| 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 | 35.7 | Very low | 38.9 | Very low | 247 Ų | 247 | 170.1 Ų | 170.1 | 100% | 1.217 | 82% | 0.821 | S | S | * | * | 0 | 157.7 | 0 | -82 | 178.7 | 164.9 | 0 | 0 | 109.3 | |||||
| 2 | P | 46.9 | Very low | 38.2 | Very low | 108 Ų | 108 | 168.4 Ų | 168.4 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | trans | -131.7 | 163.6 | -147.5 | 41.5 | -27.1 | 0 | 0 | 0 | 117.3 | ||||
| 3 | T | 41.9 | Very low | 37.6 | Very low | 141 Ų | 141 | 162.6 Ų | 162.6 | 87% | 0.865 | 80% | 0.799 | S | S | * | * | trans | -158.5 | 111.4 | 149.3 | 47 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 4 | E | 40.8 | Very low | 36.9 | Very low | 168 Ų | 168 | 162.5 Ų | 162.5 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | cis | 86.5 | 148.5 | 34.6 | -146.6 | -170.8 | -94.2 | 0 | 0 | 114.3 | ||||
| 5 | I | 40.6 | Very low | 36.4 | Very low | 132 Ų | 132 | 163.9 Ų | 163.9 | 68% | 0.677 | 80% | 0.796 | S | S | * | * | trans | 78.6 | 135.6 | 176.8 | -65.8 | 175.7 | 0 | 0 | 0 | 116.3 | ||||
| 6 | K | 41.8 | Very low | 35.9 | Very low | 163 Ų | 163 | 161.6 Ų | 161.6 | 71% | 0.709 | 78% | 0.783 | S | S | * | * | cis | -158.5 | 134.3 | -15.2 | -108.8 | 175.2 | -163.2 | 162.5 | 0 | 113.2 | ||||
| 7 | Q | 41.5 | Very low | 35.4 | Very low | 179 Ų | 179 | 159.9 Ų | 159.9 | 84% | 0.836 | 78% | 0.779 | S | S | * | * | trans | 37.2 | 134.7 | 136.8 | -61.2 | 176.1 | -11.9 | 0 | 0 | 124.8 | ||||
| 8 | R | 40.8 | Very low | 35 | Very low | 255 Ų | 255 | 158.9 Ų | 158.9 | 96% | 0.962 | 78% | 0.778 | S | S | * | * | trans | -149 | 179.9 | 131.9 | -140.3 | 168.9 | 178.9 | 136.7 | 1 | 111.6 | ||||
| 9 | K | 33.9 | Very low | 34.6 | Very low | 189 Ų | 189 | 160.3 Ų | 160.3 | 82% | 0.822 | 78% | 0.782 | S | S | * | * | trans | -163.1 | 142.2 | -154.5 | -169.5 | 172.6 | -177.3 | 176.8 | 0 | 115.7 | ||||
| 10 | K | 33.1 | Very low | 34.3 | Very low | 175 Ų | 175 | 161 Ų | 161 | 76% | 0.761 | 79% | 0.786 | S | S | * | * | trans | 67.8 | 157.5 | 168.9 | -85.7 | -170.3 | 167.1 | -166.2 | 0 | 117.4 | ||||
| 11 | T | 30.4 | Very low | 35 | Very low | 114 Ų | 114 | 157.9 Ų | 157.9 | 70% | 0.699 | 78% | 0.778 | S | S | * | * | cis | -148.4 | 149.2 | 14.6 | -22.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 12 | Q | 30.8 | Very low | 34.7 | Very low | 150 Ų | 150 | 153.5 Ų | 153.5 | 70% | 0.701 | 76% | 0.755 | S | S | * | * | 42.8 | 140.5 | 67.7 | -100.8 | -175 | -30.6 | 0 | 0 | 115.2 | |||||
| 13 | S | 30.9 | Very low | 33.8 | Very low | 93 Ų | 93 | 154.8 Ų | 154.8 | 65% | 0.65 | 76% | 0.756 | S | S | * | * | cis | -148.5 | 163.6 | 5.3 | -74.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 14 | Q | 27.4 | Very low | 33.4 | Very low | 161 Ų | 161 | 153.4 Ų | 153.4 | 75% | 0.752 | 75% | 0.752 | S | S | * | * | cis | 99.9 | 125.7 | 15.9 | -165.7 | -177.2 | 11.3 | 0 | 0 | 115.6 | ||||
| 15 | K | 29.2 | Very low | 33.5 | Very low | 184 Ų | 184 | 150.9 Ų | 150.9 | 80% | 0.8 | 75% | 0.75 | S | S | * | * | trans | 70.4 | 163.7 | 179.5 | -80.2 | -149.2 | 173 | -146.1 | 0 | 118 | ||||
| 16 | Q | 28.2 | Very low | 32.9 | Very low | 126 Ų | 126 | 149.2 Ų | 149.2 | 59% | 0.589 | 76% | 0.756 | S | S | * | * | cis | 179.7 | 142.9 | -37.4 | -152.8 | -167.9 | -27.5 | 0 | 0 | 110.1 | ||||
| 17 | N | 28 | Very low | 32.2 | Very low | 134 Ų | 134 | 149 Ų | 149 | 72% | 0.717 | 76% | 0.763 | S | S | * | * | trans | 59.9 | 176.1 | 162.5 | -79.9 | 43.2 | 0 | 0 | 0 | 117.2 | ||||
| 18 | D | 28.3 | Very low | 31.5 | Very low | 141 Ų | 141 | 143.3 Ų | 143.3 | 75% | 0.754 | 75% | 0.752 | S | S | * | * | cis | -169.5 | -174.6 | -39.8 | -168.4 | 4.5 | 0 | 0 | 0 | 107.3 | ||||
| 19 | E | 27.5 | Very low | 30.9 | Very low | 185 Ų | 185 | 141.8 Ų | 141.8 | 86% | 0.864 | 75% | 0.752 | S | S | * | * | trans | 104.6 | 124 | 170.4 | -59.1 | -165.4 | 127.1 | 0 | 0 | 119.5 | ||||
| 20 | M | 29 | Very low | 30.6 | Very low | 175 Ų | 175 | 136.1 Ų | 136.1 | 86% | 0.862 | 75% | 0.747 | S | S | * | * | trans | -99.9 | -160.2 | 161.6 | -135.7 | -148.7 | 179.3 | 0 | 0 | 106.9 | ||||
| 21 | P | 48.2 | Very low | 30.4 | Very low | 95 Ų | 95 | 137.2 Ų | 137.2 | 62% | 0.617 | 76% | 0.755 | S | S | * | * | cis | -137.7 | -160.8 | 2.2 | 28 | -0.3 | 0 | 0 | 0 | 114.8 | ||||
| 22 | Q | 29.5 | Very low | 30.2 | Very low | 155 Ų | 155 | 136 Ų | 136 | 72% | 0.724 | 76% | 0.757 | S | S | * | * | trans | 90.1 | 142 | 155.8 | -66.9 | -169.9 | 17.3 | 0 | 0 | 118.5 | ||||
| 23 | N | 29.2 | Very low | 30.1 | Very low | 135 Ų | 135 | 136.1 Ų | 136.1 | 72% | 0.722 | 76% | 0.757 | S | S | * | * | cis | -142.3 | 165.7 | 4.8 | -107.2 | -32.2 | 0 | 0 | 0 | 114 | ||||
| 24 | S | 31.9 | Very low | 29.9 | Very low | 112 Ų | 112 | 139.7 Ų | 139.7 | 78% | 0.783 | 76% | 0.761 | S | S | * | * | trans | -99.2 | -159.5 | 176.1 | -50.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 25 | P | 43.9 | Very low | 29.8 | Very low | 115 Ų | 115 | 138 Ų | 138 | 75% | 0.747 | 76% | 0.761 | S | S | * | * | cis | -144.5 | -178.8 | -4.1 | 45.5 | -26.5 | 0 | 0 | 0 | 117.6 | ||||
| 26 | A | 28.2 | Very low | 29.7 | Very low | 97 Ų | 97 | 137.8 Ų | 137.8 | 80% | 0.802 | 76% | 0.76 | S | S | * | * | trans | 45.9 | 163.8 | 133.3 | 0 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 27 | N | 25.8 | Very low | 29.6 | Very low | 159 Ų | 159 | 136.1 Ų | 136.1 | 85% | 0.85 | 76% | 0.759 | S | S | * | * | cis | -179.3 | 133.3 | -30.7 | 177.9 | 26.2 | 0 | 0 | 0 | 111 | ||||
| 28 | G | 27 | Very low | 29.5 | Very low | 59 Ų | 59 | 137 Ų | 137 | 61% | 0.608 | 76% | 0.759 | S | S | * | * | trans | 88.5 | 137.8 | 136.3 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 29 | K | 29.4 | Very low | 29.4 | Very low | 224 Ų | 224 | 137.9 Ų | 137.9 | 97% | 0.974 | 76% | 0.763 | S | S | * | * | trans | 57 | 154.1 | 152.1 | -63.9 | -177.1 | 175.9 | -176.2 | 0 | 119.8 | ||||
| 30 | G | 27 | Very low | 29.4 | Very low | 69 Ų | 69 | 132.6 Ų | 132.6 | 71% | 0.711 | 76% | 0.758 | S | S | * | * | cis | 161.1 | 127.7 | -9.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 31 | E | 27.9 | Very low | 29.4 | Very low | 198 Ų | 198 | 134.2 Ų | 134.2 | 93% | 0.925 | 76% | 0.764 | S | S | * | * | trans | 53.2 | 133.6 | 154.2 | -63.5 | -166.1 | 114.6 | 0 | 0 | 124.8 | ||||
