarHBondContact O-CG 3.46Å; N373-L377 PolarHBondContact O-N 2.86Å |
| 374 | M | 97.9 | Very high | 98.4 | Very high | 103 Ų | 103 | 88.9 Ų | 88.9 | 51% | 0.507 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.9 | -34 | 175.6 | -70.1 | -174 | -61.4 | 0 | 0 | 112.6 | T370 I371 S378 | T370-M374 HydrophobicContact CG2-CE 4.28Å; T370-M374 WeakPolarHBondContact O-CG 3.2Å; T370-M374 PolarHBondContact O-N 3.01Å; I371-M374 HydrophobicContact CG1-CE 4.08Å; I371-M374 PolarHBondContact O-N 3.47Å; M374-S378 WeakPolarHBondContact O-CB 3.5Å; M374-S378 PolarHBondContact O-N 3.06Å; M374-S378 PolarHBondContact O-OG 2.85Å |
| 375 | T | 98.4 | Very high | 98.4 | Very high | 79 Ų | 79 | 90.9 Ų | 90.9 | 49% | 0.485 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -71.4 | -43.1 | 175.7 | -57.5 | 0 | 0 | 0 | 0 | 111.4 | I371 Q372 N373 S378 V379 | I371-T375 WeakPolarHBondContact O-CB 3.1Å; I371-T375 PolarHBondContact O-N 2.84Å; I371-T375 PolarHBondContact O-OG1 3.04Å; Q372-T375 PolarHBondContact O-N 2.99Å; N373-T375 PolarHBondContact O-N 3.27Å; T375-S378 WeakPolarHBondContact O-CB 3.38Å; T375-S378 PolarHBondContact O-N 3.43Å; T375-V379 WeakPolarHBondContact O-CG2 3.35Å; T375-V379 PolarHBondContact O-N 2.81Å |
| 376 | A | 98.4 | Very high | 98.4 | Very high | 61 Ų | 61 | 92.3 Ų | 92.3 | 50% | 0.504 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.5 | -43.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q372 N373 S378 V379 G380 | Q372-A376 WeakPolarHBondContact O-CB 3.26Å; Q372-A376 PolarHBondContact O-N 3.03Å; N373-A376 PolarHBondContact O-N 2.76Å; N373-A376 VanDerWaalsContact O-N 3.16Å; A376-S378 VanDerWaalsContact C-N 3.34Å; A376-S378 PolarHBondContact O-N 3Å; A376-V379 PolarHBondContact O-N 2.78Å; A376-G380 PolarHBondContact O-N 3.02Å |
| 377 | L | 98.4 | Very high | 98.4 | Very high | 87 Ų | 87 | 92 Ų | 92 | 46% | 0.455 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.6 | -41.5 | 172.6 | -70 | 170 | 0 | 0 | 0 | 111.9 | N373 G380 Y381 | N373-L377 WeakPolarHBondContact O-CG 3.46Å; N373-L377 PolarHBondContact O-N 2.86Å; L377-G380 PolarHBondContact O-N 2.67Å; L377-Y381 HydrophobicContact CB-CE2 4.4Å; L377-Y381 WeakPolarHBondContact O-CD2 3.46Å; L377-Y381 PolarHBondContact O-N 2.96Å |
| 378 | S | 98.4 | Very high | 98.4 | Very high | 64 Ų | 64 | 90.4 Ų | 90.4 | 45% | 0.448 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64 | -40.5 | 177.3 | -58.5 | 0 | 0 | 0 | 0 | 112.4 | M374 T375 A376 I382 | M374-S378 WeakPolarHBondContact O-CB 3.5Å; M374-S378 PolarHBondContact O-N 3.06Å; M374-S378 PolarHBondContact O-OG 2.85Å; T375-S378 WeakPolarHBondContact O-CB 3.38Å; T375-S378 PolarHBondContact O-N 3.43Å; A376-S378 VanDerWaalsContact C-N 3.34Å; A376-S378 PolarHBondContact O-N 3Å; S378-I382 WeakPolarHBondContact O-CG1 3.33Å; S378-I382 PolarHBondContact O-N 3.16Å |
| 379 | V | 98.6 | Very high | 98.5 | Very high | 70 Ų | 70 | 89.8 Ų | 89.8 | 42% | 0.424 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65.1 | -42.8 | 172.7 | 172 | 0 | 0 | 0 | 0 | 110.7 | T375 A376 Y381 I382 Q383 | T375-V379 WeakPolarHBondContact O-CG2 3.35Å; T375-V379 PolarHBondContact O-N 2.81Å; A376-V379 PolarHBondContact O-N 2.78Å; V379-Y381 PolarHBondContact O-N 3.04Å; V379-I382 PolarHBondContact O-N 3.45Å; V379-Q383 HydrophobicContact CG1-CG 4.45Å; V379-Q383 WeakPolarHBondContact O-CG 3.43Å; V379-Q383 PolarHBondContact O-N 2.76Å |
| 380 | G | 98.5 | Very high | 98.5 | Very high | 22 Ų | 22 | 92.4 Ų | 92.4 | 23% | 0.227 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -58.2 | -46.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | A376 L377 I382 Q383 T384 | A376-G380 PolarHBondContact O-N 3.02Å; L377-G380 PolarHBondContact O-N 2.67Å; G380-I382 VanDerWaalsContact C-N 3.32Å; G380-I382 PolarHBondContact O-N 2.8Å; G380-Q383 WeakPolarHBondContact O-CB 3.42Å; G380-Q383 PolarHBondContact O-N 2.89Å; G380-T384 PolarHBondContact O-N 3.48Å; G380-T384 PolarHBondContact O-OG1 3.28Å; G380-T384 VanDerWaalsContact O-OG1 3.11Å |
| 381 | Y | 98.6 | Very high | 98.5 | Very high | 166 Ų | 166 | 92.6 Ų | 92.6 | 65% | 0.651 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.8 | -38.5 | 175.8 | -66.9 | -46.3 | 0 | 0 | 0 | 113 | L377 V379 Y385 | L377-Y381 HydrophobicContact CB-CE2 4.4Å; L377-Y381 WeakPolarHBondContact O-CD2 3.46Å; L377-Y381 PolarHBondContact O-N 2.96Å; V379-Y381 PolarHBondContact O-N 3.04Å; Y381-Y385 VanDerWaalsContact O-CB 3.27Å; Y381-Y385 WeakPolarHBondContact O-CB 3.47Å; Y381-Y385 PolarHBondContact O-N 3.24Å |
| 382 | I | 98.5 | Very high | 98.5 | Very high | 123 Ų | 123 | 93.9 Ų | 93.9 | 63% | 0.631 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -66.6 | -40.4 | 176.3 | -66.9 | 164.9 | 0 | 0 | 0 | 110.7 | S378 V379 G380 R386 | S378-I382 WeakPolarHBondContact O-CG1 3.33Å; S378-I382 PolarHBondContact O-N 3.16Å; V379-I382 PolarHBondContact O-N 3.45Å; G380-I382 VanDerWaalsContact C-N 3.32Å; G380-I382 PolarHBondContact O-N 2.8Å; I382-R386 WeakPolarHBondContact O-CB 3.19Å; I382-R386 PolarHBondContact O-N 3.26Å |
