| 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 | 41.5 | Very low | 47.9 | Very low | 247 Ų | 247 | 129.2 Ų | 129.2 | 100% | 1.217 | 82% | 0.817 | S | S | * | * | 0 | 134.9 | 0 | -82.5 | 165.5 | 170.3 | 0 | 0 | 108.1 | |||||
| 2 | A | 43.2 | Very low | 47.8 | Very low | 90 Ų | 90 | 132.9 Ų | 132.9 | 74% | 0.744 | 82% | 0.817 | S | S | * | * | trans | 63.1 | 103.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 3 | C | 43 | Very low | 47.6 | Very low | 135 Ų | 135 | 135.4 Ų | 135.4 | 91% | 0.912 | 82% | 0.821 | S | S | * | * | 66.6 | 112 | 95.5 | -59.5 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 4 | G | 38.2 | Very low | 47.9 | Very low | 70 Ų | 70 | 133.9 Ų | 133.9 | 72% | 0.722 | 81% | 0.811 | S | S | * | * | cis | 116.8 | 116.5 | 41.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 5 | V | 56.4 | Low | 48.2 | Very low | 153 Ų | 153 | 130.7 Ų | 130.7 | 93% | 0.927 | 81% | 0.805 | S | S | * | * | trans | -173 | 117.8 | 151.8 | -100.2 | 0 | 0 | 0 | 0 | 108 | ||||
| 6 | N | 44.1 | Very low | 48.4 | Very low | 137 Ų | 137 | 132.9 Ų | 132.9 | 73% | 0.733 | 81% | 0.809 | S | S | * | * | trans | -114.7 | 111.6 | 174.3 | -168.1 | -47.2 | 0 | 0 | 0 | 106.4 | T8 | N6-T8 PolarHBondContact O-N 3.27Å; N6-T8 PolarHBondContact OD1-OG1 3.25Å | ||
| 7 | P | 56.3 | Low | 48.1 | Very low | 115 Ų | 115 | 132.9 Ų | 132.9 | 75% | 0.747 | 81% | 0.808 | S | S | * | * | trans | -84.1 | 98.1 | 169.4 | 29.8 | -27.3 | 0 | 0 | 0 | 108.6 | ||||
| 8 | T | 47.4 | Very low | 47.9 | Very low | 117 Ų | 117 | 129.9 Ų | 129.9 | 72% | 0.718 | 81% | 0.809 | S | S | * | * | trans | -81.3 | 108.4 | 165.2 | -50.6 | 0 | 0 | 0 | 0 | 108.1 | N6 | N6-T8 PolarHBondContact O-N 3.27Å; N6-T8 PolarHBondContact OD1-OG1 3.25Å | ||
| 9 | T | 55.7 | Low | 47.4 | Very low | 124 Ų | 124 | 129.2 Ų | 129.2 | 76% | 0.761 | 81% | 0.809 | S | S | * | * | trans | -117.6 | 90.5 | 169.1 | 48.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 10 | S | 46.4 | Very low | 47.4 | Very low | 106 Ų | 106 | 127.8 Ų | 127.8 | 74% | 0.741 | 81% | 0.81 | S | S | * | * | trans | -87.5 | 115.8 | 162.4 | 65.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 11 | V | 55 | Low | 47 | Very low | 127 Ų | 127 | 125 Ų | 125 | 77% | 0.77 | 81% | 0.806 | S | S | * | * | trans | -95.1 | 106.4 | 168.4 | -166.3 | 0 | 0 | 0 | 0 | 106.7 | L13 | V11-L13 PolarHBondContact O-N 3.4Š| ||
| 12 | E | 46.4 | Very low | 47 | Very low | 174 Ų | 174 | 118.4 Ų | 118.4 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | -71.4 | 117.5 | 166.5 | -96.4 | -169.8 | 125.4 | 0 | 0 | 108.7 | ||||
| 13 | L | 45.3 | Very low | 47 | Very low | 165 Ų | 165 | 123 Ų | 123 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | trans | -90.6 | 102.6 | 167.5 | -134.5 | 89.8 | 0 | 0 | 0 | 108.2 | V11 A15 | V11-L13 PolarHBondContact O-N 3.4Å; L13-A15 PolarHBondContact O-N 3.16Å | ||
| 14 | V | 52.3 | Low | 47 | Very low | 114 Ų | 114 | 124.1 Ų | 124.1 | 69% | 0.691 | 78% | 0.779 | S | S | * | * | trans | -81.6 | 105.8 | 170 | 177.7 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 15 | A | 52.3 | Low | 47 | Very low | 86 Ų | 86 | 128.6 Ų | 128.6 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | trans | -90.6 | 106.6 | 167.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | L13 V17 | L13-A15 PolarHBondContact O-N 3.16Å; A15-V17 PolarHBondContact O-N 3.45Å | ||
| 16 | L | 50.8 | Low | 46.3 | Very low | 166 Ų | 166 | 130 Ų | 130 | 87% | 0.869 | 78% | 0.778 | S | S | * | * | trans | -69 | 105.9 | 170.6 | -82.8 | 146.2 | 0 | 0 | 0 | 109.6 | G18 | L16-G18 PolarHBondContact O-N 3.32Š| ||
| 17 | V | 43.7 | Very low | 46 | Very low | 133 Ų | 133 | 132.7 Ų | 132.7 | 81% | 0.806 | 78% | 0.783 | S | S | * | * | trans | -79.5 | 98.3 | 163.3 | 171.7 | 0 | 0 | 0 | 0 | 107.7 | A15 | A15-V17 PolarHBondContact O-N 3.45Š| ||
| 18 | G | 43.6 | Very low | 45.2 | Very low | 79 Ų | 79 | 135.1 Ų | 135.1 | 81% | 0.814 | 79% | 0.785 | S | S | * | * | trans | -87.2 | 100.6 | 165.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | L16 | L16-G18 PolarHBondContact O-N 3.32Š| ||
| 19 | S | 39 | Very low | 44.9 | Very low | 117 Ų | 117 | 137 Ų | 137 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | trans | -88.7 | 112.7 | 171.9 | -168.8 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 20 | A | 47.9 | Very low | 44.2 | Very low | 100 Ų | 100 | 138.2 Ų | 138.2 | 83% | 0.826 | 78% | 0.782 | S | S | * | * | trans | -167.9 | 121 | 159.1 | 0 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 21 | G | 38.6 | Very low | 43.9 | Very low | 70 Ų | 70 | 139.7 Ų | 139.7 | 72% | 0.722 | 78% | 0.777 | S | S | * | * | 124.4 | 88.3 | 65.1 | 0 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 22 | S | 41.6 | Very low | 43.1 | Very low | 109 Ų | 109 | 141.2 Ų | 141.2 | 76% | 0.762 | 78% | 0.776 | S | S | * | * | trans | 17.4 | 134.5 | 149 | 59.7 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 23 | K | 42.8 | Very low | 42.4 | Very low | 185 Ų | 185 | 138.7 Ų | 138.7 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | 85.3 | 119.5 | 140.6 | -71.8 | -176.6 | -170.8 | -167.3 | 0 | 121 | ||||
| 24 | Q | 42.4 | Very low | 42.1 | Very low | 159 Ų | 159 | 139 Ų | 139 | 74% | 0.743 | 78% | 0.775 | S | S | * | * | 80.1 | 129 | 129.2 | -78.6 | -174.3 | -29.4 | 0 | 0 | 121.6 | |||||
| 25 | Q | 40.2 | Very low | 41.1 | Very low | 164 Ų | 164 | 143.3 Ų | 143.3 | 77% | 0.766 | 78% | 0.779 | S | S | * | * | trans | 99.7 | 142.6 | 137.2 | -81 | 176.2 | 1.2 | 0 | 0 | 121.4 | ||||
| 26 | Q | 41.5 | Very low | 40.5 | Very low | 184 Ų | 184 | 145.2 Ų | 145.2 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | trans | 82 | 105.8 | 170.3 | -64.5 | 176.1 | -17.4 | 0 | 0 | 115.4 | ||||
| 27 | K | 37.5 | Very low | 39.6 | Very low | 192 Ų | 192 | 141.4 Ų | 141.4 | 84% | 0.835 | 77% | 0.768 | S | S | * | * | cis | 74.5 | 124 | 38.2 | -138.4 | -168.1 | -173.8 | -169.5 | 0 | 114.5 | ||||
| 28 | Q | 40.1 | Very low | 39.3 | Very low | 167 Ų | 167 | 141.5 Ų | 141.5 | 78% | 0.78 | 77% | 0.773 | S | S | * | * | trans | 86.1 | 127.3 | 170.7 | -63.6 | 176.2 | -4.7 | 0 | 0 | 115 | ||||
| 29 | Q | 40.4 | Very low | 39 | Very low | 155 Ų | 155 | 144.7 Ų | 144.7 | 72% | 0.724 | 77% | 0.771 | S | S | * | * | cis | -161.6 | 132.3 | 47.5 | -115.3 | 163.1 | 9.4 | 0 | 0 | 109.5 | ||||
| 30 | Q | 40.2 | Very low | 39 | Very low | 151 Ų | 151 | 144.6 Ų | 144.6 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | 68.4 | 139.4 | 108.9 | -73.1 | -177.7 | 3.9 | 0 | 0 | 116 | |||||