| 32 | A | 27.9 | Very low | 28.4 | Very low | 89 Ų | 89 | 136.8 Ų | 136.8 | 74% | 0.736 | 77% | 0.773 | S | S | * | * | 102 | 116.7 | 129.2 | 0 | 0 | 0 | 0 | 0 | 124 | |||||
| 33 | Q | 27.2 | Very low | 28.4 | Very low | 152 Ų | 152 | 135 Ų | 135 | 71% | 0.71 | 78% | 0.777 | S | S | * | * | trans | 75.3 | 129.4 | 134.5 | -79.2 | -162.3 | 25 | 0 | 0 | 124.2 | ||||
| 34 | K | 26.4 | Very low | 28.4 | Very low | 169 Ų | 169 | 132.1 Ų | 132.1 | 74% | 0.735 | 78% | 0.779 | S | S | * | * | trans | 72.5 | 153.8 | 140 | -74.8 | 177.4 | 177.3 | 147.9 | 0 | 119.4 | ||||
| 35 | V | 26.9 | Very low | 28.3 | Very low | 124 Ų | 124 | 131 Ų | 131 | 75% | 0.752 | 78% | 0.777 | S | S | * | * | cis | 166 | 159.4 | -30.3 | 132.2 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 36 | K | 27.1 | Very low | 27.5 | Very low | 180 Ų | 180 | 132 Ų | 132 | 78% | 0.783 | 78% | 0.776 | S | S | * | * | trans | 84.9 | 126.5 | 173 | -83.1 | -173.9 | 172.7 | -166 | 0 | 115.5 | ||||
| 37 | T | 24.5 | Very low | 27.5 | Very low | 92 Ų | 92 | 135.4 Ų | 135.4 | 56% | 0.564 | 77% | 0.773 | S | S | * | * | 86.5 | 99.5 | 58 | -71.9 | 0 | 0 | 0 | 0 | 108.3 | |||||
| 38 | E | 27.3 | Very low | 27.4 | Very low | 152 Ų | 152 | 134.2 Ų | 134.2 | 71% | 0.71 | 77% | 0.771 | S | S | * | * | 90.8 | 165.3 | 80.9 | -78.2 | 161.5 | 118.9 | 0 | 0 | 110.9 | |||||
| 39 | D | 25.1 | Very low | 27.5 | Very low | 159 Ų | 159 | 136.4 Ų | 136.4 | 85% | 0.85 | 78% | 0.777 | S | S | * | * | trans | 64.9 | 136.9 | -179.9 | -48.2 | -35.1 | 0 | 0 | 0 | 115.8 | ||||
| 40 | G | 29 | Very low | 27.3 | Very low | 74 Ų | 74 | 131.3 Ų | 131.3 | 76% | 0.763 | 77% | 0.77 | S | S | * | * | cis | 124.5 | 102.2 | -3.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 41 | E | 27.4 | Very low | 27.5 | Very low | 209 Ų | 209 | 131.1 Ų | 131.1 | 98% | 0.977 | 77% | 0.769 | S | S | * | * | trans | -152.3 | -179.6 | 174.7 | -130.1 | -179.3 | 162.5 | 0 | 0 | 114.4 | ||||
| 42 | N | 27.9 | Very low | 28.6 | Very low | 149 Ų | 149 | 127.4 Ų | 127.4 | 80% | 0.797 | 76% | 0.762 | S | S | * | * | trans | -135 | 157 | -144.4 | -178.4 | 15.5 | 0 | 0 | 0 | 113.7 | ||||
| 43 | S | 30.6 | Very low | 29.1 | Very low | 117 Ų | 117 | 129.6 Ų | 129.6 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | trans | 147.9 | 159.1 | 149.2 | 58.4 | 0 | 0 | 0 | 0 | 113 | ||||
| 44 | G | 29 | Very low | 30.2 | Very low | 75 Ų | 75 | 129.6 Ų | 129.6 | 77% | 0.773 | 76% | 0.764 | S | S | * | * | trans | -179.1 | -31.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 45 | A | 29.4 | Very low | 31.1 | Very low | 89 Ų | 89 | 131.1 Ų | 131.1 | 74% | 0.736 | 77% | 0.771 | S | S | * | * | trans | 66.9 | 157.5 | 170.4 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 46 | N | 27.6 | Very low | 31.9 | Very low | 137 Ų | 137 | 128.4 Ų | 128.4 | 73% | 0.733 | 77% | 0.767 | S | S | * | * | trans | 74.7 | 143.1 | 162.6 | -63.8 | -49.8 | 0 | 0 | 0 | 118.9 | ||||
| 47 | K | 27 | Very low | 33.1 | Very low | 168 Ų | 168 | 127.7 Ų | 127.7 | 73% | 0.73 | 77% | 0.772 | S | S | * | * | cis | -157.6 | 154.8 | -0.1 | -130.1 | 165.5 | -169 | 176.4 | 0 | 114.1 | ||||
| 48 | T | 24.6 | Very low | 34.3 | Very low | 133 Ų | 133 | 131.3 Ų | 131.3 | 82% | 0.816 | 78% | 0.784 | S | S | * | * | trans | 63.7 | 160.7 | 165.5 | 30 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 49 | S | 27.5 | Very low | 35.2 | Very low | 105 Ų | 105 | 129 Ų | 129 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | cis | -168.2 | 157.5 | -7.3 | 37.1 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 50 | S | 26.2 | Very low | 36.3 | Very low | 117 Ų | 117 | 127 Ų | 127 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | cis | -164.1 | 179.6 | -6.1 | 46.3 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 51 | G | 32.1 | Very low | 37.4 | Very low | 66 Ų | 66 | 130.9 Ų | 130.9 | 68% | 0.68 | 78% | 0.775 | S | S | * | * | trans | -89.8 | -155.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 52 | P | 50.1 | Low | 38.6 | Very low | 120 Ų | 120 | 125.2 Ų | 125.2 | 78% | 0.779 | 76% | 0.758 | S | S | * | * | cis | -138.5 | -177.6 | 16.9 | 43.8 | -25.9 | 0 | 0 | 0 | 117.7 | ||||
| 53 | D | 38.6 | Very low | 39.9 | Very low | 135 Ų | 135 | 123.5 Ų | 123.5 | 72% | 0.722 | 75% | 0.748 | S | S | * | * | trans | 44.8 | 114.5 | 153.7 | -66.9 | 8.1 | 0 | 0 | 0 | 121.5 | ||||
| 54 | I | 51.1 | Low | 41.1 | Very low | 151 Ų | 151 | 122.8 Ų | 122.8 | 77% | 0.774 | 74% | 0.739 | S | S | * | * | 72.5 | 80.4 | 66.9 | -59.4 | 167.8 | 0 | 0 | 0 | 113.5 | |||||
| 55 | K | 43.8 | Very low | 42.3 | Very low | 202 Ų | 202 | 122.2 Ų | 122.2 | 88% | 0.878 | 73% | 0.727 | S | S | * | * | trans | -160.6 | 5.2 | 137.9 | -113.4 | 163.3 | -174.2 | 170.5 | 0 | 116.2 | L57 | K55-L57 VanDerWaalsContact C-N 3.33Å; K55-L57 PolarHBondContact O-N 3.07Å; K55-L57 VanDerWaalsContact O-N 3.07Å | ||
| 56 | G | 44.7 | Very low | 43.5 | Very low | 66 Ų | 66 | 121.7 Ų | 121.7 | 68% | 0.68 | 72% | 0.717 | S | S | * | * | trans | -82.7 | 57 | 179 | 0 | 0 | 0 | 0 | 0 | 115.1 | M58 | G56-M58 VanDerWaalsContact C-N 3.28Å; G56-M58 PolarHBondContact O-N 3.05Å | ||
| 57 | L | 52.8 | Low | 45.1 | Very low | 166 Ų | 166 | 117.3 Ų | 117.3 | 87% | 0.869 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.3 | -1.5 | -160.4 | -161.1 | 61.1 | 0 | 0 | 0 | 117.1 | K55 | K55-L57 VanDerWaalsContact C-N 3.33Å; K55-L57 PolarHBondContact O-N 3.07Å; K55-L57 VanDerWaalsContact O-N 3.07Å |
| 58 | M | 48.2 | Very low | 46.6 | Very low | 168 Ų | 168 | 113.7 Ų | 113.7 | 83% | 0.828 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.3 | -1 | -165 | -79.6 | -71.8 | -78.2 | 0 | 0 | 117.5 | G56 | G56-M58 VanDerWaalsContact C-N 3.28Å; G56-M58 PolarHBondContact O-N 3.05Å |
| 59 | C | 47.5 | Very low | 48.2 | Very low | 104 Ų | 104 | 113.1 Ų | 113.1 | 70% | 0.703 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -120.8 | -12.5 | -173.9 | -64.6 | 0 | 0 | 0 | 0 | 116.7 | S62 | C59-S62 PolarHBondContact O-OG 3.21Š|
| 60 | L | 48.3 | Very low | 49.8 | Very low | 117 Ų | 117 | 111.9 Ų | 111.9 | 61% | 0.613 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | -10.8 | -173 | -81.6 | 165.4 | 0 | 0 | 0 | 115.4 | S62 L63 V64 | L60-S62 PolarHBondContact O-N 3.5Å; L60-L63 HydrophobicContact CD2-CB 4.35Å; L60-L63 HydrophobicContact CD2-CD1 4.03Å; L60-L63 PolarHBondContact O-N 3.1Å; L60-L63 VanDerWaalsContact O-N 3.1Å; L60-V64 PolarHBondContact O-N 3.22Å |