| 383 | Q | 98.6 | Very high | 98.5 | Very high | 101 Ų | 101 | 90.2 Ų | 90.2 | 47% | 0.472 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64 | -55.7 | 175.4 | -71.3 | 167.4 | -27.2 | 0 | 0 | 111 | V379 G380 Y385 R386 D387 | V379-Q383 HydrophobicContact CG1-CG 4.45Å; V379-Q383 WeakPolarHBondContact O-CG 3.43Å; V379-Q383 PolarHBondContact O-N 2.76Å; G380-Q383 WeakPolarHBondContact O-CB 3.42Å; G380-Q383 PolarHBondContact O-N 2.89Å; Q383-Y385 VanDerWaalsContact C-N 3.27Å; Q383-Y385 PolarHBondContact O-N 2.97Å; Q383-R386 WeakPolarHBondContact O-CB 3.4Å; Q383-R386 PolarHBondContact O-N 2.96Å; Q383-R386 VanDerWaalsContact O-N 3.1Å; Q383-D387 WeakPolarHBondContact O-CB 3.5Å; Q383-D387 PolarHBondContact O-N 3.01Å |
| 384 | T | 98.6 | Very high | 98.6 | Very high | 86 Ų | 86 | 92.3 Ų | 92.3 | 53% | 0.528 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -56.3 | -39.4 | 177.9 | -54 | 0 | 0 | 0 | 0 | 112.4 | G380 S388 | G380-T384 PolarHBondContact O-N 3.48Å; G380-T384 PolarHBondContact O-OG1 3.28Å; G380-T384 VanDerWaalsContact O-OG1 3.11Å; T384-S388 VanDerWaalsContact O-CB 3.26Å; T384-S388 WeakPolarHBondContact O-CB 3.41Å; T384-S388 PolarHBondContact O-N 3.14Å; T384-S388 PolarHBondContact O-OG 3.21Å |
| 385 | Y | 98.8 | Very high | 98.6 | Very high | 172 Ų | 172 | 91.1 Ų | 91.1 | 68% | 0.675 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66.1 | -46.3 | 176.5 | -175.9 | -96.6 | 0 | 0 | 0 | 112.2 | Y381 Q383 S388 V389 | Y381-Y385 VanDerWaalsContact O-CB 3.27Å; Y381-Y385 WeakPolarHBondContact O-CB 3.47Å; Y381-Y385 PolarHBondContact O-N 3.24Å; Q383-Y385 VanDerWaalsContact C-N 3.27Å; Q383-Y385 PolarHBondContact O-N 2.97Å; Y385-S388 PolarHBondContact O-N 3.26Å; Y385-V389 HydrophobicContact CD1-CG2 4.31Å; Y385-V389 HydrophobicContact CE1-CG2 3.87Å; Y385-V389 HydrophobicContact CE2-CG2 4.3Å; Y385-V389 WeakPolarHBondContact O-CG2 3.14Å; Y385-V389 PolarHBondContact O-N 2.95Å |
| 386 | R | 98.6 | Very high | 98.6 | Very high | 141 Ų | 141 | 90.6 Ų | 90.6 | 53% | 0.532 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -57.5 | -54 | 175.2 | -177.7 | -161.5 | 65.2 | 174.8 | 0.3 | 110.5 | I382 Q383 S388 V389 D390 | I382-R386 WeakPolarHBondContact O-CB 3.19Å; I382-R386 PolarHBondContact O-N 3.26Å; Q383-R386 WeakPolarHBondContact O-CB 3.4Å; Q383-R386 PolarHBondContact O-N 2.96Å; Q383-R386 VanDerWaalsContact O-N 3.1Å; R386-S388 VanDerWaalsContact C-N 3.25Å; R386-S388 PolarHBondContact O-N 3.18Å; R386-V389 PolarHBondContact O-N 3.37Å; R386-D390 WeakPolarHBondContact CG-OD2 3.33Å; R386-D390 PolarHBondContact O-N 2.72Å |
| 387 | D | 98.6 | Very high | 98.6 | Very high | 74 Ų | 74 | 91 Ų | 91 | 40% | 0.396 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.3 | -33.2 | -173.7 | -56 | -16.5 | 0 | 0 | 0 | 111.3 | Q383 S391 | Q383-D387 WeakPolarHBondContact O-CB 3.5Å; Q383-D387 PolarHBondContact O-N 3.01Å; D387-S391 VanDerWaalsContact O-CB 3.25Å; D387-S391 WeakPolarHBondContact O-CB 3.15Å; D387-S391 PolarHBondContact O-N 3.24Å |
| 388 | S | 98.8 | Very high | 98.6 | Very high | 72 Ų | 72 | 92.8 Ų | 92.8 | 50% | 0.503 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68.1 | -38 | 171.9 | -58.5 | 0 | 0 | 0 | 0 | 113.1 | T384 Y385 R386 L392 | T384-S388 VanDerWaalsContact O-CB 3.26Å; T384-S388 WeakPolarHBondContact O-CB 3.41Å; T384-S388 PolarHBondContact O-N 3.14Å; T384-S388 PolarHBondContact O-OG 3.21Å; Y385-S388 PolarHBondContact O-N 3.26Å; R386-S388 VanDerWaalsContact C-N 3.25Å; R386-S388 PolarHBondContact O-N 3.18Å; S388-L392 VanDerWaalsContact O-CB 3.27Å; S388-L392 WeakPolarHBondContact O-CB 3.48Å; S388-L392 PolarHBondContact O-N 2.89Å |
| 389 | V | 98.8 | Very high | 98.7 | Very high | 67 Ų | 67 | 93.1 Ų | 93.1 | 41% | 0.406 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -73.7 | -40.4 | 178.3 | 168.3 | 0 | 0 | 0 | 0 | 111.1 | Y385 R386 L392 G393 | Y385-V389 HydrophobicContact CD1-CG2 4.31Å; Y385-V389 HydrophobicContact CE1-CG2 3.87Å; Y385-V389 HydrophobicContact CE2-CG2 4.3Å; Y385-V389 WeakPolarHBondContact O-CG2 3.14Å; Y385-V389 PolarHBondContact O-N 2.95Å; R386-V389 PolarHBondContact O-N 3.37Å; V389-L392 PolarHBondContact O-N 3.23Å; V389-G393 PolarHBondContact O-N 2.86Å |
| 390 | D | 98.7 | Very high | 98.7 | Very high | 89 Ų | 89 | 93.2 Ų | 93.2 | 48% | 0.476 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.1 | -48.7 | 176.3 | -67.9 | -17.4 | 0 | 0 | 0 | 110.2 | R386 L392 G393 E394 | R386-D390 WeakPolarHBondContact CG-OD2 3.33Å; R386-D390 PolarHBondContact O-N 2.72Å; D390-L392 PolarHBondContact O-N 3.11Å; D390-G393 WeakPolarHBondContact O-CA 3.41Å; D390-G393 PolarHBondContact O-N 2.76Å; D390-E394 PolarHBondContact O-N 3.19Å |
| 391 | S | 98.6 | Very high | 98.7 | Very high | 72 Ų | 72 | 97.3 Ų | 97.3 | 50% | 0.503 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.1 | -38.7 | 175.9 | -177.3 | 0 | 0 | 0 | 0 | 113.2 | D387 G393 E394 S395 | D387-S391 VanDerWaalsContact O-CB 3.25Å; D387-S391 WeakPolarHBondContact O-CB 3.15Å; D387-S391 PolarHBondContact O-N 3.24Å; S391-G393 VanDerWaalsContact C-N 3.31Å; S391-G393 PolarHBondContact O-N 2.8Å; S391-E394 PolarHBondContact O-N 3.49Å; S391-S395 WeakPolarHBondContact O-CB 3.44Å; S391-S395 PolarHBondContact O-N 2.94Å |
| 392 | L | 98.7 | Very high | 98.7 | Very high | 109 Ų | 109 | 91.3 Ų | 91.3 | 57% | 0.571 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.6 | -38 | 172.1 | 178.3 | 61.8 | 0 | 0 | 0 | 111.6 | S388 V389 D390 S395 V396 | S388-L392 VanDerWaalsContact O-CB 3.27Å; S388-L392 WeakPolarHBondContact O-CB 3.48Å; S388-L392 PolarHBondContact O-N 2.89Å; V389-L392 PolarHBondContact O-N 3.23Å; D390-L392 PolarHBondContact O-N 3.11Å; L392-S395 PolarHBondContact O-N 2.84Å; L392-V396 HydrophobicContact CD1-CG2 4.16Å; L392-V396 WeakPolarHBondContact O-CB 3.37Å; L392-V396 VanDerWaalsContact O-CG2 3.31Å; L392-V396 WeakPolarHBondContact O-CG2 3.38Å; L392-V396 PolarHBondContact O-N 2.99Å |