| 31 | Q | 40.7 | Very low | 38.4 | Very low | 137 Ų | 137 | 144 Ų | 144 | 64% | 0.64 | 76% | 0.761 | S | S | * | * | cis | -173.5 | 154.6 | -0 | -118.2 | 168.8 | 16.3 | 0 | 0 | 108.7 | ||||
| 32 | Q | 39 | Very low | 38.4 | Very low | 158 Ų | 158 | 148.5 Ų | 148.5 | 74% | 0.738 | 77% | 0.767 | S | S | * | * | trans | 69.1 | 104.7 | 146.5 | -72.3 | 172.7 | -8.1 | 0 | 0 | 120.9 | ||||
| 33 | T | 31.1 | Very low | 38 | Very low | 122 Ų | 122 | 147.6 Ų | 147.6 | 75% | 0.748 | 77% | 0.766 | S | S | * | * | 62.1 | 114.2 | 84.9 | -25.4 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 34 | N | 38.3 | Very low | 37.8 | Very low | 170 Ų | 170 | 146.3 Ų | 146.3 | 91% | 0.909 | 77% | 0.767 | S | S | * | * | trans | -159.7 | 122.4 | 140.5 | -88.5 | -39.5 | 0 | 0 | 0 | 109.9 | ||||
| 35 | R | 31.7 | Very low | 37.3 | Very low | 206 Ų | 206 | 145 Ų | 145 | 78% | 0.777 | 77% | 0.77 | S | S | * | * | trans | -109.3 | 149.3 | 168.7 | -155.5 | -171.3 | -171.4 | -157 | 2.4 | 106.6 | ||||
| 36 | P | 40.1 | Very low | 37.1 | Very low | 125 Ų | 125 | 146.1 Ų | 146.1 | 81% | 0.812 | 78% | 0.775 | S | S | * | * | trans | -136.1 | 139 | 133 | 27.3 | -10.4 | 0 | 0 | 0 | 112.9 | ||||
| 37 | T | 31.2 | Very low | 36.6 | Very low | 87 Ų | 87 | 142 Ų | 142 | 53% | 0.534 | 77% | 0.767 | S | S | . | * | trans | -84.5 | 142.2 | 168.4 | -11 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 38 | C | 38.5 | Very low | 36.8 | Very low | 134 Ų | 134 | 139.7 Ų | 139.7 | 91% | 0.905 | 77% | 0.769 | S | S | * | * | trans | -146.1 | 117.4 | 154.7 | -84.9 | 0 | 0 | 0 | 0 | 110 | ||||
| 39 | D | 36.6 | Very low | 36.9 | Very low | 147 Ų | 147 | 139.7 Ų | 139.7 | 79% | 0.786 | 77% | 0.769 | S | S | * | * | trans | -73.5 | 144.4 | 173.9 | -68.8 | -65.5 | 0 | 0 | 0 | 113.3 | ||||
| 40 | S | 38.6 | Very low | 36.7 | Very low | 114 Ų | 114 | 137.7 Ų | 137.7 | 80% | 0.797 | 77% | 0.769 | S | S | * | * | trans | 155.6 | 144.4 | 141.6 | -88.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 41 | S | 36.2 | Very low | 36.6 | Very low | 89 Ų | 89 | 135.5 Ų | 135.5 | 62% | 0.622 | 77% | 0.771 | S | S | * | * | cis | -175.6 | 139.3 | -10.1 | -94 | 0 | 0 | 0 | 0 | 104.3 | ||||
| 42 | L | 37.9 | Very low | 36.3 | Very low | 164 Ų | 164 | 140.1 Ų | 140.1 | 86% | 0.859 | 78% | 0.782 | S | S | * | * | trans | 61.5 | 121.1 | 140.5 | -66.6 | 162.4 | 0 | 0 | 0 | 121.5 | ||||
| 43 | A | 33.6 | Very low | 36.4 | Very low | 90 Ų | 90 | 140 Ų | 140 | 74% | 0.744 | 79% | 0.787 | S | S | * | * | 85.6 | 118.2 | 128.3 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 44 | L | 37.3 | Very low | 36.5 | Very low | 158 Ų | 158 | 137.7 Ų | 137.7 | 83% | 0.827 | 79% | 0.787 | S | S | * | * | 141.5 | 85.3 | 122.9 | -143.6 | 90 | 0 | 0 | 0 | 109.2 | |||||
| 45 | V | 32.6 | Very low | 36.5 | Very low | 131 Ų | 131 | 138.6 Ų | 138.6 | 79% | 0.794 | 79% | 0.785 | S | S | * | * | 36.9 | 96.3 | 99.4 | -170.5 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 46 | Q | 36 | Very low | 37 | Very low | 188 Ų | 188 | 134.6 Ų | 134.6 | 88% | 0.879 | 79% | 0.786 | S | S | * | * | -159.7 | 126.4 | 124.8 | -123.8 | 167.6 | 3.1 | 0 | 0 | 112.5 | |||||
| 47 | S | 30.2 | Very low | 37 | Very low | 98 Ų | 98 | 132 Ų | 132 | 69% | 0.685 | 78% | 0.782 | S | S | * | * | trans | -88.1 | 132.8 | 175.9 | 175.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 48 | T | 43.2 | Very low | 37.4 | Very low | 142 Ų | 142 | 137.6 Ų | 137.6 | 87% | 0.871 | 80% | 0.802 | S | S | * | * | trans | -152.4 | 120.1 | 148.3 | -19.4 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 49 | E | 41.7 | Very low | 37.3 | Very low | 168 Ų | 168 | 134.7 Ų | 134.7 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | trans | -70.9 | 153.6 | -177.7 | -57.6 | 172.1 | 94.6 | 0 | 0 | 112.8 | S51 | E49-S51 PolarHBondContact O-N 3.48Š| ||
| 50 | P | 36.9 | Very low | 37.4 | Very low | 112 Ų | 112 | 135.3 Ų | 135.3 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | trans | -86.3 | 100.6 | 164.7 | 31.7 | -26.1 | 0 | 0 | 0 | 110.1 | ||||
| 51 | S | 36.4 | Very low | 37.7 | Very low | 106 Ų | 106 | 133.9 Ų | 133.9 | 74% | 0.741 | 79% | 0.793 | S | S | * | * | trans | -76 | 116.8 | 167.9 | -178.2 | 0 | 0 | 0 | 0 | 110.1 | E49 | E49-S51 PolarHBondContact O-N 3.48Š| ||
| 52 | W | 34.2 | Very low | 38 | Very low | 233 Ų | 233 | 141 Ų | 141 | 88% | 0.883 | 81% | 0.808 | S | S | * | * | trans | -110.2 | 97.4 | 171.5 | -80.9 | 73.9 | 0 | 0 | 0 | 109.1 | ||||
| 53 | N | 41.5 | Very low | 38.1 | Very low | 157 Ų | 157 | 136.8 Ų | 136.8 | 84% | 0.84 | 80% | 0.804 | S | S | * | * | trans | -134.9 | 123.4 | 163.3 | -80.5 | -21.9 | 0 | 0 | 0 | 107.9 | ||||
| 54 | G | 33.2 | Very low | 38.6 | Very low | 72 Ų | 72 | 137 Ų | 137 | 74% | 0.742 | 80% | 0.801 | S | S | * | * | trans | -89.9 | 176.4 | -161.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 55 | H | 38.6 | Very low | 39.3 | Very low | 190 Ų | 190 | 134.8 Ų | 134.8 | 88% | 0.88 | 80% | 0.798 | S | S | * | * | trans | -169.1 | 142 | 132.2 | -119.3 | -90.8 | 0 | 0 | 0 | 109.4 | ||||
| 56 | P | 42.8 | Very low | 39.8 | Very low | 121 Ų | 121 | 134.9 Ų | 134.9 | 79% | 0.786 | 79% | 0.794 | S | S | * | * | trans | -92.1 | 149.6 | 179.8 | 36.3 | -30.7 | 0 | 0 | 0 | 111.4 | ||||
| 57 | G | 39 | Very low | 40.3 | Very low | 71 Ų | 71 | 135.5 Ų | 135.5 | 73% | 0.732 | 79% | 0.794 | S | S | * | * | trans | 153.1 | 101.9 | 170.2 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 58 | Q | 40.7 | Very low | 40.9 | Very low | 204 Ų | 204 | 138.2 Ų | 138.2 | 95% | 0.953 | 80% | 0.796 | S | S | * | * | 107.2 | 122.8 | 82.9 | -178.2 | 173.7 | 84.2 | 0 | 0 | 107.9 | |||||
| 59 | G | 35.8 | Very low | 41 | Very low | 73 Ų | 73 | 139.5 Ų | 139.5 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | 150.8 | 79.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 60 | D | 39.5 | Very low | 41.2 | Very low | 161 Ų | 161 | 134.2 Ų | 134.2 | 86% | 0.861 | 77% | 0.771 | S | S | * | * | trans | -61.5 | 145 | -179.7 | -53.4 | -71.4 | 0 | 0 | 0 | 114.2 | ||||
| 61 | A | 44.2 | Very low | 41.8 | Very low | 83 Ų | 83 | 134.7 Ų | 134.7 | 69% | 0.686 | 77% | 0.766 | S | S | * | * | trans | -172.8 | 103.7 | 148.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 62 | Y | 42.4 | Very low | 42.4 | Very low | 238 Ų | 238 | 136.9 Ų | 136.9 | 93% | 0.933 | 77% | 0.77 | S | S | * | * | S | Bend | trans | 64.1 | 99.5 | 147.3 | -63.2 | -89 | 0 | 0 | 0 | 119.2 | ||
| 63 | G | 41.1 | Very low | 43.1 | Very low | 76 Ų | 76 | 130.6 Ų | 130.6 | 78% | 0.784 | 76% | 0.761 | S | S | * | * | trans | 142.6 | 75 | 157 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 64 | S | 44.4 | Very low | 43.7 | Very low | 96 Ų | 96 | 129.3 Ų | 129.3 | 67% | 0.671 | 75% | 0.754 | S | S | * | * | trans | -144.8 | 100.4 | 173 | -81.9 | 0 | 0 | 0 | 0 | 111.1 | N66 | S64-N66 PolarHBondContact O-N 3.24Š| ||