| 61 | L | 51 | Low | 51 | Low | 155 Ų | 155 | 115.5 Ų | 115.5 | 81% | 0.812 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -64.2 | -21.6 | 179.9 | -79.4 | 163.9 | 0 | 0 | 0 | 113.8 | ||
| 62 | S | 53.2 | Low | 52.4 | Low | 90 Ų | 90 | 115.8 Ų | 115.8 | 63% | 0.629 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -78.5 | -27.2 | 173.8 | 55.8 | 0 | 0 | 0 | 0 | 113.6 | C59 L60 | C59-S62 PolarHBondContact O-OG 3.21Å; L60-S62 PolarHBondContact O-N 3.5Å |
| 63 | L | 53.8 | Low | 52.9 | Low | 112 Ų | 112 | 114.9 Ų | 114.9 | 59% | 0.586 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -81.5 | -34.8 | -174.8 | -114.6 | 161 | 0 | 0 | 0 | 112.4 | L60 A65 C66 G67 | L60-L63 HydrophobicContact CD2-CB 4.35Å; L60-L63 HydrophobicContact CD2-CD1 4.03Å; L60-L63 PolarHBondContact O-N 3.1Å; L60-L63 VanDerWaalsContact O-N 3.1Å; L63-A65 VanDerWaalsContact C-N 3.33Å; L63-A65 PolarHBondContact O-N 3.21Å; L63-C66 WeakPolarHBondContact O-CB 3.36Å; L63-C66 PolarHBondContact O-N 3.12Å; L63-C66 VanDerWaalsContact O-N 3.12Å; L63-G67 PolarHBondContact O-N 3.4Å |
| 64 | V | 56 | Low | 53.9 | Low | 102 Ų | 102 | 114.4 Ų | 114.4 | 62% | 0.618 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -63.6 | -38.5 | 176.6 | -179.8 | 0 | 0 | 0 | 0 | 111.5 | L60 C66 G67 V68 | L60-V64 PolarHBondContact O-N 3.22Å; V64-C66 PolarHBondContact O-N 3.45Å; V64-G67 PolarHBondContact O-N 3.34Å; V64-V68 PolarHBondContact O-N 3.29Å |
| 65 | A | 54.1 | Low | 54.1 | Low | 63 Ų | 63 | 113 Ų | 113 | 52% | 0.521 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -62.3 | -29.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L63 | L63-A65 VanDerWaalsContact C-N 3.33Å; L63-A65 PolarHBondContact O-N 3.21Å |
| 66 | C | 56.4 | Low | 54.6 | Low | 79 Ų | 79 | 109.8 Ų | 109.8 | 53% | 0.534 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -74.5 | -37.5 | 176.3 | -157.8 | 0 | 0 | 0 | 0 | 111.9 | L63 V64 V68 L69 | L63-C66 WeakPolarHBondContact O-CB 3.36Å; L63-C66 PolarHBondContact O-N 3.12Å; L63-C66 VanDerWaalsContact O-N 3.12Å; V64-C66 PolarHBondContact O-N 3.45Å; C66-V68 PolarHBondContact O-N 3.38Å; C66-L69 PolarHBondContact O-N 3.31Å |
| 67 | G | 60.3 | Low | 55.3 | Low | 44 Ų | 44 | 112.5 Ų | 112.5 | 45% | 0.454 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -64.9 | -37.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | L63 V64 L69 S70 | L63-G67 PolarHBondContact O-N 3.4Å; V64-G67 PolarHBondContact O-N 3.34Å; G67-L69 VanDerWaalsContact C-N 3.32Å; G67-L69 PolarHBondContact O-N 3.49Å; G67-S70 PolarHBondContact O-N 3.4Å |
| 68 | V | 59.2 | Low | 55.5 | Low | 92 Ų | 92 | 112 Ų | 112 | 56% | 0.558 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -63.6 | -37.2 | -179.8 | 177.3 | 0 | 0 | 0 | 0 | 111.9 | V64 C66 S70 W71 V72 | V64-V68 PolarHBondContact O-N 3.29Å; C66-V68 PolarHBondContact O-N 3.38Å; V68-S70 PolarHBondContact O-N 3.46Å; V68-W71 PolarHBondContact O-N 3.49Å; V68-V72 PolarHBondContact O-N 3.22Å |
| 69 | L | 58.5 | Low | 56.1 | Low | 122 Ų | 122 | 113.4 Ų | 113.4 | 64% | 0.639 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -66.8 | -36.2 | 179.6 | -73 | 167.4 | 0 | 0 | 0 | 112.4 | C66 G67 W71 V72 V73 | C66-L69 PolarHBondContact O-N 3.31Å; G67-L69 VanDerWaalsContact C-N 3.32Å; G67-L69 PolarHBondContact O-N 3.49Å; L69-W71 VanDerWaalsContact C-N 3.3Å; L69-W71 PolarHBondContact O-N 3.49Å; L69-V72 PolarHBondContact O-N 3.33Å; L69-V73 PolarHBondContact O-N 3.28Å |
| 70 | S | 60.5 | Low | 56.7 | Low | 79 Ų | 79 | 116 Ų | 116 | 55% | 0.552 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -65.6 | -29.8 | 176.7 | -60.4 | 0 | 0 | 0 | 0 | 113.6 | G67 V68 | G67-S70 PolarHBondContact O-N 3.4Å; V68-S70 PolarHBondContact O-N 3.46Å |
| 71 | W | 51.9 | Low | 57.2 | Low | 192 Ų | 192 | 113.7 Ų | 113.7 | 73% | 0.727 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -71.6 | -41 | 177.7 | -170.6 | -94 | 0 | 0 | 0 | 112.4 | V68 L69 V73 L74 Q75 | V68-W71 PolarHBondContact O-N 3.49Å; L69-W71 VanDerWaalsContact C-N 3.3Å; L69-W71 PolarHBondContact O-N 3.49Å; W71-V73 VanDerWaalsContact C-N 3.32Å; W71-V73 PolarHBondContact O-N 3.2Å; W71-L74 PolarHBondContact O-N 3.31Å; W71-Q75 PolarHBondContact O-N 3.42Å |
| 72 | V | 60.7 | Low | 57.8 | Low | 73 Ų | 73 | 111 Ų | 111 | 44% | 0.442 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -64.7 | -35.3 | -179.5 | 177.5 | 0 | 0 | 0 | 0 | 111.9 | V68 L69 Q75 Q76 | V68-V72 PolarHBondContact O-N 3.22Å; L69-V72 PolarHBondContact O-N 3.33Å; V72-Q75 PolarHBondContact O-N 3.37Å; V72-Q76 PolarHBondContact O-N 3.32Å |
| 73 | V | 61.4 | Low | 58.3 | Low | 101 Ų | 101 | 113.1 Ų | 113.1 | 61% | 0.612 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -65.8 | -42.1 | 177.3 | 175.1 | 0 | 0 | 0 | 0 | 111.6 | L69 W71 Q75 Q76 | L69-V73 PolarHBondContact O-N 3.28Å; W71-V73 VanDerWaalsContact C-N 3.32Å; W71-V73 PolarHBondContact O-N 3.2Å; V73-Q75 VanDerWaalsContact C-N 3.31Å; V73-Q75 PolarHBondContact O-N 3.25Å; V73-Q76 PolarHBondContact O-N 3.45Å |
| 74 | L | 58.8 | Low | 58.9 | Low | 125 Ų | 125 | 112.7 Ų | 112.7 | 65% | 0.654 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -60.8 | -40.7 | 175.4 | -93.5 | 161.2 | 0 | 0 | 0 | 111.9 | W71 Q76 N77 | W71-L74 PolarHBondContact O-N 3.31Å; L74-Q76 PolarHBondContact O-N 3.4Å; L74-N77 PolarHBondContact O-N 3.44Å |
| 75 | Q | 54.7 | Low | 59.5 | Low | 121 Ų | 121 | 111.7 Ų | 111.7 | 57% | 0.565 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -69.2 | -16.8 | 179.1 | -160.9 | 174.3 | 17.4 | 0 | 0 | 114 | W71 V72 V73 | W71-Q75 PolarHBondContact O-N 3.42Å; V72-Q75 PolarHBondContact O-N 3.37Å; V73-Q75 VanDerWaalsContact C-N 3.31Å; V73-Q75 PolarHBondContact O-N 3.25Å |
| 76 | Q | 55.6 | Low | 60.2 | Low | 135 Ų | 135 | 114.9 Ų | 114.9 | 63% | 0.631 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -80.1 | -28.3 | 172.6 | -73.5 | -167.3 | -13.7 | 0 | 0 | 113.4 | V72 V73 L74 R79 | V72-Q76 PolarHBondContact O-N 3.32Å; V73-Q76 PolarHBondContact O-N 3.45Å; L74-Q76 PolarHBondContact O-N 3.4Å; Q76-R79 PolarHBondContact O-N 3.08Å |