| 393 | G | 98.6 | Very high | 98.7 | Very high | 39 Ų | 39 | 91.1 Ų | 91.1 | 40% | 0.402 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.2 | -48 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | V389 D390 S391 V396 D397 | V389-G393 PolarHBondContact O-N 2.86Å; D390-G393 WeakPolarHBondContact O-CA 3.41Å; D390-G393 PolarHBondContact O-N 2.76Å; S391-G393 VanDerWaalsContact C-N 3.31Å; S391-G393 PolarHBondContact O-N 2.8Å; G393-V396 PolarHBondContact O-N 2.94Å; G393-D397 WeakPolarHBondContact O-CB 3.39Å; G393-D397 PolarHBondContact O-N 3.33Å |
| 394 | E | 98.6 | Very high | 98.7 | Very high | 142 Ų | 142 | 93.5 Ų | 93.5 | 66% | 0.664 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63 | -42.1 | 175.7 | -66.9 | -176 | 159.7 | 0 | 0 | 112.3 | D390 S391 V396 D397 M398 | D390-E394 PolarHBondContact O-N 3.19Å; S391-E394 PolarHBondContact O-N 3.49Å; E394-V396 PolarHBondContact O-N 3.29Å; E394-D397 PolarHBondContact O-N 3.41Å; E394-M398 WeakPolarHBondContact O-CB 3.39Å; E394-M398 PolarHBondContact O-N 2.9Å |
| 395 | S | 98.8 | Very high | 98.7 | Very high | 78 Ų | 78 | 93.5 Ų | 93.5 | 55% | 0.545 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.4 | -43.4 | 176.5 | -171.7 | 0 | 0 | 0 | 0 | 112.1 | S391 L392 M398 S399 | S391-S395 WeakPolarHBondContact O-CB 3.44Å; S391-S395 PolarHBondContact O-N 2.94Å; L392-S395 PolarHBondContact O-N 2.84Å; S395-M398 PolarHBondContact O-N 2.88Å; S395-S399 PolarHBondContact O-N 3.16Å |
| 396 | V | 98.9 | Very high | 98.7 | Very high | 68 Ų | 68 | 90.6 Ų | 90.6 | 41% | 0.412 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -68.8 | -43.6 | 177.6 | 170.3 | 0 | 0 | 0 | 0 | 111.4 | L392 G393 E394 M398 S399 I400 | L392-V396 HydrophobicContact CD1-CG2 4.16Å; L392-V396 WeakPolarHBondContact O-CB 3.37Å; L392-V396 VanDerWaalsContact O-CG2 3.31Å; L392-V396 WeakPolarHBondContact O-CG2 3.38Å; L392-V396 PolarHBondContact O-N 2.99Å; G393-V396 PolarHBondContact O-N 2.94Å; E394-V396 PolarHBondContact O-N 3.29Å; V396-M398 VanDerWaalsContact C-N 3.34Å; V396-M398 PolarHBondContact O-N 3.26Å; V396-S399 WeakPolarHBondContact O-CB 3.49Å; V396-S399 PolarHBondContact O-N 2.86Å; V396-S399 VanDerWaalsContact O-N 3.14Å; V396-S399 PolarHBondContact O-OG 3.02Å; V396-I400 HydrophobicContact CG1-CD1 3.88Å; V396-I400 WeakPolarHBondContact O-CG1 3.34Å; V396-I400 PolarHBondContact O-N 3.02Å |
| 397 | D | 98.8 | Very high | 98.7 | Very high | 69 Ų | 69 | 88.4 Ų | 88.4 | 37% | 0.369 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.7 | -43.9 | 173.8 | 165.4 | 75.3 | 0 | 0 | 0 | 112 | G393 E394 S399 I400 K401 | G393-D397 WeakPolarHBondContact O-CB 3.39Å; G393-D397 PolarHBondContact O-N 3.33Å; E394-D397 PolarHBondContact O-N 3.41Å; D397-S399 VanDerWaalsContact C-N 3.33Å; D397-S399 PolarHBondContact O-N 2.62Å; D397-I400 PolarHBondContact O-N 3.1Å; D397-K401 VanDerWaalsContact CG-NZ 3.33Å; D397-K401 WeakPolarHBondContact O-CG 3.46Å; D397-K401 PolarHBondContact O-N 3.27Å; D397-K401 WeakPolarHBondContact OD1-CE 3.35Å; D397-K401 IonicContact OD1-NZ 3.73Å; D397-K401 PolarHBondContact OD1-NZ 2.95Å; D397-K401 VanDerWaalsContact OD2-CE 3.25Å; D397-K401 WeakPolarHBondContact OD2-CE 3.35Å; D397-K401 IonicContact OD2-NZ 3.97Å; D397-K401 PolarHBondContact OD2-NZ 3.47Å |
| 398 | M | 98.7 | Very high | 98.7 | Very high | 124 Ų | 124 | 87.5 Ų | 87.5 | 61% | 0.611 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.8 | -39.8 | 173.9 | -168.7 | 61.4 | 68.9 | 0 | 0 | 112 | E394 S395 V396 I400 K401 G402 | E394-M398 WeakPolarHBondContact O-CB 3.39Å; E394-M398 PolarHBondContact O-N 2.9Å; S395-M398 PolarHBondContact O-N 2.88Å; V396-M398 VanDerWaalsContact C-N 3.34Å; V396-M398 PolarHBondContact O-N 3.26Å; M398-I400 VanDerWaalsContact C-N 3.34Å; M398-I400 PolarHBondContact O-N 3.28Å; M398-K401 PolarHBondContact O-N 2.95Å; M398-G402 PolarHBondContact O-N 3.44Å |
| 399 | S | 98.6 | Very high | 98.6 | Very high | 71 Ų | 71 | 91.1 Ų | 91.1 | 50% | 0.497 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.9 | -37.8 | 175.7 | 82.7 | 0 | 0 | 0 | 0 | 112.6 | S395 V396 D397 G402 M403 | S395-S399 PolarHBondContact O-N 3.16Å; V396-S399 WeakPolarHBondContact O-CB 3.49Å; V396-S399 PolarHBondContact O-N 2.86Å; V396-S399 VanDerWaalsContact O-N 3.14Å; V396-S399 PolarHBondContact O-OG 3.02Å; D397-S399 VanDerWaalsContact C-N 3.33Å; D397-S399 PolarHBondContact O-N 2.62Å; S399-G402 PolarHBondContact O-N 2.88Å; S399-M403 WeakPolarHBondContact O-CB 3.41Å; S399-M403 PolarHBondContact O-N 3.47Å |
| 400 | I | 98.7 | Very high | 98.6 | Very high | 72 Ų | 72 | 91.4 Ų | 91.4 | 37% | 0.369 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68.3 | -46.3 | 177.3 | -69.1 | 164.5 | 0 | 0 | 0 | 110.1 | V396 D397 M398 G402 M403 Y404 | V396-I400 HydrophobicContact CG1-CD1 3.88Å; V396-I400 WeakPolarHBondContact O-CG1 3.34Å; V396-I400 PolarHBondContact O-N 3.02Å; D397-I400 PolarHBondContact O-N 3.1Å; M398-I400 VanDerWaalsContact C-N 3.34Å; M398-I400 PolarHBondContact O-N 3.28Å; I400-G402 VanDerWaalsContact C-N 3.32Å; I400-G402 PolarHBondContact O-N 3.45Å; I400-M403 PolarHBondContact O-N 2.94Å; I400-Y404 HydrophobicContact CG2-CD2 3.77Å; I400-Y404 HydrophobicContact CG2-CE2 3.55Å; I400-Y404 VanDerWaalsContact O-CD2 3.27Å; I400-Y404 WeakPolarHBondContact O-CD2 3.28Å; I400-Y404 PolarHBondContact O-N 3.08Å |