| 65 | S | 51.4 | Low | 44.6 | Very low | 111 Ų | 111 | 130.4 Ų | 130.4 | 78% | 0.776 | 75% | 0.748 | S | S | * | * | trans | -63.4 | 85.1 | 152.6 | 50 | 0 | 0 | 0 | 0 | 108.2 | F67 | S65-F67 PolarHBondContact O-N 3Å; S65-F67 VanDerWaalsContact O-N 3.15Å | ||
| 66 | N | 42 | Very low | 44.8 | Very low | 132 Ų | 132 | 131.2 Ų | 131.2 | 71% | 0.706 | 75% | 0.749 | S | S | * | * | trans | -72.8 | 100.4 | 173.1 | -75.1 | -35.6 | 0 | 0 | 0 | 108.7 | S64 H68 | S64-N66 PolarHBondContact O-N 3.24Å; N66-H68 PolarHBondContact O-N 3.19Å | ||
| 67 | F | 46.7 | Very low | 45.3 | Very low | 202 Ų | 202 | 134.1 Ų | 134.1 | 89% | 0.886 | 75% | 0.749 | S | S | * | * | trans | -68 | 80.2 | 154.9 | -74.1 | -78.2 | 0 | 0 | 0 | 107.9 | S65 F69 | S65-F67 PolarHBondContact O-N 3Å; S65-F67 VanDerWaalsContact O-N 3.15Å; F67-F69 PolarHBondContact O-N 3.22Å; F67-F69 VanDerWaalsContact O-N 3.1Å | ||
| 68 | H | 43 | Very low | 46.1 | Very low | 154 Ų | 154 | 135.2 Ų | 135.2 | 71% | 0.713 | 75% | 0.745 | S | S | * | * | trans | -75.6 | 90.8 | 173.6 | -178.7 | -115.7 | 0 | 0 | 0 | 108.2 | N66 S70 | N66-H68 PolarHBondContact O-N 3.19Å; H68-S70 PolarHBondContact CE1-OG 3.35Å; H68-S70 PolarHBondContact ND1-OG 3.45Å; H68-S70 VanDerWaalsContact ND1-OG 3.1Å; H68-S70 PolarHBondContact O-N 3.11Å | ||
| 69 | F | 45 | Very low | 47 | Very low | 170 Ų | 170 | 131.6 Ų | 131.6 | 75% | 0.746 | 74% | 0.738 | S | S | * | * | trans | -85.5 | 92.5 | 166 | -163.5 | -98 | 0 | 0 | 0 | 107.9 | F67 I71 | F67-F69 PolarHBondContact O-N 3.22Å; F67-F69 VanDerWaalsContact O-N 3.1Å; F69-I71 HydrophobicContact CD1-CD1 4.06Å; F69-I71 HydrophobicContact CD1-CG1 3.49Å; F69-I71 VanDerWaalsContact CD1-CG1 3.49Å; F69-I71 HydrophobicContact CE1-CD1 4.37Å; F69-I71 HydrophobicContact CE1-CG1 3.8Å; F69-I71 PolarHBondContact O-N 3.33Å; F69-I71 VanDerWaalsContact O-N 3.07Å | ||
| 70 | S | 45.5 | Very low | 48 | Very low | 56 Ų | 56 | 133.3 Ų | 133.3 | 39% | 0.392 | 73% | 0.733 | S | S | . | * | trans | -63.9 | 105.7 | 170.5 | -58.4 | 0 | 0 | 0 | 0 | 109.6 | H68 D72 | H68-S70 PolarHBondContact CE1-OG 3.35Å; H68-S70 PolarHBondContact ND1-OG 3.45Å; H68-S70 VanDerWaalsContact ND1-OG 3.1Å; H68-S70 PolarHBondContact O-N 3.11Å; S70-D72 PolarHBondContact O-N 3.44Å | ||
| 71 | I | 51 | Low | 48.4 | Very low | 122 Ų | 122 | 133.1 Ų | 133.1 | 63% | 0.626 | 73% | 0.725 | S | S | * | * | trans | -81.1 | 7.4 | 168.6 | -57.5 | -174.7 | 0 | 0 | 0 | 110.8 | F69 | F69-I71 HydrophobicContact CD1-CD1 4.06Å; F69-I71 HydrophobicContact CD1-CG1 3.49Å; F69-I71 VanDerWaalsContact CD1-CG1 3.49Å; F69-I71 HydrophobicContact CE1-CD1 4.37Å; F69-I71 HydrophobicContact CE1-CG1 3.8Å; F69-I71 PolarHBondContact O-N 3.33Å; F69-I71 VanDerWaalsContact O-N 3.07Å | ||
| 72 | D | 47.6 | Very low | 48.8 | Very low | 153 Ų | 153 | 138.1 Ų | 138.1 | 82% | 0.818 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -109.3 | 28 | -170.5 | -68.7 | -55.7 | 0 | 0 | 0 | 115 | S70 | S70-D72 PolarHBondContact O-N 3.44Š|
| 73 | S | 48.9 | Very low | 49.8 | Very low | 101 Ų | 101 | 132.5 Ų | 132.5 | 71% | 0.706 | 72% | 0.717 | S | S | * | * | trans | -149 | 19.7 | 176.8 | -41.9 | 0 | 0 | 0 | 0 | 115.6 | P75 | S73-P75 WeakPolarHBondContact O-CD 3.47Š| ||
| 74 | L | 54.3 | Low | 50.4 | Low | 129 Ų | 129 | 137.1 Ų | 137.1 | 68% | 0.675 | 72% | 0.718 | S | S | * | * | trans | -71 | 122.9 | 170.8 | -86.7 | 86.5 | 0 | 0 | 0 | 109.1 | K76 | L74-K76 PolarHBondContact O-N 3.37Š| ||
| 75 | P | 52.6 | Low | 51.1 | Low | 95 Ų | 95 | 137.5 Ų | 137.5 | 62% | 0.617 | 72% | 0.718 | S | S | * | * | trans | -58.2 | 119.3 | 177.3 | 23.2 | -31.2 | 0 | 0 | 0 | 107.9 | S73 K77 | S73-P75 WeakPolarHBondContact O-CD 3.47Å; P75-K77 PolarHBondContact O-N 3Å | ||
| 76 | K | 43.8 | Very low | 51.8 | Low | 207 Ų | 207 | 140.5 Ų | 140.5 | 90% | 0.9 | 72% | 0.72 | S | S | * | * | trans | -57.9 | 82.1 | 170.4 | -82.3 | 172.9 | 173.6 | 171.4 | 0 | 108.9 | L74 S78 | L74-K76 PolarHBondContact O-N 3.37Å; K76-S78 PolarHBondContact O-N 3Å | ||
| 77 | K | 51.9 | Low | 52.4 | Low | 182 Ų | 182 | 143.6 Ų | 143.6 | 79% | 0.791 | 72% | 0.723 | S | S | * | * | trans | -80.3 | 71.9 | 164.7 | -55.6 | -178.8 | -170.4 | -170.9 | 0 | 106.6 | P75 T79 | P75-K77 PolarHBondContact O-N 3Å; K77-T79 VanDerWaalsContact C-N 3.35Å; K77-T79 PolarHBondContact O-N 3.39Å | ||
| 78 | S | 55.7 | Low | 53.2 | Low | 94 Ų | 94 | 140.9 Ų | 140.9 | 66% | 0.657 | 72% | 0.716 | S | S | * | * | trans | -64.5 | 96.1 | 168.8 | 175.5 | 0 | 0 | 0 | 0 | 107.7 | K76 T80 | K76-S78 PolarHBondContact O-N 3Å; S78-T80 VanDerWaalsContact C-N 3.29Å; S78-T80 PolarHBondContact O-N 3Å; S78-T80 VanDerWaalsContact O-N 3.11Å; S78-T80 PolarHBondContact OG-OG1 3.23Å | ||
| 79 | T | 59.6 | Low | 54.2 | Low | 129 Ų | 129 | 138 Ų | 138 | 79% | 0.791 | 71% | 0.711 | S | S | * | * | trans | -78.2 | 89.9 | 163.7 | -177.7 | 0 | 0 | 0 | 0 | 107.3 | K77 F81 | K77-T79 VanDerWaalsContact C-N 3.35Å; K77-T79 PolarHBondContact O-N 3.39Å; T79-F81 PolarHBondContact O-N 2.71Å | ||
| 80 | T | 57.2 | Low | 54.5 | Low | 108 Ų | 108 | 132.9 Ų | 132.9 | 66% | 0.663 | 71% | 0.707 | S | S | * | * | trans | -76.3 | 101.9 | 169.2 | -60 | 0 | 0 | 0 | 0 | 107.1 | S78 K82 | S78-T80 VanDerWaalsContact C-N 3.29Å; S78-T80 PolarHBondContact O-N 3Å; S78-T80 VanDerWaalsContact O-N 3.11Å; S78-T80 PolarHBondContact OG-OG1 3.23Å; T80-K82 PolarHBondContact O-N 3.01Å | ||
| 81 | F | 47.8 | Very low | 55.1 | Low | 158 Ų | 158 | 136.4 Ų | 136.4 | 69% | 0.693 | 73% | 0.728 | S | S | * | * | trans | -78.6 | 98.5 | 167.4 | -153.6 | -67.8 | 0 | 0 | 0 | 107.8 | T79 L83 | T79-F81 PolarHBondContact O-N 2.71Å; F81-L83 HydrophobicContact CD1-CB 3.85Å; F81-L83 HydrophobicContact CD1-CD1 3.13Å; F81-L83 HydrophobicContact CD1-CG 3.55Å; F81-L83 HydrophobicContact CE1-CB 4.08Å; F81-L83 HydrophobicContact CE1-CD1 3.17Å; F81-L83 HydrophobicContact CE1-CG 3.36Å; F81-L83 HydrophobicContact CG-CD1 3.98Å; F81-L83 HydrophobicContact CZ-CD1 4.01Å; F81-L83 HydrophobicContact CZ-CG 4.43Å; F81-L83 PolarHBondContact O-N 3.31Å | ||
| 82 | K | 53.4 | Low | 55.4 | Low | 187 Ų | 187 | 140.5 Ų | 140.5 | 81% | 0.813 | 74% | 0.741 | S | S | * | * | trans | -70.3 | 87.3 | 161.4 | -100.5 | -169 | 166.8 | -168.1 | 0 | 107.2 | T80 E84 | T80-K82 PolarHBondContact O-N 3.01Å; K82-E84 PolarHBondContact O-N 2.72Å | ||