| 77 | N | 57.5 | Low | 60.7 | Low | 123 Ų | 123 | 119.6 Ų | 119.6 | 66% | 0.658 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -66.8 | -45.5 | -175.7 | -165.3 | 43.2 | 0 | 0 | 0 | 112 | L74 R79 F80 | L74-N77 PolarHBondContact O-N 3.44Å; N77-R79 VanDerWaalsContact C-N 3.31Å; N77-R79 PolarHBondContact O-N 3.09Å; N77-F80 WeakPolarHBondContact O-CB 3.47Å; N77-F80 PolarHBondContact O-N 3.06Å; N77-F80 VanDerWaalsContact O-N 3.08Å |
| 78 | E | 58.5 | Low | 61.2 | Low | 156 Ų | 156 | 122.9 Ų | 122.9 | 73% | 0.729 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -64.5 | -33.1 | -179.3 | -165 | 170.6 | -115.1 | 0 | 0 | 112.8 | F80 | E78-F80 PolarHBondContact O-N 3.38Å |
| 79 | R | 59.4 | Low | 61.8 | Low | 196 Ų | 196 | 121.1 Ų | 121.1 | 74% | 0.74 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -63.5 | -27 | 173.6 | -72.6 | -72.2 | -156.7 | 159.9 | 6.2 | 113.3 | Q76 N77 | Q76-R79 PolarHBondContact O-N 3.08Å; N77-R79 VanDerWaalsContact C-N 3.31Å; N77-R79 PolarHBondContact O-N 3.09Å |
| 80 | F | 60.5 | Low | 62.2 | Low | 158 Ų | 158 | 120.9 Ų | 120.9 | 69% | 0.693 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -81.4 | -43.3 | -172.9 | -136.9 | -89.2 | 0 | 0 | 0 | 112.2 | N77 E78 L82 M83 E84 | N77-F80 WeakPolarHBondContact O-CB 3.47Å; N77-F80 PolarHBondContact O-N 3.06Å; N77-F80 VanDerWaalsContact O-N 3.08Å; E78-F80 PolarHBondContact O-N 3.38Å; F80-L82 VanDerWaalsContact C-N 3.33Å; F80-L82 PolarHBondContact O-N 3.49Å; F80-M83 WeakPolarHBondContact O-CB 3.33Å; F80-M83 PolarHBondContact O-N 2.64Å; F80-E84 PolarHBondContact O-N 2.89Å |
| 81 | S | 60.4 | Low | 62.6 | Low | 69 Ų | 69 | 123.6 Ų | 123.6 | 48% | 0.483 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -56.3 | -47.4 | 176.3 | -163.4 | 0 | 0 | 0 | 0 | 111.6 | M83 E84 D85 | S81-M83 PolarHBondContact O-N 3.32Å; S81-M83 VanDerWaalsContact O-N 3.09Å; S81-E84 PolarHBondContact O-N 3.08Å; S81-E84 VanDerWaalsContact O-N 3.08Å; S81-D85 PolarHBondContact O-N 3.37Å |
| 82 | L | 63.2 | Low | 63.6 | Low | 100 Ų | 100 | 116.5 Ų | 116.5 | 52% | 0.524 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -68.8 | -6.7 | 179.3 | -168.3 | 125 | 0 | 0 | 0 | 113.9 | F80 K86 | F80-L82 VanDerWaalsContact C-N 3.33Å; F80-L82 PolarHBondContact O-N 3.49Å; L82-K86 VanDerWaalsContact O-CD 3.22Å; L82-K86 WeakPolarHBondContact O-CD 3.22Å; L82-K86 WeakPolarHBondContact O-CE 3.22Å; L82-K86 WeakPolarHBondContact O-CG 3.47Å |
| 83 | M | 62.6 | Low | 64.3 | Low | 133 Ų | 133 | 119.5 Ų | 119.5 | 66% | 0.655 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -96.3 | -37.9 | 169.1 | -170.1 | 137.8 | -71.6 | 0 | 0 | 111.8 | F80 S81 K86 Y87 | F80-M83 WeakPolarHBondContact O-CB 3.33Å; F80-M83 PolarHBondContact O-N 2.64Å; S81-M83 PolarHBondContact O-N 3.32Å; S81-M83 VanDerWaalsContact O-N 3.09Å; M83-K86 PolarHBondContact O-N 2.96Å; M83-Y87 PolarHBondContact O-N 3.48Å |
| 84 | E | 67.5 | Low | 64.8 | Low | 103 Ų | 103 | 118 Ų | 118 | 48% | 0.481 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -61.6 | -47.3 | 175.3 | -165.2 | -174.2 | 144.6 | 0 | 0 | 111.7 | F80 S81 K86 Y87 K88 | F80-E84 PolarHBondContact O-N 2.89Å; S81-E84 PolarHBondContact O-N 3.08Å; S81-E84 VanDerWaalsContact O-N 3.08Å; E84-K86 VanDerWaalsContact C-N 3.29Å; E84-K86 PolarHBondContact O-N 3.07Å; E84-Y87 WeakPolarHBondContact O-CB 3.07Å; E84-Y87 PolarHBondContact O-N 3.37Å; E84-K88 PolarHBondContact O-N 3.37Å; E84-K88 WeakPolarHBondContact OE1-CE 3.45Å; E84-K88 IonicContact OE1-NZ 3.74Å; E84-K88 PolarHBondContact OE1-NZ 3.03Å |
| 85 | D | 68.9 | Low | 65.5 | Low | 82 Ų | 82 | 115.7 Ų | 115.7 | 44% | 0.439 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -66.6 | -31.9 | 179.4 | -67.8 | -39.3 | 0 | 0 | 0 | 112.5 | S81 Y87 K88 A89 | S81-D85 PolarHBondContact O-N 3.37Å; D85-Y87 VanDerWaalsContact C-N 3.35Å; D85-K88 IonicContact OD1-NZ 2.6Å; D85-A89 WeakPolarHBondContact O-CB 3.44Å; D85-A89 PolarHBondContact O-N 3.05Å |
| 86 | K | 68.1 | Low | 66.5 | Low | 129 Ų | 129 | 112.8 Ų | 112.8 | 56% | 0.561 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -68.1 | -34.5 | 171.9 | -74.1 | 177.6 | -172.3 | 167.5 | 0 | 112.2 | L82 M83 E84 L90 | L82-K86 VanDerWaalsContact O-CD 3.22Å; L82-K86 WeakPolarHBondContact O-CD 3.22Å; L82-K86 WeakPolarHBondContact O-CE 3.22Å; L82-K86 WeakPolarHBondContact O-CG 3.47Å; M83-K86 PolarHBondContact O-N 2.96Å; E84-K86 VanDerWaalsContact C-N 3.29Å; E84-K86 PolarHBondContact O-N 3.07Å; K86-L90 WeakPolarHBondContact O-CB 3.43Å; K86-L90 PolarHBondContact O-N 3.36Å |
| 87 | Y | 67.4 | Low | 67.5 | Low | 178 Ų | 178 | 111.1 Ų | 111.1 | 70% | 0.698 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -69.5 | -45.4 | 175.5 | -155.1 | -89.4 | 0 | 0 | 0 | 111.3 | M83 E84 D85 A89 L90 H91 | M83-Y87 PolarHBondContact O-N 3.48Å; E84-Y87 WeakPolarHBondContact O-CB 3.07Å; E84-Y87 PolarHBondContact O-N 3.37Å; D85-Y87 VanDerWaalsContact C-N 3.35Å; Y87-A89 PolarHBondContact O-N 3Å; Y87-L90 PolarHBondContact O-N 3.06Å; Y87-H91 PolarHBondContact O-N 3.39Å |
| 88 | K | 70.2 | Confident | 68.4 | Low | 113 Ų | 113 | 110.2 Ų | 110.2 | 49% | 0.491 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -58.1 | -46.7 | 173.1 | -68.7 | 171 | -174 | 158.1 | 0 | 111.9 | E84 D85 L90 H91 G92 | E84-K88 PolarHBondContact O-N 3.37Å; E84-K88 WeakPolarHBondContact OE1-CE 3.45Å; E84-K88 IonicContact OE1-NZ 3.74Å; E84-K88 PolarHBondContact OE1-NZ 3.03Å; D85-K88 IonicContact OD1-NZ 2.6Å; K88-L90 VanDerWaalsContact C-N 3.27Å; K88-L90 PolarHBondContact O-N 3.05Å; K88-H91 PolarHBondContact O-N 2.92Å; K88-G92 PolarHBondContact O-N 3.46Å |
| 89 | A | 72.3 | Confident | 69.5 | Low | 56 Ų | 56 | 109.1 Ų | 109.1 | 46% | 0.463 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -66.9 | -24.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | D85 Y87 K93 | D85-A89 WeakPolarHBondContact O-CB 3.44Å; D85-A89 PolarHBondContact O-N 3.05Å; Y87-A89 PolarHBondContact O-N 3Å; A89-K93 WeakPolarHBondContact O-CG 3.39Å |
| 90 | L | 65.9 | Low | 70.4 | Confident | 117 Ų | 117 | 105 Ų | 105 | 61% | 0.613 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -78.9 | -45.9 | 172.4 | -149.6 | 75.5 | 0 | 0 | 0 | 111 | K86 Y87 K88 G92 K93 T94 | K86-L90 WeakPolarHBondContact O-CB 3.43Å; K86-L90 PolarHBondContact O-N 3.36Å; Y87-L90 PolarHBondContact O-N 3.06Å; K88-L90 VanDerWaalsContact C-N 3.27Å; K88-L90 PolarHBondContact O-N 3.05Å; L90-G92 PolarHBondContact O-N 3.31Å; L90-K93 WeakPolarHBondContact O-CA 3.42Å; L90-K93 WeakPolarHBondContact O-CB 3.5Å; L90-K93 PolarHBondContact O-N 3.19Å; L90-T94 PolarHBondContact O-N 3.21Å; L90-T94 PolarHBondContact O-OG1 3.06Å |