| 401 | K | 98.7 | Very high | 98.6 | Very high | 109 Ų | 109 | 91.7 Ų | 91.7 | 47% | 0.474 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.5 | -41.9 | 173.9 | -72.9 | 166.9 | 176.3 | 167.5 | 0 | 111.9 | D397 M398 T405 | D397-K401 VanDerWaalsContact CG-NZ 3.33Å; D397-K401 WeakPolarHBondContact O-CG 3.46Å; D397-K401 PolarHBondContact O-N 3.27Å; D397-K401 WeakPolarHBondContact OD1-CE 3.35Å; D397-K401 IonicContact OD1-NZ 3.73Å; D397-K401 PolarHBondContact OD1-NZ 2.95Å; D397-K401 VanDerWaalsContact OD2-CE 3.25Å; D397-K401 WeakPolarHBondContact OD2-CE 3.35Å; D397-K401 IonicContact OD2-NZ 3.97Å; D397-K401 PolarHBondContact OD2-NZ 3.47Å; M398-K401 PolarHBondContact O-N 2.95Å; K401-T405 WeakPolarHBondContact O-CB 3.48Å; K401-T405 PolarHBondContact O-N 3.36Å; K401-T405 PolarHBondContact O-OG1 3.42Å |
| 402 | G | 98.6 | Very high | 98.6 | Very high | 40 Ų | 40 | 93 Ų | 93 | 41% | 0.412 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.7 | -44.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | M398 S399 I400 T405 L406 | M398-G402 PolarHBondContact O-N 3.44Å; S399-G402 PolarHBondContact O-N 2.88Å; I400-G402 VanDerWaalsContact C-N 3.32Å; I400-G402 PolarHBondContact O-N 3.45Å; G402-T405 WeakPolarHBondContact O-CB 3.2Å; G402-T405 PolarHBondContact O-N 2.92Å; G402-L406 WeakPolarHBondContact O-CB 3.45Å; G402-L406 PolarHBondContact O-N 2.89Å |
| 403 | M | 98.7 | Very high | 98.5 | Very high | 118 Ų | 118 | 93 Ų | 93 | 58% | 0.581 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66.7 | -40.8 | 178.9 | -174.8 | 164.9 | 58.3 | 0 | 0 | 112.9 | S399 I400 T405 L406 M407 | S399-M403 WeakPolarHBondContact O-CB 3.41Å; S399-M403 PolarHBondContact O-N 3.47Å; I400-M403 PolarHBondContact O-N 2.94Å; M403-T405 VanDerWaalsContact C-N 3.34Å; M403-L406 PolarHBondContact O-N 3.49Å; M403-M407 WeakPolarHBondContact O-CB 3.38Å; M403-M407 PolarHBondContact O-N 2.91Å |
| 404 | Y | 98.7 | Very high | 98.5 | Very high | 152 Ų | 152 | 94.9 Ų | 94.9 | 60% | 0.596 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.1 | -38.7 | 171.9 | -79.1 | -63.1 | 0 | 0 | 0 | 112.4 | I400 M407 A408 | I400-Y404 HydrophobicContact CG2-CD2 3.77Å; I400-Y404 HydrophobicContact CG2-CE2 3.55Å; I400-Y404 VanDerWaalsContact O-CD2 3.27Å; I400-Y404 WeakPolarHBondContact O-CD2 3.28Å; I400-Y404 PolarHBondContact O-N 3.08Å; Y404-M407 HydrophobicContact CD1-CE 4.34Å; Y404-M407 PolarHBondContact O-N 3.23Å; Y404-A408 PolarHBondContact O-N 3.23Å; Y404-A408 VanDerWaalsContact O-N 3.09Å |
| 405 | T | 98.6 | Very high | 98.4 | Very high | 85 Ų | 85 | 95.4 Ų | 95.4 | 52% | 0.521 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.8 | -45.8 | 175.6 | -56.9 | 0 | 0 | 0 | 0 | 111 | K401 G402 M403 M407 A408 R409 | K401-T405 WeakPolarHBondContact O-CB 3.48Å; K401-T405 PolarHBondContact O-N 3.36Å; K401-T405 PolarHBondContact O-OG1 3.42Å; G402-T405 WeakPolarHBondContact O-CB 3.2Å; G402-T405 PolarHBondContact O-N 2.92Å; M403-T405 VanDerWaalsContact C-N 3.34Å; T405-M407 PolarHBondContact O-N 2.97Å; T405-A408 PolarHBondContact O-N 3.14Å; T405-R409 WeakPolarHBondContact O-CG 3.48Å; T405-R409 PolarHBondContact O-N 2.84Å; T405-R409 VanDerWaalsContact O-N 3.12Å |
| 406 | L | 98.6 | Very high | 98.4 | Very high | 111 Ų | 111 | 95.2 Ų | 95.2 | 58% | 0.581 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -60 | -45.6 | 175.9 | 179.5 | 62.5 | 0 | 0 | 0 | 111.5 | G402 M403 A408 R409 C410 | G402-L406 WeakPolarHBondContact O-CB 3.45Å; G402-L406 PolarHBondContact O-N 2.89Å; M403-L406 PolarHBondContact O-N 3.49Å; L406-A408 PolarHBondContact O-N 3.36Å; L406-R409 CarbonylContact O-C 3.57Å; L406-R409 PolarHBondContact O-N 3.42Å; L406-R409 VanDerWaalsContact O-N 3.12Å; L406-C410 PolarHBondContact O-N 2.93Å; L406-C410 PolarHBondContact O-SG 2.92Å; L406-C410 VanDerWaalsContact O-SG 3.35Å |
| 407 | M | 98.4 | Very high | 98.3 | Very high | 96 Ų | 96 | 95.6 Ų | 95.6 | 47% | 0.473 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -56.5 | -47.6 | 177.8 | -170.3 | -174.8 | -54.8 | 0 | 0 | 111.7 | M403 Y404 T405 R409 C410 E411 | M403-M407 WeakPolarHBondContact O-CB 3.38Å; M403-M407 PolarHBondContact O-N 2.91Å; Y404-M407 HydrophobicContact CD1-CE 4.34Å; Y404-M407 PolarHBondContact O-N 3.23Å; T405-M407 PolarHBondContact O-N 2.97Å; M407-R409 VanDerWaalsContact C-N 3.33Å; M407-R409 PolarHBondContact O-N 3.33Å; M407-C410 WeakPolarHBondContact O-CB 3.33Å; M407-C410 PolarHBondContact O-N 3.41Å; M407-E411 PolarHBondContact O-N 2.89Å |
| 408 | A | 98.6 | Very high | 98.2 | Very high | 54 Ų | 54 | 96.7 Ų | 96.7 | 45% | 0.446 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.2 | -38.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y404 T405 L406 E411 E412 | Y404-A408 PolarHBondContact O-N 3.23Å; Y404-A408 VanDerWaalsContact O-N 3.09Å; T405-A408 PolarHBondContact O-N 3.14Å; L406-A408 PolarHBondContact O-N 3.36Å; A408-E411 PolarHBondContact O-N 3.37Å; A408-E412 WeakPolarHBondContact O-CB 3.47Å; A408-E412 PolarHBondContact O-N 3.38Å |