| 83 | L | 62.4 | Low | 55.4 | Low | 121 Ų | 121 | 139.3 Ų | 139.3 | 63% | 0.634 | 74% | 0.74 | S | S | * | * | trans | -81.9 | 105.9 | 163 | -113.5 | 123.5 | 0 | 0 | 0 | 104.4 | F81 P85 | F81-L83 HydrophobicContact CD1-CB 3.85Å; F81-L83 HydrophobicContact CD1-CD1 3.13Å; F81-L83 HydrophobicContact CD1-CG 3.55Å; F81-L83 HydrophobicContact CE1-CB 4.08Å; F81-L83 HydrophobicContact CE1-CD1 3.17Å; F81-L83 HydrophobicContact CE1-CG 3.36Å; F81-L83 HydrophobicContact CG-CD1 3.98Å; F81-L83 HydrophobicContact CZ-CD1 4.01Å; F81-L83 HydrophobicContact CZ-CG 4.43Å; F81-L83 PolarHBondContact O-N 3.31Å; L83-P85 HydrophobicContact CD2-CG 4.37Å; L83-P85 VanDerWaalsContact O-CD 3.29Å; L83-P85 WeakPolarHBondContact O-CD 3.29Å | ||
| 84 | E | 53.9 | Low | 55.2 | Low | 173 Ų | 173 | 140.6 Ų | 140.6 | 81% | 0.808 | 75% | 0.746 | S | S | * | * | trans | -89.6 | 100.3 | 157.4 | -88.4 | -82.3 | 150.1 | 0 | 0 | 105.7 | K82 E86 | K82-E84 PolarHBondContact O-N 2.72Å; E84-E86 PolarHBondContact O-N 3Å | ||
| 85 | P | 59.8 | Low | 54.7 | Low | 103 Ų | 103 | 138 Ų | 138 | 67% | 0.669 | 75% | 0.751 | S | S | * | * | trans | -83.5 | 104.7 | 168.7 | -1.5 | 22.9 | 0 | 0 | 0 | 107.4 | L83 | L83-P85 HydrophobicContact CD2-CG 4.37Å; L83-P85 VanDerWaalsContact O-CD 3.29Å; L83-P85 WeakPolarHBondContact O-CD 3.29Å | ||
| 86 | E | 64.9 | Low | 54.3 | Low | 174 Ų | 174 | 141.9 Ų | 141.9 | 81% | 0.813 | 77% | 0.766 | S | S | * | * | trans | -20.6 | 128.1 | 160.6 | -169.3 | 170.2 | 172.2 | 0 | 0 | 114.8 | E84 I88 | E84-E86 PolarHBondContact O-N 3Å; E86-I88 PolarHBondContact O-N 3.23Å; E86-I88 VanDerWaalsContact O-N 3.16Å | ||
| 87 | Y | 55.6 | Low | 54.2 | Low | 198 Ų | 198 | 136 Ų | 136 | 78% | 0.776 | 76% | 0.764 | S | S | * | * | trans | -66.6 | 109.4 | 177 | 177.9 | -101.1 | 0 | 0 | 0 | 110.4 | P89 | Y87-P89 HydrophobicContact CD1-CG 4.03Å; Y87-P89 HydrophobicContact CE1-CB 4.07Å; Y87-P89 HydrophobicContact CE1-CG 3.74Å; Y87-P89 WeakPolarHBondContact O-CD 3.41Å | ||
| 88 | I | 62.9 | Low | 54.2 | Low | 145 Ų | 145 | 131.8 Ų | 131.8 | 74% | 0.744 | 76% | 0.763 | S | S | * | * | trans | -96.8 | 112.2 | 170.7 | -53.7 | 175.2 | 0 | 0 | 0 | 107.9 | E86 G90 | E86-I88 PolarHBondContact O-N 3.23Å; E86-I88 VanDerWaalsContact O-N 3.16Å; I88-G90 PolarHBondContact O-N 3.45Å | ||
| 89 | P | 64 | Low | 54 | Low | 92 Ų | 92 | 133.1 Ų | 133.1 | 60% | 0.597 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 120 | 175.6 | -13 | 25.6 | 0 | 0 | 0 | 110.2 | Y87 | Y87-P89 HydrophobicContact CD1-CG 4.03Å; Y87-P89 HydrophobicContact CE1-CB 4.07Å; Y87-P89 HydrophobicContact CE1-CG 3.74Å; Y87-P89 WeakPolarHBondContact O-CD 3.41Å |
| 90 | G | 51.8 | Low | 53.5 | Low | 64 Ų | 64 | 133 Ų | 133 | 66% | 0.66 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 142.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | I88 | I88-G90 PolarHBondContact O-N 3.45Š|
| 91 | P | 59.1 | Low | 53.1 | Low | 129 Ų | 129 | 131.6 Ų | 131.6 | 84% | 0.838 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 138.8 | 164 | 29.6 | -29.7 | 0 | 0 | 0 | 110.8 | ||
| 92 | K | 55.9 | Low | 53.2 | Low | 208 Ų | 208 | 127.1 Ų | 127.1 | 90% | 0.904 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 141 | -176.4 | -65.2 | 177.2 | 178.2 | 174.2 | 0 | 112 | ||
| 93 | T | 48.2 | Very low | 53 | Low | 128 Ų | 128 | 126.7 Ų | 126.7 | 79% | 0.785 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 164.8 | 178.9 | 59.3 | 0 | 0 | 0 | 0 | 112.3 | ||
| 94 | P | 45 | Very low | 52.4 | Low | 129 Ų | 129 | 126.4 Ų | 126.4 | 84% | 0.838 | 76% | 0.759 | S | S | * | * | -151.1 | 127.7 | 71.7 | 35.6 | -13.3 | 0 | 0 | 0 | 115.5 | |||||
| 95 | G | 43.3 | Very low | 52.3 | Low | 75 Ų | 75 | 123 Ų | 123 | 77% | 0.773 | 75% | 0.746 | S | S | * | * | trans | 160.2 | 80.6 | 173 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 96 | D | 43.6 | Very low | 52 | Low | 175 Ų | 175 | 127.8 Ų | 127.8 | 94% | 0.936 | 75% | 0.751 | S | S | * | * | trans | -60.3 | 137.7 | -175.2 | -65 | -51.7 | 0 | 0 | 0 | 114 | ||||
| 97 | G | 43.1 | Very low | 51.4 | Low | 83 Ų | 83 | 125.2 Ų | 125.2 | 86% | 0.856 | 74% | 0.742 | S | S | * | * | 121.1 | 8.4 | 128.9 | 0 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 98 | A | 50.8 | Low | 51.4 | Low | 94 Ų | 94 | 123.5 Ų | 123.5 | 78% | 0.777 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -111 | -20.5 | -170 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||
| 99 | S | 52 | Low | 51.1 | Low | 122 Ų | 122 | 119.5 Ų | 119.5 | 85% | 0.853 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -125.6 | 7.9 | -158.8 | -60.8 | 0 | 0 | 0 | 0 | 118 | ||
| 100 | D | 49.7 | Very low | 50.5 | Low | 126 Ų | 126 | 123.9 Ų | 123.9 | 67% | 0.674 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -121.4 | 13.6 | 178.9 | -141.1 | -8.4 | 0 | 0 | 0 | 114.5 | G102 | D100-G102 VanDerWaalsContact C-N 3.34Å; D100-G102 PolarHBondContact O-N 3.37Å |
| 101 | A | 48.1 | Very low | 50.8 | Low | 79 Ų | 79 | 123.7 Ų | 123.7 | 65% | 0.653 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | -11.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 102 | G | 50 | Low | 50.8 | Low | 65 Ų | 65 | 124 Ų | 124 | 67% | 0.67 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83 | -29 | -170.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | D100 | D100-G102 VanDerWaalsContact C-N 3.34Å; D100-G102 PolarHBondContact O-N 3.37Å |
| 103 | K | 49.6 | Very low | 51.1 | Low | 177 Ų | 177 | 118.1 Ų | 118.1 | 77% | 0.77 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.7 | -30.4 | -175.7 | -83.7 | -176.8 | 174.5 | -173.5 | 0 | 114.2 | N105 | K103-N105 VanDerWaalsContact C-N 3.27Å; K103-N105 PolarHBondContact O-N 3.17Å |
| 104 | Q | 50.2 | Low | 52.2 | Low | 116 Ų | 116 | 121.2 Ų | 121.2 | 54% | 0.542 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -71.4 | -17.3 | 176.9 | -68.9 | -168.9 | 1.1 | 0 | 0 | 114.2 | R108 | Q104-R108 WeakPolarHBondContact O-CG 3.49Å; Q104-R108 PolarHBondContact O-N 3.38Å |
| 105 | N | 51.4 | Low | 53.6 | Low | 101 Ų | 101 | 122.6 Ų | 122.6 | 54% | 0.54 | 67% | 0.67 | S | S | . | * | H | α-helix | trans | -73.9 | -34.7 | -177.1 | -159.7 | -30.8 | 0 | 0 | 0 | 112.4 | K103 T109 | K103-N105 VanDerWaalsContact C-N 3.27Å; K103-N105 PolarHBondContact O-N 3.17Å; N105-T109 WeakPolarHBondContact O-CB 3.44Å; N105-T109 PolarHBondContact O-N 3Å; N105-T109 PolarHBondContact O-OG1 3.07Å; N105-T109 PolarHBondContact OD1-OG1 3.02Å |
| 106 | R | 52.9 | Low | 55.3 | Low | 204 Ų | 204 | 123.9 Ų | 123.9 | 77% | 0.77 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -69.7 | -36.7 | -178.7 | -77.4 | -173.1 | 168.6 | 164.1 | -1.8 | 113.1 | T109 R110 | R106-T109 PolarHBondContact O-N 3.22Å; R106-R110 PolarHBondContact O-N 3.11Å |