| 91 | H | 69.3 | Low | 71.3 | Confident | 136 Ų | 136 | 103.1 Ų | 103.1 | 63% | 0.63 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64 | -39.7 | 179.7 | -165.5 | 46.3 | 0 | 0 | 0 | 112.3 | Y87 K88 K93 T94 S95 | Y87-H91 PolarHBondContact O-N 3.39Å; K88-H91 PolarHBondContact O-N 2.92Å; H91-K93 VanDerWaalsContact C-N 3.27Å; H91-K93 PolarHBondContact O-N 3.06Å; H91-T94 WeakPolarHBondContact O-CB 3.29Å; H91-T94 PolarHBondContact O-N 3.31Å; H91-T94 VanDerWaalsContact O-N 3.17Å; H91-S95 PolarHBondContact O-N 3.26Å |
| 92 | G | 73.3 | Confident | 72.3 | Confident | 43 Ų | 43 | 106.5 Ų | 106.5 | 44% | 0.443 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.9 | -33.2 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | K88 L90 S95 S96 | K88-G92 PolarHBondContact O-N 3.46Å; L90-G92 PolarHBondContact O-N 3.31Å; G92-S95 WeakPolarHBondContact O-CB 3.49Å; G92-S95 PolarHBondContact O-N 2.93Å; G92-S96 PolarHBondContact O-N 3.34Å |
| 93 | K | 74.5 | Confident | 73.4 | Confident | 135 Ų | 135 | 105.6 Ų | 105.6 | 59% | 0.587 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -71.9 | -38.3 | 173.1 | -76.8 | 173 | -178.9 | 169.3 | 0 | 112.5 | A89 L90 H91 S95 S96 L97 | A89-K93 WeakPolarHBondContact O-CG 3.39Å; L90-K93 WeakPolarHBondContact O-CA 3.42Å; L90-K93 WeakPolarHBondContact O-CB 3.5Å; L90-K93 PolarHBondContact O-N 3.19Å; H91-K93 VanDerWaalsContact C-N 3.27Å; H91-K93 PolarHBondContact O-N 3.06Å; K93-S95 VanDerWaalsContact C-N 3.28Å; K93-S95 PolarHBondContact O-N 2.95Å; K93-S96 WeakPolarHBondContact CA-OG 3.41Å; K93-S96 PolarHBondContact O-N 2.93Å; K93-S96 PolarHBondContact O-OG 3.17Å; K93-L97 WeakPolarHBondContact O-CG 3.43Å; K93-L97 PolarHBondContact O-N 3Å |
| 94 | T | 73 | Confident | 74.1 | Confident | 71 Ų | 71 | 105.3 Ų | 105.3 | 44% | 0.436 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -59.7 | -40.5 | 170.4 | -51.8 | 0 | 0 | 0 | 0 | 111.3 | L90 H91 L97 L98 | L90-T94 PolarHBondContact O-N 3.21Å; L90-T94 PolarHBondContact O-OG1 3.06Å; H91-T94 WeakPolarHBondContact O-CB 3.29Å; H91-T94 PolarHBondContact O-N 3.31Å; H91-T94 VanDerWaalsContact O-N 3.17Å; T94-L97 PolarHBondContact O-N 3.3Å; T94-L98 PolarHBondContact O-N 2.97Å |
| 95 | S | 72.9 | Confident | 74.8 | Confident | 75 Ų | 75 | 103.6 Ų | 103.6 | 52% | 0.524 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -58.9 | -49.1 | 172.7 | -165.2 | 0 | 0 | 0 | 0 | 111.9 | H91 G92 K93 L97 L98 E99 | H91-S95 PolarHBondContact O-N 3.26Å; G92-S95 WeakPolarHBondContact O-CB 3.49Å; G92-S95 PolarHBondContact O-N 2.93Å; K93-S95 VanDerWaalsContact C-N 3.28Å; K93-S95 PolarHBondContact O-N 2.95Å; S95-L97 VanDerWaalsContact C-N 3.25Å; S95-L97 PolarHBondContact O-N 2.8Å; S95-L98 PolarHBondContact O-N 3.24Å; S95-E99 PolarHBondContact O-N 3.46Å |
| 96 | S | 75.1 | Confident | 75.6 | Confident | 60 Ų | 60 | 104.2 Ų | 104.2 | 42% | 0.42 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.1 | -24.9 | 178.3 | 64.9 | 0 | 0 | 0 | 0 | 113.9 | G92 K93 M100 | G92-S96 PolarHBondContact O-N 3.34Å; K93-S96 WeakPolarHBondContact CA-OG 3.41Å; K93-S96 PolarHBondContact O-N 2.93Å; K93-S96 PolarHBondContact O-OG 3.17Å; S96-M100 VanDerWaalsContact O-CB 3.29Å; S96-M100 WeakPolarHBondContact O-CB 3.42Å; S96-M100 PolarHBondContact O-N 3.04Å |
| 97 | L | 76.2 | Confident | 76.4 | Confident | 101 Ų | 101 | 102.1 Ų | 102.1 | 53% | 0.529 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -75.5 | -38.5 | 173.4 | -77.6 | 172.3 | 0 | 0 | 0 | 112 | K93 T94 S95 M100 E101 | K93-L97 WeakPolarHBondContact O-CG 3.43Å; K93-L97 PolarHBondContact O-N 3Å; T94-L97 PolarHBondContact O-N 3.3Å; S95-L97 VanDerWaalsContact C-N 3.25Å; S95-L97 PolarHBondContact O-N 2.8Å; L97-M100 HydrophobicContact CD2-CE 3.75Å; L97-M100 PolarHBondContact O-N 2.87Å; L97-E101 WeakPolarHBondContact O-CB 3.26Å; L97-E101 PolarHBondContact O-N 2.83Å |
| 98 | L | 78.1 | Confident | 77.2 | Confident | 104 Ų | 104 | 96.3 Ų | 96.3 | 55% | 0.545 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.3 | -39.1 | 173.2 | -79.2 | 166.2 | 0 | 0 | 0 | 112 | T94 S95 M100 E101 E102 | T94-L98 PolarHBondContact O-N 2.97Å; S95-L98 PolarHBondContact O-N 3.24Å; L98-M100 VanDerWaalsContact C-N 3.34Å; L98-E101 PolarHBondContact O-N 2.64Å; L98-E102 PolarHBondContact O-N 2.94Å |
| 99 | E | 79.9 | Confident | 78 | Confident | 133 Ų | 133 | 96.8 Ų | 96.8 | 62% | 0.621 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.5 | -40.3 | 173.1 | -173.6 | 176.8 | -169.9 | 0 | 0 | 111.5 | S95 E102 E103 | S95-E99 PolarHBondContact O-N 3.46Å; E99-E102 PolarHBondContact O-N 3.43Å; E99-E103 PolarHBondContact O-N 3.07Å |
| 100 | M | 80 | Confident | 78.7 | Confident | 108 Ų | 108 | 100 Ų | 100 | 53% | 0.532 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.3 | -32.8 | 173.1 | -170.5 | -174.2 | 75.1 | 0 | 0 | 112.6 | S96 L97 L98 M104 | S96-M100 VanDerWaalsContact O-CB 3.29Å; S96-M100 WeakPolarHBondContact O-CB 3.42Å; S96-M100 PolarHBondContact O-N 3.04Å; L97-M100 HydrophobicContact CD2-CE 3.75Å; L97-M100 PolarHBondContact O-N 2.87Å; L98-M100 VanDerWaalsContact C-N 3.34Å; M100-M104 VanDerWaalsContact O-CB 3.23Å; M100-M104 WeakPolarHBondContact O-CB 3.44Å; M100-M104 PolarHBondContact O-N 3.23Å |
| 101 | E | 79.4 | Confident | 79.5 | Confident | 119 Ų | 119 | 98.2 Ų | 98.2 | 56% | 0.556 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -68.2 | -42.9 | 173.1 | -174 | 176.4 | 179.2 | 0 | 0 | 111 | L97 L98 M104 V105 | L97-E101 WeakPolarHBondContact O-CB 3.26Å; L97-E101 PolarHBondContact O-N 2.83Å; L98-E101 PolarHBondContact O-N 2.64Å; E101-M104 PolarHBondContact O-N 2.84Å; E101-V105 WeakPolarHBondContact O-CG2 3.24Å; E101-V105 PolarHBondContact O-N 3.33Å |
| 102 | E | 81.3 | Confident | 80.3 | Confident | 140 Ų | 140 | 96 Ų | 96 | 65% | 0.654 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.2 | -45 | 174.6 | -173 | 174 | 178.3 | 0 | 0 | 111.6 | L98 E99 M104 V105 K106 | L98-E102 PolarHBondContact O-N 2.94Å; E99-E102 PolarHBondContact O-N 3.43Å; E102-M104 VanDerWaalsContact C-N 3.32Å; E102-M104 PolarHBondContact O-N 2.84Å; E102-V105 PolarHBondContact O-N 3.38Å; E102-K106 WeakPolarHBondContact O-CB 3.27Å; E102-K106 PolarHBondContact O-N 3.29Å |