| 409 | R | 98.3 | Very high | 98.2 | Very high | 149 Ų | 149 | 94.8 Ų | 94.8 | 56% | 0.562 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -70.2 | -32.6 | 174.9 | -63.6 | -54.7 | -175.8 | 179.8 | 0.2 | 113.1 | T405 L406 M407 E412 L413 | T405-R409 WeakPolarHBondContact O-CG 3.48Å; T405-R409 PolarHBondContact O-N 2.84Å; T405-R409 VanDerWaalsContact O-N 3.12Å; L406-R409 CarbonylContact O-C 3.57Å; L406-R409 PolarHBondContact O-N 3.42Å; L406-R409 VanDerWaalsContact O-N 3.12Å; M407-R409 VanDerWaalsContact C-N 3.33Å; M407-R409 PolarHBondContact O-N 3.33Å; R409-E412 WeakPolarHBondContact CD-OE2 3.41Å; R409-E412 IonicContact CZ-OE2 2.62Å; R409-E412 IonicContact NE-OE2 3.58Å; R409-E412 IonicContact NH1-OE1 2.72Å; R409-E412 PolarHBondContact NH1-OE1 3.24Å; R409-E412 IonicContact NH1-OE2 2.62Å; R409-E412 PolarHBondContact NH1-OE2 2.86Å; R409-E412 PolarHBondContact O-N 3.08Å; R409-L413 VanDerWaalsContact O-CB 3.31Å; R409-L413 WeakPolarHBondContact O-CB 3.39Å; R409-L413 PolarHBondContact O-N 2.94Å |
| 410 | C | 98.1 | Very high | 98.1 | Very high | 72 Ų | 72 | 96.7 Ų | 96.7 | 49% | 0.486 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.9 | -42.1 | 172.1 | -69.1 | 0 | 0 | 0 | 0 | 111.7 | L406 M407 L413 D414 | L406-C410 PolarHBondContact O-N 2.93Å; L406-C410 PolarHBondContact O-SG 2.92Å; L406-C410 VanDerWaalsContact O-SG 3.35Å; M407-C410 WeakPolarHBondContact O-CB 3.33Å; M407-C410 PolarHBondContact O-N 3.41Å; C410-L413 PolarHBondContact O-N 3.21Å; C410-D414 PolarHBondContact O-N 3.45Å |
| 411 | E | 98.3 | Very high | 98.1 | Very high | 96 Ų | 96 | 98.1 Ų | 98.1 | 45% | 0.449 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.4 | -35.2 | 174.3 | -60.6 | -176.6 | -174.4 | 0 | 0 | 113 | M407 A408 R415 | M407-E411 PolarHBondContact O-N 2.89Å; A408-E411 PolarHBondContact O-N 3.37Å; E411-R415 VanDerWaalsContact C-NH1 3.27Å; E411-R415 VanDerWaalsContact O-CG 3.28Å; E411-R415 WeakPolarHBondContact O-CG 3.45Å; E411-R415 PolarHBondContact O-N 3.48Å; E411-R415 VanDerWaalsContact O-N 3.14Å; E411-R415 PolarHBondContact O-NH1 2.96Å; E411-R415 VanDerWaalsContact O-NH1 3.17Å; E411-R415 IonicContact OE2-CZ 3.39Å; E411-R415 IonicContact OE2-NH1 3.25Å; E411-R415 PolarHBondContact OE2-NH1 3.37Å; E411-R415 IonicContact OE2-NH2 2.63Å; E411-R415 PolarHBondContact OE2-NH2 3.2Å |
| 412 | E | 98.2 | Very high | 98 | Very high | 98 Ų | 98 | 96.7 Ų | 96.7 | 46% | 0.458 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.1 | -44.2 | 174.3 | -174 | 178.2 | -151.5 | 0 | 0 | 110.9 | A408 R409 R415 S416 | A408-E412 WeakPolarHBondContact O-CB 3.47Å; A408-E412 PolarHBondContact O-N 3.38Å; R409-E412 WeakPolarHBondContact CD-OE2 3.41Å; R409-E412 IonicContact CZ-OE2 2.62Å; R409-E412 IonicContact NE-OE2 3.58Å; R409-E412 IonicContact NH1-OE1 2.72Å; R409-E412 PolarHBondContact NH1-OE1 3.24Å; R409-E412 IonicContact NH1-OE2 2.62Å; R409-E412 PolarHBondContact NH1-OE2 2.86Å; R409-E412 PolarHBondContact O-N 3.08Å; E412-R415 PolarHBondContact O-N 3.45Å; E412-S416 WeakPolarHBondContact O-CB 3.41Å; E412-S416 PolarHBondContact O-N 3.47Å |
| 413 | L | 98.2 | Very high | 97.9 | Very high | 111 Ų | 111 | 99.2 Ų | 99.2 | 58% | 0.581 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.5 | -47 | 175.2 | -179.6 | 62.2 | 0 | 0 | 0 | 111.9 | R409 C410 R415 S416 M417 | R409-L413 VanDerWaalsContact O-CB 3.31Å; R409-L413 WeakPolarHBondContact O-CB 3.39Å; R409-L413 PolarHBondContact O-N 2.94Å; C410-L413 PolarHBondContact O-N 3.21Å; L413-R415 PolarHBondContact O-N 2.95Å; L413-S416 WeakPolarHBondContact O-CB 3.48Å; L413-S416 PolarHBondContact O-N 3.38Å; L413-S416 VanDerWaalsContact O-N 3.12Å; L413-S416 PolarHBondContact O-OG 3.48Å; L413-M417 PolarHBondContact O-N 3.48Å |
| 414 | D | 96.9 | Very high | 97.9 | Very high | 78 Ų | 78 | 95.7 Ų | 95.7 | 42% | 0.417 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.6 | -49.3 | 177.8 | -177.7 | 89.1 | 0 | 0 | 0 | 111.7 | C410 S416 M417 Q418 | C410-D414 PolarHBondContact O-N 3.45Å; D414-S416 PolarHBondContact O-N 3.34Å; D414-M417 WeakPolarHBondContact O-CB 3.34Å; D414-M417 PolarHBondContact O-N 2.96Å; D414-Q418 PolarHBondContact O-N 3.46Å; D414-Q418 PolarHBondContact OD2-NE2 3.24Å |
| 415 | R | 97.8 | Very high | 97.9 | Very high | 152 Ų | 152 | 90 Ų | 90 | 57% | 0.574 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -56.6 | -39.3 | 175.2 | -69.5 | 176.5 | -164 | 104.9 | -1.1 | 111.8 | E411 E412 L413 M417 | E411-R415 VanDerWaalsContact C-NH1 3.27Å; E411-R415 VanDerWaalsContact O-CG 3.28Å; E411-R415 WeakPolarHBondContact O-CG 3.45Å; E411-R415 PolarHBondContact O-N 3.48Å; E411-R415 VanDerWaalsContact O-N 3.14Å; E411-R415 PolarHBondContact O-NH1 2.96Å; E411-R415 VanDerWaalsContact O-NH1 3.17Å; E411-R415 IonicContact OE2-CZ 3.39Å; E411-R415 IonicContact OE2-NH1 3.25Å; E411-R415 PolarHBondContact OE2-NH1 3.37Å; E411-R415 IonicContact OE2-NH2 2.63Å; E411-R415 PolarHBondContact OE2-NH2 3.2Å; E412-R415 PolarHBondContact O-N 3.45Å; L413-R415 PolarHBondContact O-N 2.95Å; R415-M417 VanDerWaalsContact C-N 3.26Å; R415-M417 PolarHBondContact O-N 3.37Å |
| 416 | S | 97.6 | Very high | 97.8 | Very high | 74 Ų | 74 | 91 Ų | 91 | 52% | 0.517 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -69.5 | -20.3 | 177.1 | 82.3 | 0 | 0 | 0 | 0 | 114 | E412 L413 D414 P419 | E412-S416 WeakPolarHBondContact O-CB 3.41Å; E412-S416 PolarHBondContact O-N 3.47Å; L413-S416 WeakPolarHBondContact O-CB 3.48Å; L413-S416 PolarHBondContact O-N 3.38Å; L413-S416 VanDerWaalsContact O-N 3.12Å; L413-S416 PolarHBondContact O-OG 3.48Å; D414-S416 PolarHBondContact O-N 3.34Å; S416-P419 WeakPolarHBondContact O-CD 3.1Å |