| 107 | D | 52.8 | Low | 57.1 | Low | 119 Ų | 119 | 120 Ų | 120 | 64% | 0.636 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -74.2 | -37.3 | 176.7 | -75.1 | -49.2 | 0 | 0 | 0 | 112.8 | T109 R110 A111 | D107-T109 VanDerWaalsContact C-N 3.25Å; D107-T109 PolarHBondContact O-N 3.27Å; D107-R110 PolarHBondContact O-N 2.78Å; D107-A111 WeakPolarHBondContact O-CB 3.45Å; D107-A111 PolarHBondContact O-N 3.34Å |
| 108 | R | 56 | Low | 59 | Low | 163 Ų | 163 | 120.1 Ų | 120.1 | 62% | 0.615 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -62.8 | -34.6 | 170.8 | -73 | -177.8 | -177.1 | -174.9 | 3.2 | 111.8 | Q104 K112 | Q104-R108 WeakPolarHBondContact O-CG 3.49Å; Q104-R108 PolarHBondContact O-N 3.38Å; R108-K112 WeakPolarHBondContact O-CD 3.48Å; R108-K112 VanDerWaalsContact O-CG 3.22Å; R108-K112 WeakPolarHBondContact O-CG 3.23Å; R108-K112 PolarHBondContact O-N 2.88Å; R108-K112 VanDerWaalsContact O-N 3.17Å |
| 109 | T | 56.1 | Low | 60.7 | Low | 61 Ų | 61 | 120.4 Ų | 120.4 | 37% | 0.374 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -71.4 | -43.4 | 177.6 | -53.4 | 0 | 0 | 0 | 0 | 111.3 | N105 R106 D107 A111 K112 I113 | N105-T109 WeakPolarHBondContact O-CB 3.44Å; N105-T109 PolarHBondContact O-N 3Å; N105-T109 PolarHBondContact O-OG1 3.07Å; N105-T109 PolarHBondContact OD1-OG1 3.02Å; R106-T109 PolarHBondContact O-N 3.22Å; D107-T109 VanDerWaalsContact C-N 3.25Å; D107-T109 PolarHBondContact O-N 3.27Å; T109-A111 PolarHBondContact O-N 3.32Å; T109-K112 PolarHBondContact O-N 3.19Å; T109-I113 HydrophobicContact CG2-CD1 4.04Å; T109-I113 WeakPolarHBondContact O-CD1 3.48Å; T109-I113 VanDerWaalsContact O-CG1 3.23Å; T109-I113 WeakPolarHBondContact O-CG1 3.5Å; T109-I113 PolarHBondContact O-N 3.33Å |
| 110 | R | 51.9 | Low | 62.4 | Low | 183 Ų | 183 | 117.9 Ų | 117.9 | 69% | 0.691 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -64.1 | -36.7 | 175 | -76 | -174.6 | 173.7 | -134 | -1.9 | 113.4 | R106 D107 | R106-R110 PolarHBondContact O-N 3.11Å; D107-R110 PolarHBondContact O-N 2.78Å |
| 111 | A | 56.5 | Low | 64.3 | Low | 60 Ų | 60 | 113.4 Ų | 113.4 | 50% | 0.496 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -68.2 | -33.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.9 | D107 T109 | D107-A111 WeakPolarHBondContact O-CB 3.45Å; D107-A111 PolarHBondContact O-N 3.34Å; T109-A111 PolarHBondContact O-N 3.32Å |
| 112 | K | 59.8 | Low | 66.3 | Low | 137 Ų | 137 | 114.3 Ų | 114.3 | 60% | 0.596 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -72.6 | -39.1 | 175.8 | -73.6 | 171.5 | -178.4 | -176.8 | 0 | 112.5 | R108 T109 R114 K115 I116 | R108-K112 WeakPolarHBondContact O-CD 3.48Å; R108-K112 VanDerWaalsContact O-CG 3.22Å; R108-K112 WeakPolarHBondContact O-CG 3.23Å; R108-K112 PolarHBondContact O-N 2.88Å; R108-K112 VanDerWaalsContact O-N 3.17Å; T109-K112 PolarHBondContact O-N 3.19Å; K112-R114 VanDerWaalsContact C-N 3.29Å; K112-R114 PolarHBondContact O-N 3.1Å; K112-K115 WeakPolarHBondContact O-CB 3.22Å; K112-K115 PolarHBondContact O-N 3.41Å; K112-K115 VanDerWaalsContact O-N 3.11Å; K112-I116 PolarHBondContact O-N 2.8Å |
| 113 | I | 63 | Low | 68.2 | Low | 83 Ų | 83 | 113.8 Ų | 113.8 | 43% | 0.426 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -60 | -39.8 | -179.8 | -67.8 | 160.1 | 0 | 0 | 0 | 111.2 | T109 K115 I116 V117 | T109-I113 HydrophobicContact CG2-CD1 4.04Å; T109-I113 WeakPolarHBondContact O-CD1 3.48Å; T109-I113 VanDerWaalsContact O-CG1 3.23Å; T109-I113 WeakPolarHBondContact O-CG1 3.5Å; T109-I113 PolarHBondContact O-N 3.33Å; I113-K115 VanDerWaalsContact C-N 3.25Å; I113-K115 PolarHBondContact O-N 3.09Å; I113-I116 PolarHBondContact O-N 3.34Å; I113-I116 VanDerWaalsContact O-N 3.09Å; I113-V117 HydrophobicContact CG2-CG2 4.04Å; I113-V117 WeakPolarHBondContact O-CG2 3.35Å; I113-V117 PolarHBondContact O-N 3.24Å |
| 114 | R | 69.7 | Low | 70.2 | Confident | 193 Ų | 193 | 110 Ų | 110 | 73% | 0.728 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -59 | -36.7 | 177.5 | -66.6 | -176.8 | -172.4 | 178.8 | 2.1 | 112.7 | K112 C118 | K112-R114 VanDerWaalsContact C-N 3.29Å; K112-R114 PolarHBondContact O-N 3.1Å; R114-C118 PolarHBondContact O-N 3.14Å; R114-C118 PolarHBondContact O-SG 3.39Å; R114-C118 VanDerWaalsContact O-SG 3.32Å |
| 115 | K | 76.1 | Confident | 72.1 | Confident | 158 Ų | 158 | 108.5 Ų | 108.5 | 69% | 0.687 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -68 | -42.2 | 175.8 | -63.6 | -174.8 | 177.4 | -179.1 | 0 | 111.4 | K112 I113 C118 V119 | K112-K115 WeakPolarHBondContact O-CB 3.22Å; K112-K115 PolarHBondContact O-N 3.41Å; K112-K115 VanDerWaalsContact O-N 3.11Å; I113-K115 VanDerWaalsContact C-N 3.25Å; I113-K115 PolarHBondContact O-N 3.09Å; K115-C118 PolarHBondContact O-N 3.5Å; K115-V119 WeakPolarHBondContact O-CG2 3.26Å; K115-V119 PolarHBondContact O-N 2.97Å |
| 116 | I | 78.9 | Confident | 74.1 | Confident | 102 Ų | 102 | 107.6 Ų | 107.6 | 52% | 0.523 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -64.4 | -43.6 | 178.8 | -61.8 | 166.8 | 0 | 0 | 0 | 110.2 | K112 I113 C118 V119 V120 | K112-I116 PolarHBondContact O-N 2.8Å; I113-I116 PolarHBondContact O-N 3.34Å; I113-I116 VanDerWaalsContact O-N 3.09Å; I116-C118 VanDerWaalsContact C-N 3.32Å; I116-C118 PolarHBondContact O-N 2.85Å; I116-V119 PolarHBondContact O-N 2.89Å; I116-V119 VanDerWaalsContact O-N 3.14Å; I116-V120 HydrophobicContact CG2-CG2 4.02Å; I116-V120 WeakPolarHBondContact O-CB 3.44Å; I116-V120 VanDerWaalsContact O-CG2 3.26Å; I116-V120 WeakPolarHBondContact O-CG2 3.36Å; I116-V120 PolarHBondContact O-N 2.84Å |
| 117 | V | 81.6 | Confident | 76 | Confident | 93 Ų | 93 | 102.5 Ų | 102.5 | 56% | 0.564 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -61.1 | -40.7 | 178 | 174.8 | 0 | 0 | 0 | 0 | 111.4 | I113 G121 | I113-V117 HydrophobicContact CG2-CG2 4.04Å; I113-V117 WeakPolarHBondContact O-CG2 3.35Å; I113-V117 PolarHBondContact O-N 3.24Å; V117-G121 PolarHBondContact O-N 3.02Å |
| 118 | C | 82.5 | Confident | 77.9 | Confident | 87 Ų | 87 | 99.8 Ų | 99.8 | 59% | 0.588 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.1 | -43.8 | 174 | -67.2 | 0 | 0 | 0 | 0 | 112.1 | R114 K115 I116 G121 V122 | R114-C118 PolarHBondContact O-N 3.14Å; R114-C118 PolarHBondContact O-SG 3.39Å; R114-C118 VanDerWaalsContact O-SG 3.32Å; K115-C118 PolarHBondContact O-N 3.5Å; I116-C118 VanDerWaalsContact C-N 3.32Å; I116-C118 PolarHBondContact O-N 2.85Å; C118-G121 PolarHBondContact O-N 3.34Å; C118-V122 WeakPolarHBondContact O-CG2 3.44Å; C118-V122 PolarHBondContact O-N 3.06Å |