| 103 | E | 84.9 | Confident | 80.8 | Confident | 82 Ų | 82 | 96.7 Ų | 96.7 | 38% | 0.383 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.2 | -34.3 | 172.1 | -80.7 | -63.3 | 160.5 | 0 | 0 | 112.3 | E99 K106 V107 | E99-E103 PolarHBondContact O-N 3.07Å; E103-K106 PolarHBondContact O-N 3.46Å; E103-K106 VanDerWaalsContact OE1-CE 3.26Å; E103-K106 WeakPolarHBondContact OE1-CE 3.48Å; E103-K106 IonicContact OE1-NZ 2.64Å; E103-K106 PolarHBondContact OE1-NZ 2.78Å; E103-K106 WeakPolarHBondContact OE2-CD 3.23Å; E103-K106 IonicContact OE2-NZ 2.64Å; E103-V107 VanDerWaalsContact O-CB 3.3Å; E103-V107 WeakPolarHBondContact O-CB 3.49Å; E103-V107 VanDerWaalsContact O-CG2 3.24Å; E103-V107 WeakPolarHBondContact O-CG2 3.33Å; E103-V107 PolarHBondContact O-N 2.78Å |
| 104 | M | 77.2 | Confident | 81.4 | Confident | 127 Ų | 127 | 94.5 Ų | 94.5 | 63% | 0.626 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.2 | -42.6 | 173.3 | -175.3 | 177.3 | -69.7 | 0 | 0 | 111.6 | M100 E101 E102 K106 V107 S108 | M100-M104 VanDerWaalsContact O-CB 3.23Å; M100-M104 WeakPolarHBondContact O-CB 3.44Å; M100-M104 PolarHBondContact O-N 3.23Å; E101-M104 PolarHBondContact O-N 2.84Å; E102-M104 VanDerWaalsContact C-N 3.32Å; E102-M104 PolarHBondContact O-N 2.84Å; M104-K106 VanDerWaalsContact C-N 3.34Å; M104-V107 PolarHBondContact O-N 3.42Å; M104-S108 WeakPolarHBondContact O-CB 3.4Å; M104-S108 PolarHBondContact O-N 2.85Å |
| 105 | V | 82.7 | Confident | 82.1 | Confident | 66 Ų | 66 | 96 Ų | 96 | 40% | 0.4 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.5 | -37 | 174.4 | 168.6 | 0 | 0 | 0 | 0 | 111.4 | E101 E102 S108 K109 | E101-V105 WeakPolarHBondContact O-CG2 3.24Å; E101-V105 PolarHBondContact O-N 3.33Å; E102-V105 PolarHBondContact O-N 3.38Å; V105-S108 WeakPolarHBondContact O-CB 3.3Å; V105-S108 PolarHBondContact O-N 3.21Å; V105-K109 HydrophobicContact CG1-CD 4.18Å; V105-K109 WeakPolarHBondContact O-CB 3.38Å; V105-K109 WeakPolarHBondContact O-CG 3.31Å; V105-K109 PolarHBondContact O-N 3.28Å |
| 106 | K | 85.4 | Confident | 82.7 | Confident | 95 Ų | 95 | 98.4 Ų | 98.4 | 41% | 0.413 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -71.2 | -36.8 | 177.1 | -177.4 | 169.8 | 166.4 | -172.1 | 0 | 112 | E102 E103 M104 K110 | E102-K106 WeakPolarHBondContact O-CB 3.27Å; E102-K106 PolarHBondContact O-N 3.29Å; E103-K106 PolarHBondContact O-N 3.46Å; E103-K106 VanDerWaalsContact OE1-CE 3.26Å; E103-K106 WeakPolarHBondContact OE1-CE 3.48Å; E103-K106 IonicContact OE1-NZ 2.64Å; E103-K106 PolarHBondContact OE1-NZ 2.78Å; E103-K106 WeakPolarHBondContact OE2-CD 3.23Å; E103-K106 IonicContact OE2-NZ 2.64Å; M104-K106 VanDerWaalsContact C-N 3.34Å; K106-K110 WeakPolarHBondContact O-CB 3.48Å; K106-K110 VanDerWaalsContact O-CG 3.27Å; K106-K110 WeakPolarHBondContact O-CG 3.39Å; K106-K110 PolarHBondContact O-N 3.38Å; K106-K110 VanDerWaalsContact O-N 3.07Å |
| 107 | V | 85.8 | Confident | 83.2 | Confident | 85 Ų | 85 | 100.7 Ų | 100.7 | 52% | 0.515 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -69.1 | -39.9 | 169 | 168.7 | 0 | 0 | 0 | 0 | 110.8 | E103 M104 K110 C111 | E103-V107 VanDerWaalsContact O-CB 3.3Å; E103-V107 WeakPolarHBondContact O-CB 3.49Å; E103-V107 VanDerWaalsContact O-CG2 3.24Å; E103-V107 WeakPolarHBondContact O-CG2 3.33Å; E103-V107 PolarHBondContact O-N 2.78Å; M104-V107 PolarHBondContact O-N 3.42Å; V107-K110 WeakPolarHBondContact O-CB 3.34Å; V107-K110 PolarHBondContact O-N 2.82Å; V107-C111 WeakPolarHBondContact O-CB 3.16Å; V107-C111 PolarHBondContact O-N 2.76Å |
| 108 | S | 84.6 | Confident | 83.6 | Confident | 57 Ų | 57 | 101.1 Ų | 101.1 | 40% | 0.399 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.8 | -51.5 | 173.8 | -168.6 | 0 | 0 | 0 | 0 | 111.3 | M104 V105 K110 C111 E112 | M104-S108 WeakPolarHBondContact O-CB 3.4Å; M104-S108 PolarHBondContact O-N 2.85Å; V105-S108 WeakPolarHBondContact O-CB 3.3Å; V105-S108 PolarHBondContact O-N 3.21Å; S108-K110 VanDerWaalsContact C-N 3.28Å; S108-K110 PolarHBondContact O-N 3.35Å; S108-C111 CarbonylContact O-C 3.56Å; S108-C111 WeakPolarHBondContact O-CA 3.31Å; S108-C111 WeakPolarHBondContact O-CB 3.25Å; S108-C111 PolarHBondContact O-N 2.74Å; S108-E112 WeakPolarHBondContact O-CG 3.39Å; S108-E112 PolarHBondContact O-N 3.24Å; S108-E112 PolarHBondContact OG-OE1 3.29Å |
| 109 | K | 85.8 | Confident | 84 | Confident | 123 Ų | 123 | 101 Ų | 101 | 54% | 0.535 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.2 | -34.6 | 176.3 | -73.5 | 170.1 | -179.8 | 172.2 | 0 | 113.1 | V105 T113 | V105-K109 HydrophobicContact CG1-CD 4.18Å; V105-K109 WeakPolarHBondContact O-CB 3.38Å; V105-K109 WeakPolarHBondContact O-CG 3.31Å; V105-K109 PolarHBondContact O-N 3.28Å; K109-T113 VanDerWaalsContact O-CB 3.31Å; K109-T113 WeakPolarHBondContact O-CB 3.4Å; K109-T113 PolarHBondContact O-N 2.7Å; K109-T113 VanDerWaalsContact O-N 3.15Å; K109-T113 PolarHBondContact O-OG1 3.15Å |
| 110 | K | 87.1 | Confident | 84.2 | Confident | 123 Ų | 123 | 98.8 Ų | 98.8 | 54% | 0.535 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67 | -44.1 | 170 | -76 | 169 | -178.8 | 172.9 | 0 | 111.2 | K106 V107 S108 T113 V114 | K106-K110 WeakPolarHBondContact O-CB 3.48Å; K106-K110 VanDerWaalsContact O-CG 3.27Å; K106-K110 WeakPolarHBondContact O-CG 3.39Å; K106-K110 PolarHBondContact O-N 3.38Å; K106-K110 VanDerWaalsContact O-N 3.07Å; V107-K110 WeakPolarHBondContact O-CB 3.34Å; V107-K110 PolarHBondContact O-N 2.82Å; S108-K110 VanDerWaalsContact C-N 3.28Å; S108-K110 PolarHBondContact O-N 3.35Å; K110-T113 PolarHBondContact O-N 2.82Å; K110-T113 VanDerWaalsContact O-N 3.17Å; K110-V114 WeakPolarHBondContact O-CG2 3.33Å; K110-V114 PolarHBondContact O-N 2.96Å |
| 111 | C | 82.1 | Confident | 84.4 | Confident | 80 Ų | 80 | 98.6 Ų | 98.6 | 54% | 0.541 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.6 | -49 | 178.8 | -159.3 | 0 | 0 | 0 | 0 | 111.3 | V107 S108 T113 V114 Q115 | V107-C111 WeakPolarHBondContact O-CB 3.16Å; V107-C111 PolarHBondContact O-N 2.76Å; S108-C111 CarbonylContact O-C 3.56Å; S108-C111 WeakPolarHBondContact O-CA 3.31Å; S108-C111 WeakPolarHBondContact O-CB 3.25Å; S108-C111 PolarHBondContact O-N 2.74Å; C111-T113 PolarHBondContact O-N 3.24Å; C111-V114 CarbonylContact O-C 3.6Å; C111-V114 PolarHBondContact O-N 2.89Å; C111-Q115 VanDerWaalsContact O-CB 3.25Å; C111-Q115 WeakPolarHBondContact O-CB 3.33Å; C111-Q115 PolarHBondContact O-N 2.98Å |