| 417 | M | 97.6 | Very high | 97.8 | Very high | 77 Ų | 77 | 90.5 Ų | 90.5 | 38% | 0.379 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -90.2 | -18.5 | -178 | -165.9 | 163 | 66.5 | 0 | 0 | 113.4 | L413 D414 R415 P419 I420 H421 | L413-M417 PolarHBondContact O-N 3.48Å; D414-M417 WeakPolarHBondContact O-CB 3.34Å; D414-M417 PolarHBondContact O-N 2.96Å; R415-M417 VanDerWaalsContact C-N 3.26Å; R415-M417 PolarHBondContact O-N 3.37Å; M417-P419 VanDerWaalsContact C-CD 3.41Å; M417-P419 VanDerWaalsContact C-N 3.34Å; M417-I420 HydrophobicContact CG-CB 4.48Å; M417-I420 HydrophobicContact CG-CD1 4.35Å; M417-I420 WeakPolarHBondContact O-CB 3.3Å; M417-I420 PolarHBondContact O-N 3.35Å; M417-H421 PolarHBondContact O-CD2 3.36Å; M417-H421 PolarHBondContact O-N 3.28Å |
| 418 | Q | 97.6 | Very high | 97.8 | Very high | 92 Ų | 92 | 93 Ų | 93 | 43% | 0.43 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -51.7 | -38.3 | 177.5 | -59.5 | -60.5 | -26.2 | 0 | 0 | 115.1 | D414 I420 H421 T422 | D414-Q418 PolarHBondContact O-N 3.46Å; D414-Q418 PolarHBondContact OD2-NE2 3.24Å; Q418-I420 VanDerWaalsContact C-N 3.29Å; Q418-I420 PolarHBondContact O-N 2.95Å; Q418-H421 PolarHBondContact O-N 2.67Å; Q418-T422 PolarHBondContact O-N 2.94Å; Q418-T422 PolarHBondContact O-OG1 3.48Å; Q418-T422 VanDerWaalsContact O-OG1 3.1Å |
| 419 | P | 97.3 | Very high | 97.8 | Very high | 83 Ų | 83 | 94.4 Ų | 94.4 | 54% | 0.539 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.9 | -30.5 | 173.5 | -22.5 | 35.3 | 0 | 0 | 0 | 113.7 | S416 M417 T422 L423 | S416-P419 WeakPolarHBondContact O-CD 3.1Å; M417-P419 VanDerWaalsContact C-CD 3.41Å; M417-P419 VanDerWaalsContact C-N 3.34Å; P419-T422 WeakPolarHBondContact O-CB 3.3Å; P419-T422 PolarHBondContact O-N 3.34Å; P419-L423 PolarHBondContact O-N 2.96Å |
| 420 | I | 97.8 | Very high | 97.8 | Very high | 111 Ų | 111 | 92.4 Ų | 92.4 | 57% | 0.569 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -70.7 | -40.5 | 179.5 | -58.5 | 175.8 | 0 | 0 | 0 | 110 | M417 Q418 T422 L423 A424 | M417-I420 HydrophobicContact CG-CB 4.48Å; M417-I420 HydrophobicContact CG-CD1 4.35Å; M417-I420 WeakPolarHBondContact O-CB 3.3Å; M417-I420 PolarHBondContact O-N 3.35Å; Q418-I420 VanDerWaalsContact C-N 3.29Å; Q418-I420 PolarHBondContact O-N 2.95Å; I420-T422 VanDerWaalsContact C-N 3.29Å; I420-T422 PolarHBondContact O-N 2.99Å; I420-L423 PolarHBondContact O-N 3.26Å; I420-A424 WeakPolarHBondContact O-CB 3.33Å; I420-A424 PolarHBondContact O-N 3.02Å |
| 421 | H | 97.1 | Very high | 97.8 | Very high | 102 Ų | 102 | 95.1 Ų | 95.1 | 47% | 0.472 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.7 | -37.9 | 171.7 | -66.3 | -69.7 | 0 | 0 | 0 | 112.2 | M417 Q418 A424 A425 | M417-H421 PolarHBondContact O-CD2 3.36Å; M417-H421 PolarHBondContact O-N 3.28Å; Q418-H421 PolarHBondContact O-N 2.67Å; H421-A424 PolarHBondContact O-N 3.49Å; H421-A425 PolarHBondContact O-N 3.5Å; H421-A425 VanDerWaalsContact O-N 3.08Å |
| 422 | T | 96.7 | Very high | 97.8 | Very high | 79 Ų | 79 | 97.2 Ų | 97.2 | 49% | 0.485 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.6 | -47.2 | 175.2 | -56.2 | 0 | 0 | 0 | 0 | 111.6 | Q418 P419 I420 A424 A425 Q426 | Q418-T422 PolarHBondContact O-N 2.94Å; Q418-T422 PolarHBondContact O-OG1 3.48Å; Q418-T422 VanDerWaalsContact O-OG1 3.1Å; P419-T422 WeakPolarHBondContact O-CB 3.3Å; P419-T422 PolarHBondContact O-N 3.34Å; I420-T422 VanDerWaalsContact C-N 3.29Å; I420-T422 PolarHBondContact O-N 2.99Å; T422-A424 VanDerWaalsContact C-N 3.32Å; T422-A424 PolarHBondContact O-N 2.9Å; T422-A425 WeakPolarHBondContact O-CB 3.33Å; T422-A425 PolarHBondContact O-N 2.93Å; T422-A425 VanDerWaalsContact O-N 3.1Å; T422-Q426 PolarHBondContact O-N 2.62Å |
| 423 | L | 98.1 | Very high | 97.7 | Very high | 94 Ų | 94 | 96.3 Ų | 96.3 | 49% | 0.492 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.6 | -39.8 | 176.3 | -178.1 | 62.1 | 0 | 0 | 0 | 111.7 | P419 I420 A425 Q426 I427 | P419-L423 PolarHBondContact O-N 2.96Å; I420-L423 PolarHBondContact O-N 3.26Å; L423-A425 VanDerWaalsContact C-N 3.27Å; L423-A425 PolarHBondContact O-N 2.83Å; L423-Q426 PolarHBondContact O-N 2.7Å; L423-I427 HydrophobicContact CD1-CD1 4.23Å; L423-I427 HydrophobicContact CD1-CG1 4.4Å; L423-I427 HydrophobicContact CG-CD1 3.94Å; L423-I427 WeakPolarHBondContact O-CG1 3.48Å; L423-I427 PolarHBondContact O-N 3.33Å |
| 424 | A | 97.8 | Very high | 97.7 | Very high | 44 Ų | 44 | 96 Ų | 96 | 36% | 0.364 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.7 | -22.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | I420 H421 T422 R428 | I420-A424 WeakPolarHBondContact O-CB 3.33Å; I420-A424 PolarHBondContact O-N 3.02Å; H421-A424 PolarHBondContact O-N 3.49Å; T422-A424 VanDerWaalsContact C-N 3.32Å; T422-A424 PolarHBondContact O-N 2.9Å; A424-R428 WeakPolarHBondContact O-CG 3.47Å; A424-R428 PolarHBondContact O-NE 3.05Å |
| 425 | A | 97.6 | Very high | 97.7 | Very high | 31 Ų | 31 | 95.3 Ų | 95.3 | 26% | 0.256 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -72.7 | -53.5 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | H421 T422 L423 I427 R428 D429 | H421-A425 PolarHBondContact O-N 3.5Å; H421-A425 VanDerWaalsContact O-N 3.08Å; T422-A425 WeakPolarHBondContact O-CB 3.33Å; T422-A425 PolarHBondContact O-N 2.93Å; T422-A425 VanDerWaalsContact O-N 3.1Å; L423-A425 VanDerWaalsContact C-N 3.27Å; L423-A425 PolarHBondContact O-N 2.83Å; A425-I427 VanDerWaalsContact C-N 3.3Å; A425-I427 PolarHBondContact O-N 2.83Å; A425-R428 WeakPolarHBondContact O-CA 3.28Å; A425-R428 WeakPolarHBondContact O-CB 3.49Å; A425-R428 PolarHBondContact O-N 3.08Å; A425-D429 VanDerWaalsContact O-CG 3.32Å; A425-D429 PolarHBondContact O-N 2.93Å |