| 119 | V | 85.4 | Confident | 79.6 | Confident | 100 Ų | 100 | 97.4 Ų | 97.4 | 61% | 0.606 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.2 | -44.9 | 178.8 | 174.4 | 0 | 0 | 0 | 0 | 111.3 | K115 I116 G121 V122 S123 | K115-V119 WeakPolarHBondContact O-CG2 3.26Å; K115-V119 PolarHBondContact O-N 2.97Å; I116-V119 PolarHBondContact O-N 2.89Å; I116-V119 VanDerWaalsContact O-N 3.14Å; V119-G121 VanDerWaalsContact C-N 3.31Å; V119-G121 PolarHBondContact O-N 3.35Å; V119-V122 PolarHBondContact O-N 3.15Å; V119-S123 WeakPolarHBondContact O-CB 3.26Å; V119-S123 PolarHBondContact O-N 3.1Å; V119-S123 PolarHBondContact O-OG 3.33Å |
| 120 | V | 88.9 | Confident | 81.3 | Confident | 69 Ų | 69 | 98.1 Ų | 98.1 | 42% | 0.418 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.4 | -44.6 | 175.7 | 172.9 | 0 | 0 | 0 | 0 | 109.8 | I116 V122 S123 L124 | I116-V120 HydrophobicContact CG2-CG2 4.02Å; I116-V120 WeakPolarHBondContact O-CB 3.44Å; I116-V120 VanDerWaalsContact O-CG2 3.26Å; I116-V120 WeakPolarHBondContact O-CG2 3.36Å; I116-V120 PolarHBondContact O-N 2.84Å; V120-V122 PolarHBondContact O-N 2.7Å; V120-S123 WeakPolarHBondContact CA-OG 3.38Å; V120-S123 PolarHBondContact O-N 3.36Å; V120-S123 PolarHBondContact O-OG 3.35Å; V120-L124 HydrophobicContact CG1-CD1 4.07Å; V120-L124 WeakPolarHBondContact O-CB 3.49Å; V120-L124 PolarHBondContact O-N 3.37Å |
| 121 | G | 89.2 | Confident | 83.1 | Confident | 32 Ų | 32 | 94 Ų | 94 | 33% | 0.33 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -55.3 | -53.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V117 C118 V119 S123 L124 T125 | V117-G121 PolarHBondContact O-N 3.02Å; C118-G121 PolarHBondContact O-N 3.34Å; V119-G121 VanDerWaalsContact C-N 3.31Å; V119-G121 PolarHBondContact O-N 3.35Å; G121-S123 VanDerWaalsContact C-N 3.33Å; G121-S123 PolarHBondContact O-N 3.25Å; G121-L124 PolarHBondContact O-N 3.47Å; G121-T125 PolarHBondContact O-N 3.24Å; G121-T125 PolarHBondContact O-OG1 2.93Å |
| 122 | V | 89.9 | Confident | 84.7 | Confident | 97 Ų | 97 | 94.9 Ų | 94.9 | 59% | 0.588 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.5 | -43.8 | 177.7 | 175.6 | 0 | 0 | 0 | 0 | 111.3 | C118 V119 V120 L124 T125 V126 | C118-V122 WeakPolarHBondContact O-CG2 3.44Å; C118-V122 PolarHBondContact O-N 3.06Å; V119-V122 PolarHBondContact O-N 3.15Å; V120-V122 PolarHBondContact O-N 2.7Å; V122-L124 VanDerWaalsContact C-N 3.34Å; V122-L124 PolarHBondContact O-N 3.27Å; V122-T125 PolarHBondContact O-N 3.4Å; V122-V126 WeakPolarHBondContact O-CG2 3.46Å; V122-V126 PolarHBondContact O-N 3.46Å; V122-V126 VanDerWaalsContact O-N 3.1Å |
| 123 | S | 90.5 | Very high | 86.1 | Confident | 54 Ų | 54 | 91.1 Ų | 91.1 | 38% | 0.378 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.9 | -40.2 | 179 | 68.9 | 0 | 0 | 0 | 0 | 112.5 | V119 V120 G121 V126 I127 | V119-S123 WeakPolarHBondContact O-CB 3.26Å; V119-S123 PolarHBondContact O-N 3.1Å; V119-S123 PolarHBondContact O-OG 3.33Å; V120-S123 WeakPolarHBondContact CA-OG 3.38Å; V120-S123 PolarHBondContact O-N 3.36Å; V120-S123 PolarHBondContact O-OG 3.35Å; G121-S123 VanDerWaalsContact C-N 3.33Å; G121-S123 PolarHBondContact O-N 3.25Å; S123-V126 PolarHBondContact O-N 2.86Å; S123-I127 WeakPolarHBondContact O-CD1 3.42Å; S123-I127 VanDerWaalsContact O-CG1 3.26Å; S123-I127 WeakPolarHBondContact O-CG1 3.38Å; S123-I127 PolarHBondContact O-N 3.44Å |
| 124 | L | 91.1 | Very high | 87.3 | Confident | 99 Ų | 99 | 91 Ų | 91 | 52% | 0.518 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.3 | -42.7 | 176.1 | -116.3 | 143.2 | 0 | 0 | 0 | 111.1 | V120 G121 V122 V126 I127 C128 | V120-L124 HydrophobicContact CG1-CD1 4.07Å; V120-L124 WeakPolarHBondContact O-CB 3.49Å; V120-L124 PolarHBondContact O-N 3.37Å; G121-L124 PolarHBondContact O-N 3.47Å; V122-L124 VanDerWaalsContact C-N 3.34Å; V122-L124 PolarHBondContact O-N 3.27Å; L124-V126 PolarHBondContact O-N 3.03Å; L124-I127 PolarHBondContact O-N 3.45Å; L124-C128 WeakPolarHBondContact O-CB 3.34Å; L124-C128 PolarHBondContact O-N 3.1Å; L124-C128 PolarHBondContact O-SG 2.82Å |
| 125 | T | 90.9 | Very high | 88 | Confident | 83 Ų | 83 | 85.4 Ų | 85.4 | 51% | 0.509 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.6 | -44.2 | 177.6 | -37.9 | 0 | 0 | 0 | 0 | 111.7 | G121 V122 C128 I129 | G121-T125 PolarHBondContact O-N 3.24Å; G121-T125 PolarHBondContact O-OG1 2.93Å; V122-T125 PolarHBondContact O-N 3.4Å; T125-C128 PolarHBondContact O-N 2.86Å; T125-I129 HydrophobicContact CG2-CD1 4.32Å; T125-I129 VanDerWaalsContact O-CG1 3.28Å; T125-I129 WeakPolarHBondContact O-CG1 3.35Å; T125-I129 PolarHBondContact O-N 3.45Å |
| 126 | V | 92.9 | Very high | 88.3 | Confident | 83 Ų | 83 | 85.3 Ų | 85.3 | 50% | 0.503 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.2 | -46.3 | 178 | 176.3 | 0 | 0 | 0 | 0 | 110.7 | V122 S123 L124 C128 I129 V130 | V122-V126 WeakPolarHBondContact O-CG2 3.46Å; V122-V126 PolarHBondContact O-N 3.46Å; V122-V126 VanDerWaalsContact O-N 3.1Å; S123-V126 PolarHBondContact O-N 2.86Å; L124-V126 PolarHBondContact O-N 3.03Å; V126-C128 VanDerWaalsContact C-N 3.33Å; V126-C128 PolarHBondContact O-N 2.94Å; V126-I129 PolarHBondContact O-N 3.35Å; V126-V130 WeakPolarHBondContact O-CG2 3.24Å; V126-V130 PolarHBondContact O-N 3.31Å |
| 127 | I | 92.1 | Very high | 88.3 | Confident | 97 Ų | 97 | 83.6 Ų | 83.6 | 50% | 0.497 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.1 | -44.7 | 176.8 | -66.2 | 163.7 | 0 | 0 | 0 | 110.5 | S123 L124 I129 V130 L131 | S123-I127 WeakPolarHBondContact O-CD1 3.42Å; S123-I127 VanDerWaalsContact O-CG1 3.26Å; S123-I127 WeakPolarHBondContact O-CG1 3.38Å; S123-I127 PolarHBondContact O-N 3.44Å; L124-I127 PolarHBondContact O-N 3.45Å; I127-I129 PolarHBondContact O-N 2.88Å; I127-V130 PolarHBondContact O-N 2.85Å; I127-L131 HydrophobicContact CG2-CD1 3.95Å; I127-L131 HydrophobicContact CG2-CG 4.22Å; I127-L131 WeakPolarHBondContact O-CG 3.45Å; I127-L131 PolarHBondContact O-N 2.92Å |
| 128 | C | 92.8 | Very high | 87.9 | Confident | 62 Ų | 62 | 83.3 Ų | 83.3 | 42% | 0.419 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.1 | -44.7 | 176.9 | -75.6 | 0 | 0 | 0 | 0 | 112.2 | L124 T125 V126 V130 L131 V132 | L124-C128 WeakPolarHBondContact O-CB 3.34Å; L124-C128 PolarHBondContact O-N 3.1Å; L124-C128 PolarHBondContact O-SG 2.82Å; T125-C128 PolarHBondContact O-N 2.86Å; V126-C128 VanDerWaalsContact C-N 3.33Å; V126-C128 PolarHBondContact O-N 2.94Å; C128-V130 VanDerWaalsContact C-N 3.33Å; C128-V130 PolarHBondContact O-N 2.72Å; C128-L131 PolarHBondContact O-N 3.46Å; C128-V132 WeakPolarHBondContact O-CB 3.32Å; C128-V132 VanDerWaalsContact O-CG2 3.24Å; C128-V132 WeakPolarHBondContact O-CG2 3.49Å; C128-V132 PolarHBondContact O-N 3.44Å |