| 112 | E | 86.3 | Confident | 84.6 | Confident | 89 Ų | 89 | 97.4 Ų | 97.4 | 42% | 0.416 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -55.5 | -35.2 | 171.4 | -70 | 164.9 | -151.6 | 0 | 0 | 112.8 | S108 R116 | S108-E112 WeakPolarHBondContact O-CG 3.39Å; S108-E112 PolarHBondContact O-N 3.24Å; S108-E112 PolarHBondContact OG-OE1 3.29Å; E112-R116 WeakPolarHBondContact O-CB 3.36Å; E112-R116 WeakPolarHBondContact O-CG 3.4Å; E112-R116 PolarHBondContact O-N 3.42Å; E112-R116 PolarHBondContact O-NE 2.79Å |
| 113 | T | 85.1 | Confident | 84.7 | Confident | 57 Ų | 57 | 93.5 Ų | 93.5 | 35% | 0.35 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -79.2 | -38.6 | -179.3 | -58.3 | 0 | 0 | 0 | 0 | 111.5 | K109 K110 C111 Q115 R116 M117 | K109-T113 VanDerWaalsContact O-CB 3.31Å; K109-T113 WeakPolarHBondContact O-CB 3.4Å; K109-T113 PolarHBondContact O-N 2.7Å; K109-T113 VanDerWaalsContact O-N 3.15Å; K109-T113 PolarHBondContact O-OG1 3.15Å; K110-T113 PolarHBondContact O-N 2.82Å; K110-T113 VanDerWaalsContact O-N 3.17Å; C111-T113 PolarHBondContact O-N 3.24Å; T113-Q115 VanDerWaalsContact C-N 3.33Å; T113-R116 PolarHBondContact OG1-NH2 2.79Å; T113-M117 WeakPolarHBondContact O-CG 3.43Å; T113-M117 PolarHBondContact O-N 3.17Å |
| 114 | V | 85.5 | Confident | 84.7 | Confident | 89 Ų | 89 | 94.2 Ų | 94.2 | 54% | 0.539 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.2 | -39.8 | 168.9 | 170.4 | 0 | 0 | 0 | 0 | 110.7 | K110 C111 M117 L118 | K110-V114 WeakPolarHBondContact O-CG2 3.33Å; K110-V114 PolarHBondContact O-N 2.96Å; C111-V114 CarbonylContact O-C 3.6Å; C111-V114 PolarHBondContact O-N 2.89Å; V114-M117 HydrophobicContact CG2-CE 4.1Å; V114-M117 PolarHBondContact O-N 3.39Å; V114-L118 VanDerWaalsContact O-CB 3.31Å; V114-L118 WeakPolarHBondContact O-CB 3.5Å; V114-L118 PolarHBondContact O-N 2.96Å |
| 115 | Q | 88.3 | Confident | 84.9 | Confident | 102 Ų | 102 | 97 Ų | 97 | 48% | 0.477 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.4 | -48.8 | 175.4 | 178.8 | 175 | -16.3 | 0 | 0 | 111 | C111 T113 M117 L118 E119 | C111-Q115 VanDerWaalsContact O-CB 3.25Å; C111-Q115 WeakPolarHBondContact O-CB 3.33Å; C111-Q115 PolarHBondContact O-N 2.98Å; T113-Q115 VanDerWaalsContact C-N 3.33Å; Q115-M117 VanDerWaalsContact C-N 3.32Å; Q115-M117 PolarHBondContact O-N 3.06Å; Q115-L118 CarbonylContact O-C 3.54Å; Q115-L118 WeakPolarHBondContact O-CA 3.5Å; Q115-L118 WeakPolarHBondContact O-CB 3.38Å; Q115-L118 PolarHBondContact O-N 2.95Å; Q115-E119 HydrophobicContact CG-CG 4.36Å; Q115-E119 VanDerWaalsContact CG-OE1 3.24Å; Q115-E119 WeakPolarHBondContact CG-OE1 3.3Å; Q115-E119 PolarHBondContact NE2-OE1 2.86Å; Q115-E119 WeakPolarHBondContact O-CB 3.48Å; Q115-E119 WeakPolarHBondContact O-CG 3.21Å; Q115-E119 PolarHBondContact O-N 2.8Å |
| 116 | R | 86.1 | Confident | 84.9 | Confident | 127 Ų | 127 | 96 Ų | 96 | 48% | 0.479 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.2 | -37.9 | 174.1 | -83.8 | 178.8 | -83.2 | 99.2 | 1.4 | 113 | E112 T113 D120 | E112-R116 WeakPolarHBondContact O-CB 3.36Å; E112-R116 WeakPolarHBondContact O-CG 3.4Å; E112-R116 PolarHBondContact O-N 3.42Å; E112-R116 PolarHBondContact O-NE 2.79Å; T113-R116 PolarHBondContact OG1-NH2 2.79Å; R116-D120 WeakPolarHBondContact O-CB 3.23Å; R116-D120 PolarHBondContact O-N 2.91Å |
| 117 | M | 85.3 | Confident | 84.8 | Confident | 107 Ų | 107 | 96.7 Ų | 96.7 | 53% | 0.527 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68.3 | -34.7 | 172.8 | -71.9 | -173.7 | -58.7 | 0 | 0 | 112.4 | T113 V114 Q115 L121 | T113-M117 WeakPolarHBondContact O-CG 3.43Å; T113-M117 PolarHBondContact O-N 3.17Å; V114-M117 HydrophobicContact CG2-CE 4.1Å; V114-M117 PolarHBondContact O-N 3.39Å; Q115-M117 VanDerWaalsContact C-N 3.32Å; Q115-M117 PolarHBondContact O-N 3.06Å; M117-L121 VanDerWaalsContact O-CB 3.3Å; M117-L121 WeakPolarHBondContact O-CB 3.5Å; M117-L121 WeakPolarHBondContact O-CD1 3.37Å; M117-L121 WeakPolarHBondContact O-CG 3.31Å; M117-L121 PolarHBondContact O-N 3.37Å |
| 118 | L | 83.8 | Confident | 84.9 | Confident | 111 Ų | 111 | 97.9 Ų | 97.9 | 58% | 0.581 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -70.3 | -42 | 176.3 | -171.3 | 69.2 | 0 | 0 | 0 | 111.2 | V114 Q115 L121 V122 | V114-L118 VanDerWaalsContact O-CB 3.31Å; V114-L118 WeakPolarHBondContact O-CB 3.5Å; V114-L118 PolarHBondContact O-N 2.96Å; Q115-L118 CarbonylContact O-C 3.54Å; Q115-L118 WeakPolarHBondContact O-CA 3.5Å; Q115-L118 WeakPolarHBondContact O-CB 3.38Å; Q115-L118 PolarHBondContact O-N 2.95Å; L118-L121 PolarHBondContact O-N 3.35Å; L118-V122 WeakPolarHBondContact O-CB 3.43Å; L118-V122 VanDerWaalsContact O-CG2 3.23Å; L118-V122 WeakPolarHBondContact O-CG2 3.32Å; L118-V122 PolarHBondContact O-N 2.89Å |
| 119 | E | 86.8 | Confident | 85 | Confident | 102 Ų | 102 | 100.3 Ų | 100.3 | 48% | 0.477 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.4 | -44 | 173.9 | -72.8 | 166 | 179.8 | 0 | 0 | 111.2 | Q115 V122 A123 | Q115-E119 HydrophobicContact CG-CG 4.36Å; Q115-E119 VanDerWaalsContact CG-OE1 3.24Å; Q115-E119 WeakPolarHBondContact CG-OE1 3.3Å; Q115-E119 PolarHBondContact NE2-OE1 2.86Å; Q115-E119 WeakPolarHBondContact O-CB 3.48Å; Q115-E119 WeakPolarHBondContact O-CG 3.21Å; Q115-E119 PolarHBondContact O-N 2.8Å; E119-V122 PolarHBondContact O-N 2.73Å; E119-A123 WeakPolarHBondContact O-CB 3.42Å; E119-A123 PolarHBondContact O-N 3.42Å |
| 120 | D | 85.1 | Confident | 85.2 | Confident | 86 Ų | 86 | 97.4 Ų | 97.4 | 46% | 0.46 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -67.1 | -41.4 | 174.9 | -170.8 | 64.5 | 0 | 0 | 0 | 112.3 | R116 V122 A123 Q124 | R116-D120 WeakPolarHBondContact O-CB 3.23Å; R116-D120 PolarHBondContact O-N 2.91Å; D120-V122 VanDerWaalsContact C-N 3.3Å; D120-V122 PolarHBondContact O-N 2.91Å; D120-A123 CarbonylContact O-C 3.6Å; D120-A123 PolarHBondContact O-N 3.23Å; D120-Q124 WeakPolarHBondContact O-CB 3.45Å; D120-Q124 VanDerWaalsContact O-CG 3.31Å; D120-Q124 WeakPolarHBondContact O-CG 3.44Å; D120-Q124 PolarHBondContact O-N 2.78Å; D120-Q124 PolarHBondContact OD2-NE2 3.39Å |