| 426 | Q | 98.3 | Very high | 97.7 | Very high | 106 Ų | 106 | 92 Ų | 92 | 50% | 0.495 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -54 | -42.3 | -179.9 | -68.2 | 174.8 | -8.4 | 0 | 0 | 113 | T422 L423 R428 D429 I430 | T422-Q426 PolarHBondContact O-N 2.62Å; L423-Q426 PolarHBondContact O-N 2.7Å; Q426-R428 PolarHBondContact O-N 2.95Å; Q426-D429 PolarHBondContact O-N 2.72Å; Q426-I430 WeakPolarHBondContact O-CB 3.34Å; Q426-I430 VanDerWaalsContact O-CG1 3.27Å; Q426-I430 WeakPolarHBondContact O-CG1 3.27Å; Q426-I430 PolarHBondContact O-N 3.25Å |
| 427 | I | 98.3 | Very high | 97.6 | Very high | 102 Ų | 102 | 93.6 Ų | 93.6 | 52% | 0.523 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.5 | -38.7 | 176.6 | -68.7 | 166.9 | 0 | 0 | 0 | 111.7 | L423 A425 K431 | L423-I427 HydrophobicContact CD1-CD1 4.23Å; L423-I427 HydrophobicContact CD1-CG1 4.4Å; L423-I427 HydrophobicContact CG-CD1 3.94Å; L423-I427 WeakPolarHBondContact O-CG1 3.48Å; L423-I427 PolarHBondContact O-N 3.33Å; A425-I427 VanDerWaalsContact C-N 3.3Å; A425-I427 PolarHBondContact O-N 2.83Å; I427-K431 WeakPolarHBondContact O-CB 3.32Å; I427-K431 PolarHBondContact O-N 3.13Å |
| 428 | R | 98.3 | Very high | 97.6 | Very high | 149 Ų | 149 | 94.4 Ų | 94.4 | 56% | 0.562 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -69.8 | -34.4 | 175.5 | -73.3 | 179.3 | -69.3 | 164.1 | 1.6 | 112.1 | A424 A425 Q426 K431 R432 | A424-R428 WeakPolarHBondContact O-CG 3.47Å; A424-R428 PolarHBondContact O-NE 3.05Å; A425-R428 WeakPolarHBondContact O-CA 3.28Å; A425-R428 WeakPolarHBondContact O-CB 3.49Å; A425-R428 PolarHBondContact O-N 3.08Å; Q426-R428 PolarHBondContact O-N 2.95Å; R428-K431 PolarHBondContact O-N 2.91Å; R428-R432 WeakPolarHBondContact O-CG 3.38Å; R428-R432 PolarHBondContact O-N 3.08Å; R428-R432 PolarHBondContact O-NH1 3.29Å |
| 429 | D | 98.1 | Very high | 97.5 | Very high | 82 Ų | 82 | 93.3 Ų | 93.3 | 44% | 0.439 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -72.4 | -44.8 | 178.1 | -59.3 | -25.8 | 0 | 0 | 0 | 111.1 | A425 Q426 K431 R432 T433 | A425-D429 VanDerWaalsContact O-CG 3.32Å; A425-D429 PolarHBondContact O-N 2.93Å; Q426-D429 PolarHBondContact O-N 2.72Å; D429-K431 VanDerWaalsContact C-N 3.3Å; D429-K431 PolarHBondContact O-N 3.04Å; D429-R432 PolarHBondContact O-N 2.89Å; D429-R432 IonicContact OD1-CZ 3.96Å; D429-R432 IonicContact OD1-NH1 3.16Å; D429-R432 PolarHBondContact OD1-NH1 2.86Å; D429-R432 IonicContact OD1-NH2 3.7Å; D429-T433 PolarHBondContact O-N 3.46Å |
| 430 | I | 97.9 | Very high | 97.4 | Very high | 107 Ų | 107 | 95.7 Ų | 95.7 | 55% | 0.549 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -54.9 | -47.3 | 169.5 | -69.4 | 164.7 | 0 | 0 | 0 | 110 | Q426 R432 T433 L434 | Q426-I430 WeakPolarHBondContact O-CB 3.34Å; Q426-I430 VanDerWaalsContact O-CG1 3.27Å; Q426-I430 WeakPolarHBondContact O-CG1 3.27Å; Q426-I430 PolarHBondContact O-N 3.25Å; I430-R432 PolarHBondContact O-N 2.95Å; I430-T433 PolarHBondContact O-N 3.27Å; I430-T433 PolarHBondContact O-OG1 3.35Å; I430-L434 WeakPolarHBondContact O-CB 3.49Å; I430-L434 PolarHBondContact O-N 2.95Å |
| 431 | K | 98.1 | Very high | 96.9 | Very high | 129 Ų | 129 | 95.7 Ų | 95.7 | 56% | 0.561 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -57 | -50.6 | 176.8 | -164.8 | -156.2 | 166.6 | -165.6 | 0 | 111.5 | I427 R428 D429 T433 L434 D435 | I427-K431 WeakPolarHBondContact O-CB 3.32Å; I427-K431 PolarHBondContact O-N 3.13Å; R428-K431 PolarHBondContact O-N 2.91Å; D429-K431 VanDerWaalsContact C-N 3.3Å; D429-K431 PolarHBondContact O-N 3.04Å; K431-T433 VanDerWaalsContact C-N 3.31Å; K431-T433 PolarHBondContact O-N 3.38Å; K431-L434 CarbonylContact O-C 3.6Å; K431-L434 WeakPolarHBondContact O-CB 3.36Å; K431-L434 PolarHBondContact O-N 2.77Å; K431-D435 WeakPolarHBondContact CE-OD1 3.34Å; K431-D435 WeakPolarHBondContact CE-OD2 3.28Å; K431-D435 IonicContact NZ-OD2 3.72Å; K431-D435 PolarHBondContact O-N 2.82Å |
| 432 | R | 98.1 | Very high | 95.8 | Very high | 140 Ų | 140 | 100.5 Ų | 100.5 | 53% | 0.528 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -58.2 | -40.8 | 178.4 | -71.8 | -166.6 | -148.6 | 83 | -21.4 | 112.5 | R428 D429 I430 L434 D435 T436 | R428-R432 WeakPolarHBondContact O-CG 3.38Å; R428-R432 PolarHBondContact O-N 3.08Å; R428-R432 PolarHBondContact O-NH1 3.29Å; D429-R432 PolarHBondContact O-N 2.89Å; D429-R432 IonicContact OD1-CZ 3.96Å; D429-R432 IonicContact OD1-NH1 3.16Å; D429-R432 PolarHBondContact OD1-NH1 2.86Å; D429-R432 IonicContact OD1-NH2 3.7Å; I430-R432 PolarHBondContact O-N 2.95Å; R432-L434 VanDerWaalsContact C-N 3.33Å; R432-L434 PolarHBondContact O-N 3.38Å; R432-D435 PolarHBondContact O-N 3.34Å; R432-T436 WeakPolarHBondContact O-CG2 3.4Å; R432-T436 PolarHBondContact O-N 3.25Å; R432-T436 PolarHBondContact O-OG1 2.68Å |
| 433 | T | 97.3 | Very high | 95.8 | Very high | 80 Ų | 80 | 101.6 Ų | 101.6 | 49% | 0.491 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.7 | -38.6 | 176.4 | 60.8 | 0 | 0 | 0 | 0 | 112.1 | D429 I430 K431 T436 L437 | D429-T433 PolarHBondContact O-N 3.46Å; I430-T433 PolarHBondContact O-N 3.27Å; I430-T433 PolarHBondContact O-OG1 3.35Å; K431-T433 VanDerWaalsContact C-N 3.31Å; K431-T433 PolarHBondContact O-N 3.38Å; T433-T436 WeakPolarHBondContact CA-OG1 3.36Å; T433-T436 PolarHBondContact O-N 2.85Å; T433-T436 PolarHBondContact O-OG1 3.19Å; T433-L437 WeakPolarHBondContact O-CG 3.45Å; T433-L437 PolarHBondContact O-N 3.45Å |