| 129 | I | 91.8 | Very high | 87 | Confident | 112 Ų | 112 | 80.8 Ų | 80.8 | 57% | 0.574 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.8 | -43.3 | 177.4 | -66.8 | 163.5 | 0 | 0 | 0 | 110.7 | T125 V126 I127 V132 A133 | T125-I129 HydrophobicContact CG2-CD1 4.32Å; T125-I129 VanDerWaalsContact O-CG1 3.28Å; T125-I129 WeakPolarHBondContact O-CG1 3.35Å; T125-I129 PolarHBondContact O-N 3.45Å; V126-I129 PolarHBondContact O-N 3.35Å; I127-I129 PolarHBondContact O-N 2.88Å; I129-V132 PolarHBondContact O-N 3.26Å; I129-A133 PolarHBondContact O-N 3.47Å |
| 130 | V | 92.3 | Very high | 85.6 | Confident | 77 Ų | 77 | 83.5 Ų | 83.5 | 47% | 0.467 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.6 | -43.9 | 177.1 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | V126 I127 C128 V132 A133 I134 | V126-V130 WeakPolarHBondContact O-CG2 3.24Å; V126-V130 PolarHBondContact O-N 3.31Å; I127-V130 PolarHBondContact O-N 2.85Å; C128-V130 VanDerWaalsContact C-N 3.33Å; C128-V130 PolarHBondContact O-N 2.72Å; V130-V132 VanDerWaalsContact C-N 3.34Å; V130-V132 PolarHBondContact O-N 2.97Å; V130-A133 WeakPolarHBondContact O-CB 3.3Å; V130-A133 PolarHBondContact O-N 3.32Å; V130-I134 HydrophobicContact CG1-CD1 3.86Å; V130-I134 HydrophobicContact CG1-CG1 4.47Å; V130-I134 VanDerWaalsContact O-CG1 3.31Å; V130-I134 WeakPolarHBondContact O-CG1 3.31Å; V130-I134 PolarHBondContact O-N 3.29Å |
| 131 | L | 90.2 | Very high | 84 | Confident | 97 Ų | 97 | 85.6 Ų | 85.6 | 51% | 0.508 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64 | -38.7 | 176.7 | -71.5 | 176.7 | 0 | 0 | 0 | 112.2 | I127 C128 I134 S135 | I127-L131 HydrophobicContact CG2-CD1 3.95Å; I127-L131 HydrophobicContact CG2-CG 4.22Å; I127-L131 WeakPolarHBondContact O-CG 3.45Å; I127-L131 PolarHBondContact O-N 2.92Å; C128-L131 PolarHBondContact O-N 3.46Å; L131-I134 PolarHBondContact O-N 3.23Å; L131-S135 VanDerWaalsContact O-CB 3.32Å; L131-S135 WeakPolarHBondContact O-CB 3.35Å; L131-S135 PolarHBondContact O-N 3.02Å; L131-S135 PolarHBondContact O-OG 3.25Å |
| 132 | V | 89.6 | Confident | 82.3 | Confident | 77 Ų | 77 | 89.4 Ų | 89.4 | 47% | 0.467 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63 | -45.6 | 173.6 | 169.4 | 0 | 0 | 0 | 0 | 110 | C128 I129 V130 I134 S135 F136 | C128-V132 WeakPolarHBondContact O-CB 3.32Å; C128-V132 VanDerWaalsContact O-CG2 3.24Å; C128-V132 WeakPolarHBondContact O-CG2 3.49Å; C128-V132 PolarHBondContact O-N 3.44Å; I129-V132 PolarHBondContact O-N 3.26Å; V130-V132 VanDerWaalsContact C-N 3.34Å; V130-V132 PolarHBondContact O-N 2.97Å; V132-I134 PolarHBondContact O-N 3.45Å; V132-S135 WeakPolarHBondContact O-CB 3.31Å; V132-S135 PolarHBondContact O-N 2.9Å; V132-S135 VanDerWaalsContact O-N 3.15Å; V132-F136 HydrophobicContact CG1-CD2 3.61Å; V132-F136 HydrophobicContact CG1-CE2 3.46Å; V132-F136 VanDerWaalsContact CG1-CE2 3.46Å; V132-F136 WeakPolarHBondContact O-CD2 3.28Å; V132-F136 PolarHBondContact O-N 3.07Å |
| 133 | A | 89.1 | Confident | 80.5 | Confident | 59 Ų | 59 | 89.2 Ų | 89.2 | 49% | 0.488 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.7 | -43.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | I129 V130 S135 F136 A137 | I129-A133 PolarHBondContact O-N 3.47Å; V130-A133 WeakPolarHBondContact O-CB 3.3Å; V130-A133 PolarHBondContact O-N 3.32Å; A133-S135 VanDerWaalsContact C-N 3.35Å; A133-F136 PolarHBondContact O-N 3.34Å; A133-A137 PolarHBondContact O-N 3.15Å |
| 134 | I | 87.3 | Confident | 78.6 | Confident | 81 Ų | 81 | 96.3 Ų | 96.3 | 42% | 0.415 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.3 | -40.9 | 174.1 | -64.8 | 164.8 | 0 | 0 | 0 | 110.4 | V130 L131 V132 F136 A137 L138 | V130-I134 HydrophobicContact CG1-CD1 3.86Å; V130-I134 HydrophobicContact CG1-CG1 4.47Å; V130-I134 VanDerWaalsContact O-CG1 3.31Å; V130-I134 WeakPolarHBondContact O-CG1 3.31Å; V130-I134 PolarHBondContact O-N 3.29Å; L131-I134 PolarHBondContact O-N 3.23Å; V132-I134 PolarHBondContact O-N 3.45Å; I134-F136 VanDerWaalsContact C-N 3.31Å; I134-F136 PolarHBondContact O-N 3.29Å; I134-A137 WeakPolarHBondContact O-CB 3.38Å; I134-A137 PolarHBondContact O-N 2.9Å; I134-A137 VanDerWaalsContact O-N 3.17Å; I134-L138 HydrophobicContact CG2-CD1 3.6Å; I134-L138 HydrophobicContact CG2-CG 3.97Å; I134-L138 WeakPolarHBondContact O-CB 3.21Å; I134-L138 VanDerWaalsContact O-CG 3.3Å; I134-L138 WeakPolarHBondContact O-CG 3.49Å; I134-L138 PolarHBondContact O-N 2.9Å |
| 135 | S | 84.6 | Confident | 76.7 | Confident | 75 Ų | 75 | 97.2 Ų | 97.2 | 52% | 0.524 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.6 | -33.8 | 177.7 | -57.8 | 0 | 0 | 0 | 0 | 112.2 | L131 V132 A133 G139 | L131-S135 VanDerWaalsContact O-CB 3.32Å; L131-S135 WeakPolarHBondContact O-CB 3.35Å; L131-S135 PolarHBondContact O-N 3.02Å; L131-S135 PolarHBondContact O-OG 3.25Å; V132-S135 WeakPolarHBondContact O-CB 3.31Å; V132-S135 PolarHBondContact O-N 2.9Å; V132-S135 VanDerWaalsContact O-N 3.15Å; A133-S135 VanDerWaalsContact C-N 3.35Å; S135-G139 WeakPolarHBondContact O-CA 3.19Å; S135-G139 PolarHBondContact O-N 3.32Å |
| 136 | F | 81.8 | Confident | 74.9 | Confident | 156 Ų | 156 | 96 Ų | 96 | 68% | 0.684 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -69.9 | -39.6 | 171.4 | -84.6 | -71.8 | 0 | 0 | 0 | 111.8 | V132 A133 I134 | V132-F136 HydrophobicContact CG1-CD2 3.61Å; V132-F136 HydrophobicContact CG1-CE2 3.46Å; V132-F136 VanDerWaalsContact CG1-CE2 3.46Å; V132-F136 WeakPolarHBondContact O-CD2 3.28Å; V132-F136 PolarHBondContact O-N 3.07Å; A133-F136 PolarHBondContact O-N 3.34Å; I134-F136 VanDerWaalsContact C-N 3.31Å; I134-F136 PolarHBondContact O-N 3.29Å |
| 137 | A | 80.5 | Confident | 72.9 | Confident | 65 Ų | 65 | 98.3 Ų | 98.3 | 54% | 0.537 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.3 | -46.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A133 I134 | A133-A137 PolarHBondContact O-N 3.15Å; I134-A137 WeakPolarHBondContact O-CB 3.38Å; I134-A137 PolarHBondContact O-N 2.9Å; I134-A137 VanDerWaalsContact O-N 3.17Å |
| 138 | L | 71.5 | Confident | 70.7 | Confident | 87 Ų | 87 | 97.5 Ų | 97.5 | 46% | 0.455 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -75.5 | -31.5 | 178 | -64.2 | 178.5 | 0 | 0 | 0 | 112.4 | I134 Q140 E141 I142 | I134-L138 HydrophobicContact CG2-CD1 3.6Å; I134-L138 HydrophobicContact CG2-CG 3.97Å; I134-L138 WeakPolarHBondContact O-CB 3.21Å; I134-L138 VanDerWaalsContact O-CG 3.3Å; I134-L138 WeakPolarHBondContact O-CG 3.49Å; I134-L138 PolarHBondContact O-N 2.9Å; L138-Q140 VanDerWaalsContact C-N 3.27Å; L138-Q140 PolarHBondContact O-N 2.72Å; L138-E141 CarbonylContact O-C 3.57Å; L138-E141 WeakPolarHBondContact O-CA 3.39Å; L138-E141 WeakPolarHBondContact O-CB 3.5Å; L138-E141 PolarHBondContact O-N 2.77Å; L138-I142 HydrophobicContact CB-CD1 4.34Å; L138-I142 VanDerWaalsContact O-CG1 3.31Å; L138-I142 WeakPolarHBondContact O-CG1 3.36Å; L138-I142 PolarHBondContact O-N 3.17Å |