| 434 | L | 97.7 | Very high | 95.7 | Very high | 103 Ų | 103 | 102 Ų | 102 | 54% | 0.539 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.6 | -44.8 | 176 | -153.9 | 161.9 | 0 | 0 | 0 | 111.1 | I430 K431 R432 T436 L437 E438 | I430-L434 WeakPolarHBondContact O-CB 3.49Å; I430-L434 PolarHBondContact O-N 2.95Å; K431-L434 CarbonylContact O-C 3.6Å; K431-L434 WeakPolarHBondContact O-CB 3.36Å; K431-L434 PolarHBondContact O-N 2.77Å; R432-L434 VanDerWaalsContact C-N 3.33Å; R432-L434 PolarHBondContact O-N 3.38Å; L434-T436 VanDerWaalsContact C-N 3.29Å; L434-T436 PolarHBondContact O-N 2.71Å; L434-L437 PolarHBondContact O-N 3.29Å; L434-L437 VanDerWaalsContact O-N 3.13Å; L434-E438 PolarHBondContact O-N 2.68Å |
| 435 | D | 97.2 | Very high | 95.6 | Very high | 65 Ų | 65 | 105.2 Ų | 105.2 | 35% | 0.348 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -56.8 | -40.9 | 173.5 | -62.2 | -28.1 | 0 | 0 | 0 | 110.8 | K431 R432 E438 A439 | K431-D435 WeakPolarHBondContact CE-OD1 3.34Å; K431-D435 WeakPolarHBondContact CE-OD2 3.28Å; K431-D435 IonicContact NZ-OD2 3.72Å; K431-D435 PolarHBondContact O-N 2.82Å; R432-D435 PolarHBondContact O-N 3.34Å; D435-E438 PolarHBondContact O-N 2.86Å; D435-A439 PolarHBondContact O-N 2.63Å; D435-A439 VanDerWaalsContact O-N 3.08Å |
| 436 | T | 96.5 | Very high | 95.4 | Very high | 82 Ų | 82 | 109.6 Ų | 109.6 | 50% | 0.503 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -70.8 | -34.5 | 175.6 | 56.8 | 0 | 0 | 0 | 0 | 113.9 | R432 T433 L434 A439 I440 | R432-T436 WeakPolarHBondContact O-CG2 3.4Å; R432-T436 PolarHBondContact O-N 3.25Å; R432-T436 PolarHBondContact O-OG1 2.68Å; T433-T436 WeakPolarHBondContact CA-OG1 3.36Å; T433-T436 PolarHBondContact O-N 2.85Å; T433-T436 PolarHBondContact O-OG1 3.19Å; L434-T436 VanDerWaalsContact C-N 3.29Å; L434-T436 PolarHBondContact O-N 2.71Å; T436-A439 PolarHBondContact O-N 3.36Å; T436-I440 WeakPolarHBondContact O-CD1 3.44Å; T436-I440 WeakPolarHBondContact O-CG1 3.41Å; T436-I440 PolarHBondContact O-N 3.28Å |
| 437 | L | 96.6 | Very high | 95.3 | Very high | 107 Ų | 107 | 109.8 Ų | 109.8 | 56% | 0.56 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -69.1 | -38 | 174.6 | -71.9 | 169.1 | 0 | 0 | 0 | 111 | T433 L434 A439 I440 C441 | T433-L437 WeakPolarHBondContact O-CG 3.45Å; T433-L437 PolarHBondContact O-N 3.45Å; L434-L437 PolarHBondContact O-N 3.29Å; L434-L437 VanDerWaalsContact O-N 3.13Å; L437-A439 VanDerWaalsContact C-N 3.29Å; L437-A439 PolarHBondContact O-N 2.86Å; L437-I440 PolarHBondContact O-N 2.92Å; L437-C441 WeakPolarHBondContact O-CB 3.43Å; L437-C441 PolarHBondContact O-N 2.87Å; L437-C441 VanDerWaalsContact O-N 3.13Å; L437-C441 PolarHBondContact O-SG 3.4Å; L437-C441 VanDerWaalsContact O-SG 3.4Å |
| 438 | E | 97 | Very high | 95.1 | Very high | 95 Ų | 95 | 110.3 Ų | 110.3 | 44% | 0.444 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.7 | -36.5 | 173 | -165.7 | -173.8 | 159.4 | 0 | 0 | 111.6 | L434 D435 I440 C441 K442 | L434-E438 PolarHBondContact O-N 2.68Å; D435-E438 PolarHBondContact O-N 2.86Å; E438-I440 VanDerWaalsContact C-N 3.34Å; E438-C441 PolarHBondContact O-N 2.83Å; E438-K442 HydrophobicContact CG-CD 4.48Å; E438-K442 WeakPolarHBondContact O-CG 3.43Å; E438-K442 WeakPolarHBondContact OE1-CE 3.34Å; E438-K442 IonicContact OE1-NZ 2.77Å; E438-K442 PolarHBondContact OE1-NZ 3.32Å |
| 439 | A | 96.2 | Very high | 94.8 | Very high | 68 Ų | 68 | 107.6 Ų | 107.6 | 56% | 0.562 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -72.1 | -21.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | D435 T436 L437 | D435-A439 PolarHBondContact O-N 2.63Å; D435-A439 VanDerWaalsContact O-N 3.08Å; T436-A439 PolarHBondContact O-N 3.36Å; L437-A439 VanDerWaalsContact C-N 3.29Å; L437-A439 PolarHBondContact O-N 2.86Å |
| 440 | I | 95.7 | Very high | 94.6 | Very high | 133 Ų | 133 | 109.5 Ų | 109.5 | 68% | 0.682 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -87.7 | -23.5 | 175.5 | -67.3 | 162.9 | 0 | 0 | 0 | 111.6 | T436 L437 E438 | T436-I440 WeakPolarHBondContact O-CD1 3.44Å; T436-I440 WeakPolarHBondContact O-CG1 3.41Å; T436-I440 PolarHBondContact O-N 3.28Å; L437-I440 PolarHBondContact O-N 2.92Å; E438-I440 VanDerWaalsContact C-N 3.34Å |
| 441 | C | 87.1 | Confident | 94.3 | Very high | 112 Ų | 112 | 109.8 Ų | 109.8 | 76% | 0.757 | 57% | 0.571 | S | S | * | * | trans | -95.2 | 11.7 | -178.9 | -69.5 | 0 | 0 | 0 | 0 | 114.3 | L437 E438 | L437-C441 WeakPolarHBondContact O-CB 3.43Å; L437-C441 PolarHBondContact O-N 2.87Å; L437-C441 VanDerWaalsContact O-N 3.13Å; L437-C441 PolarHBondContact O-SG 3.4Å; L437-C441 VanDerWaalsContact O-SG 3.4Å; E438-C441 PolarHBondContact O-N 2.83Å | ||
| 442 | K | 74.2 | Confident | 93.9 | Very high | 203 Ų | 203 | 108 Ų | 108 | 88% | 0.883 | 57% | 0.572 | S | S | * | * | trans | -112.7 | 0 | 177.5 | -79.4 | 172.8 | 179.3 | 167.1 | 0 | 111.6 | E438 | E438-K442 HydrophobicContact CG-CD 4.48Å; E438-K442 WeakPolarHBondContact O-CG 3.43Å; E438-K442 WeakPolarHBondContact OE1-CE 3.34Å; E438-K442 IonicContact OE1-NZ 2.77Å; E438-K442 PolarHBondContact OE1-NZ 3.32Å |
Retrieved 442 of 442 residues in 138.4 ms
(Link to these results)