| 139 | G | 64.6 | Low | 68.8 | Low | 34 Ų | 34 | 100.7 Ų | 100.7 | 35% | 0.351 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -64.6 | -30 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | S135 E141 D143 | S135-G139 WeakPolarHBondContact O-CA 3.19Å; S135-G139 PolarHBondContact O-N 3.32Å; G139-E141 VanDerWaalsContact C-N 3.31Å; G139-D143 PolarHBondContact O-N 2.96Å; G139-D143 VanDerWaalsContact O-N 3.15Å |
| 140 | Q | 56 | Low | 66.8 | Low | 157 Ų | 157 | 100.7 Ų | 100.7 | 73% | 0.734 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -70.7 | -27.9 | 169.8 | -69.4 | -167 | -8 | 0 | 0 | 112.8 | L138 | L138-Q140 VanDerWaalsContact C-N 3.27Å; L138-Q140 PolarHBondContact O-N 2.72Å |
| 141 | E | 55.4 | Low | 64.8 | Low | 114 Ų | 114 | 102.6 Ų | 102.6 | 53% | 0.533 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -80.6 | -35.4 | 178.3 | -137.4 | 164.4 | 157.8 | 0 | 0 | 111.4 | L138 G139 R144 M145 | L138-E141 CarbonylContact O-C 3.57Å; L138-E141 WeakPolarHBondContact O-CA 3.39Å; L138-E141 WeakPolarHBondContact O-CB 3.5Å; L138-E141 PolarHBondContact O-N 2.77Å; G139-E141 VanDerWaalsContact C-N 3.31Å; E141-R144 PolarHBondContact O-N 3.43Å; E141-M145 HydrophobicContact CG-CE 4.44Å; E141-M145 PolarHBondContact O-N 2.86Å |
| 142 | I | 53.9 | Low | 62.9 | Low | 112 Ų | 112 | 104.4 Ų | 104.4 | 57% | 0.574 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -77.8 | -29.6 | 178.7 | -51.2 | 159 | 0 | 0 | 0 | 112 | L138 R144 M145 G146 | L138-I142 HydrophobicContact CB-CD1 4.34Å; L138-I142 VanDerWaalsContact O-CG1 3.31Å; L138-I142 WeakPolarHBondContact O-CG1 3.36Å; L138-I142 PolarHBondContact O-N 3.17Å; I142-R144 PolarHBondContact O-N 3.34Å; I142-M145 PolarHBondContact O-N 3.15Å; I142-G146 PolarHBondContact O-N 3.45Å |
| 143 | D | 52.2 | Low | 61 | Low | 93 Ų | 93 | 106.7 Ų | 106.7 | 50% | 0.497 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -69.7 | -18.3 | 170.7 | -171.3 | 52.3 | 0 | 0 | 0 | 112.6 | G139 K147 | G139-D143 PolarHBondContact O-N 2.96Å; G139-D143 VanDerWaalsContact O-N 3.15Å; D143-K147 IonicContact OD1-NZ 2.78Å; D143-K147 PolarHBondContact OD1-NZ 3.23Å; D143-K147 IonicContact OD2-NZ 2.84Å; D143-K147 PolarHBondContact OD2-NZ 2.84Å |
| 144 | R | 50.5 | Low | 59.3 | Low | 202 Ų | 202 | 108 Ų | 108 | 76% | 0.762 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -86.6 | -31.6 | 169.7 | -71.1 | -170.6 | 176.3 | -159.2 | 0.6 | 112.9 | E141 I142 C148 | E141-R144 PolarHBondContact O-N 3.43Å; I142-R144 PolarHBondContact O-N 3.34Å; R144-C148 PolarHBondContact O-SG 3.35Å; R144-C148 VanDerWaalsContact O-SG 3.35Å |
| 145 | M | 51.4 | Low | 57.8 | Low | 118 Ų | 118 | 112.7 Ų | 112.7 | 58% | 0.581 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -76.7 | -37.9 | 176.5 | -71.5 | 172.9 | -178.6 | 0 | 0 | 112.4 | E141 I142 K147 C148 | E141-M145 HydrophobicContact CG-CE 4.44Å; E141-M145 PolarHBondContact O-N 2.86Å; I142-M145 PolarHBondContact O-N 3.15Å; M145-K147 VanDerWaalsContact C-N 3.29Å; M145-K147 PolarHBondContact O-N 2.9Å; M145-C148 PolarHBondContact O-N 2.78Å |
| 146 | G | 51.9 | Low | 56.1 | Low | 57 Ų | 57 | 112.2 Ų | 112.2 | 59% | 0.588 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | -14.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | I142 | I142-G146 PolarHBondContact O-N 3.45Š|
| 147 | K | 51.4 | Low | 54.7 | Low | 132 Ų | 132 | 110.8 Ų | 110.8 | 57% | 0.574 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.6 | -11.7 | 175.1 | -80.5 | -178.3 | 178.5 | 96.8 | 0 | 113.8 | D143 M145 | D143-K147 IonicContact OD1-NZ 2.78Å; D143-K147 PolarHBondContact OD1-NZ 3.23Å; D143-K147 IonicContact OD2-NZ 2.84Å; D143-K147 PolarHBondContact OD2-NZ 2.84Å; M145-K147 VanDerWaalsContact C-N 3.29Å; M145-K147 PolarHBondContact O-N 2.9Å |
| 148 | C | 46.9 | Very low | 53.3 | Low | 80 Ų | 80 | 115.6 Ų | 115.6 | 54% | 0.541 | 65% | 0.645 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -95.5 | -18.1 | -174.6 | -72.7 | 0 | 0 | 0 | 0 | 114.7 | R144 M145 C150 | R144-C148 PolarHBondContact O-SG 3.35Å; R144-C148 VanDerWaalsContact O-SG 3.35Å; M145-C148 PolarHBondContact O-N 2.78Å; C148-C150 PolarHBondContact O-N 3.39Å |
| 149 | D | 52.3 | Low | 51.9 | Low | 130 Ų | 130 | 124 Ų | 124 | 70% | 0.695 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -8.3 | -175.9 | -67.8 | -34.4 | 0 | 0 | 0 | 114.7 | ||
| 150 | C | 48.7 | Very low | 51.2 | Low | 112 Ų | 112 | 128.5 Ų | 128.5 | 76% | 0.757 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.4 | -4.9 | 177.8 | -62.6 | 0 | 0 | 0 | 0 | 114.6 | C148 | C148-C150 PolarHBondContact O-N 3.39Š|
| 151 | L | 51.5 | Low | 51 | Low | 117 Ų | 117 | 126.9 Ų | 126.9 | 61% | 0.613 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.7 | -12.4 | -170 | -127.4 | 145.3 | 0 | 0 | 0 | 114.9 | ||
| 152 | N | 50 | Low | 50.7 | Low | 134 Ų | 134 | 127.7 Ų | 127.7 | 72% | 0.717 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -100.3 | -14.2 | 178.4 | -92.2 | -45.2 | 0 | 0 | 0 | 115.4 | A154 | N152-A154 VanDerWaalsContact C-N 3.32Š|
| 153 | T | 49.5 | Very low | 50.6 | Low | 126 Ų | 126 | 128.6 Ų | 128.6 | 77% | 0.773 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -80.2 | -15.2 | 171.9 | -53.5 | 0 | 0 | 0 | 0 | 112.5 | ||
| 154 | A | 52.8 | Low | 50.5 | Low | 87 Ų | 87 | 130.8 Ų | 130.8 | 72% | 0.719 | 73% | 0.726 | S | S | * | * | G | 310 helix | trans | -86.7 | -2.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115 | N152 | N152-A154 VanDerWaalsContact C-N 3.32Š|
| 155 | K | 56.2 | Low | 50.5 | Low | 178 Ų | 178 | 126.1 Ų | 126.1 | 77% | 0.774 | 72% | 0.723 | S | S | * | * | G | 310 helix | trans | -110.9 | 10.5 | -177.7 | -73.1 | -170.7 | 173.4 | -179.4 | 0 | 115 | ||
| 156 | G | 49.6 | Very low | 50.4 | Low | 66 Ų | 66 | 126.6 Ų | 126.6 | 68% | 0.68 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -100 | 14.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||
| 157 | T | 51.4 | Low | 50.3 | Low | 125 Ų | 125 | 132 Ų | 132 | 77% | 0.767 | 74% | 0.744 | S | S | * | * | trans | -151.7 | 69.4 | -171.8 | -49.6 | 0 | 0 | 0 | 0 | 113 | ||||
| 158 | I | 52.1 | Low | 50.2 | Low | 166 Ų | 166 | 132 Ų | 132 | 85% | 0.851 | 76% | 0.759 | S | S | * | * | trans | -155.1 | 115.4 | 152 | -51.5 | -175 | 0 | 0 | 0 | 109.1 | ||||
| 159 | H | 41.4 | Very low | 50.5 | Low | 263 Ų | 263 | 136.7 Ų | 136.7 | 100% | 1.218 | 78% | 0.778 | S | S | * | * | trans | 65.7 | 0 | 164.1 | -108.5 | -95.6 | 0 | 0 | 0 | 121 |
Retrieved 159 of 159 residues in 122.8 ms
(Link to these results)