| 121 | L | 84.3 | Confident | 85.2 | Confident | 103 Ų | 103 | 100 Ų | 100 | 54% | 0.539 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.6 | -33.7 | 172.8 | -76.5 | 168.1 | 0 | 0 | 0 | 112.7 | M117 L118 R125 | M117-L121 VanDerWaalsContact O-CB 3.3Å; M117-L121 WeakPolarHBondContact O-CB 3.5Å; M117-L121 WeakPolarHBondContact O-CD1 3.37Å; M117-L121 WeakPolarHBondContact O-CG 3.31Å; M117-L121 PolarHBondContact O-N 3.37Å; L118-L121 PolarHBondContact O-N 3.35Å; L121-R125 WeakPolarHBondContact O-CB 3.24Å; L121-R125 PolarHBondContact O-N 3.31Å |
| 122 | V | 83.1 | Confident | 85.7 | Confident | 94 Ų | 94 | 101.7 Ų | 101.7 | 57% | 0.57 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -69.3 | -40.3 | 172.5 | 165.2 | 0 | 0 | 0 | 0 | 110.9 | L118 E119 D120 R125 G126 | L118-V122 WeakPolarHBondContact O-CB 3.43Å; L118-V122 VanDerWaalsContact O-CG2 3.23Å; L118-V122 WeakPolarHBondContact O-CG2 3.32Å; L118-V122 PolarHBondContact O-N 2.89Å; E119-V122 PolarHBondContact O-N 2.73Å; D120-V122 VanDerWaalsContact C-N 3.3Å; D120-V122 PolarHBondContact O-N 2.91Å; V122-R125 PolarHBondContact O-N 2.85Å; V122-G126 PolarHBondContact O-N 3.37Å |
| 123 | A | 83.5 | Confident | 86 | Confident | 59 Ų | 59 | 101.4 Ų | 101.4 | 49% | 0.488 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.8 | -42.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | E119 D120 G126 N127 | E119-A123 WeakPolarHBondContact O-CB 3.42Å; E119-A123 PolarHBondContact O-N 3.42Å; D120-A123 CarbonylContact O-C 3.6Å; D120-A123 PolarHBondContact O-N 3.23Å; A123-G126 CarbonylContact O-C 3.6Å; A123-G126 PolarHBondContact O-N 2.86Å; A123-N127 PolarHBondContact O-N 2.89Å |
| 124 | Q | 84.1 | Confident | 86.4 | Confident | 96 Ų | 96 | 100 Ų | 100 | 45% | 0.449 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.3 | -43.1 | 173.6 | -71.4 | -176.5 | 36.2 | 0 | 0 | 111.5 | D120 G126 N127 L128 | D120-Q124 WeakPolarHBondContact O-CB 3.45Å; D120-Q124 VanDerWaalsContact O-CG 3.31Å; D120-Q124 WeakPolarHBondContact O-CG 3.44Å; D120-Q124 PolarHBondContact O-N 2.78Å; D120-Q124 PolarHBondContact OD2-NE2 3.39Å; Q124-G126 VanDerWaalsContact C-N 3.35Å; Q124-N127 PolarHBondContact O-N 3.17Å; Q124-L128 WeakPolarHBondContact O-CB 3.26Å; Q124-L128 WeakPolarHBondContact O-CG 3.41Å; Q124-L128 PolarHBondContact O-N 2.86Å |
| 125 | R | 81.4 | Confident | 86.8 | Confident | 185 Ų | 185 | 100.8 Ų | 100.8 | 70% | 0.698 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -58.8 | -45.6 | 170.6 | 174.9 | -178.2 | -81.6 | -154 | -4.2 | 111.2 | L121 V122 N127 L128 Q129 | L121-R125 WeakPolarHBondContact O-CB 3.24Å; L121-R125 PolarHBondContact O-N 3.31Å; V122-R125 PolarHBondContact O-N 2.85Å; R125-N127 PolarHBondContact O-N 3.15Å; R125-L128 PolarHBondContact O-N 3Å; R125-Q129 WeakPolarHBondContact O-CB 3.35Å; R125-Q129 PolarHBondContact O-N 2.92Å |
| 126 | G | 82.6 | Confident | 87.1 | Confident | 47 Ų | 47 | 102 Ų | 102 | 49% | 0.485 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63 | -23.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | V122 A123 Q124 P130 | V122-G126 PolarHBondContact O-N 3.37Å; A123-G126 CarbonylContact O-C 3.6Å; A123-G126 PolarHBondContact O-N 2.86Å; Q124-G126 VanDerWaalsContact C-N 3.35Å; G126-P130 WeakPolarHBondContact O-CD 3.47Å |
| 127 | N | 84.3 | Confident | 87.5 | Confident | 109 Ų | 109 | 103 Ų | 103 | 58% | 0.583 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -90.4 | -33.1 | 173.4 | -169.4 | -0.6 | 0 | 0 | 0 | 112.4 | A123 Q124 R125 P130 R131 | A123-N127 PolarHBondContact O-N 2.89Å; Q124-N127 PolarHBondContact O-N 3.17Å; R125-N127 PolarHBondContact O-N 3.15Å; N127-P130 WeakPolarHBondContact O-CD 3.48Å; N127-P130 WeakPolarHBondContact O-CG 3.48Å; N127-R131 WeakPolarHBondContact O-CG 3.45Å |
| 128 | L | 86.9 | Confident | 88 | Confident | 109 Ų | 109 | 102.2 Ų | 102.2 | 57% | 0.571 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -67.9 | -37.1 | 173.5 | -77.9 | 166.2 | 0 | 0 | 0 | 112.4 | Q124 R125 R131 L132 | Q124-L128 WeakPolarHBondContact O-CB 3.26Å; Q124-L128 WeakPolarHBondContact O-CG 3.41Å; Q124-L128 PolarHBondContact O-N 2.86Å; R125-L128 PolarHBondContact O-N 3Å; L128-R131 WeakPolarHBondContact O-CB 3.47Å; L128-R131 PolarHBondContact O-N 3.02Å; L128-L132 PolarHBondContact O-N 3.18Å |
| 129 | Q | 87.6 | Confident | 88.6 | Confident | 109 Ų | 109 | 101.1 Ų | 101.1 | 51% | 0.509 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -58.9 | -53.3 | -178.2 | 179.2 | 157.8 | -17.7 | 0 | 0 | 114.2 | R125 R131 L132 E133 | R125-Q129 WeakPolarHBondContact O-CB 3.35Å; R125-Q129 PolarHBondContact O-N 2.92Å; Q129-R131 PolarHBondContact O-N 2.9Å; Q129-R131 VanDerWaalsContact O-N 3.17Å; Q129-L132 WeakPolarHBondContact O-CB 3.41Å; Q129-L132 PolarHBondContact O-N 3.17Å; Q129-E133 HydrophobicContact CG-CG 4.36Å; Q129-E133 WeakPolarHBondContact CG-OE1 3.44Å; Q129-E133 PolarHBondContact NE2-OE1 3.28Å; Q129-E133 WeakPolarHBondContact O-CG 3.49Å; Q129-E133 PolarHBondContact O-N 2.95Å |
| 130 | P | 89.1 | Confident | 89.1 | Confident | 62 Ų | 62 | 100.1 Ų | 100.1 | 40% | 0.403 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.9 | -20.3 | 176.8 | 25.6 | -35.2 | 0 | 0 | 0 | 113.3 | G126 N127 A134 | G126-P130 WeakPolarHBondContact O-CD 3.47Å; N127-P130 WeakPolarHBondContact O-CD 3.48Å; N127-P130 WeakPolarHBondContact O-CG 3.48Å; P130-A134 VanDerWaalsContact O-CB 3.29Å; P130-A134 WeakPolarHBondContact O-CB 3.38Å; P130-A134 PolarHBondContact O-N 3.18Å |
| 131 | R | 88.9 | Confident | 89.6 | Confident | 177 Ų | 177 | 101.3 Ų | 101.3 | 67% | 0.668 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -78.2 | -34 | 171.7 | -64.1 | -176.2 | 70.4 | -170.8 | 1.5 | 112.4 | N127 L128 Q129 A134 L135 | N127-R131 WeakPolarHBondContact O-CG 3.45Å; L128-R131 WeakPolarHBondContact O-CB 3.47Å; L128-R131 PolarHBondContact O-N 3.02Å; Q129-R131 PolarHBondContact O-N 2.9Å; Q129-R131 VanDerWaalsContact O-N 3.17Å; R131-A134 PolarHBondContact O-N 3.5Å; R131-L135 WeakPolarHBondContact O-CB 3.4Å; R131-L135 PolarHBondContact O-N 3.42Å |
| 132 | L | 91.4 | Very high | 90.2 | Very high | 115 Ų | 115 | 102.3 Ų | 102.3 | 60% | 0.602 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -69.2 | -46 | 171.5 | -176.9 | 62.3 | 0 | 0 | 0 | 110.7 | L128 Q129 A134 L135 E136 | L128-L132 PolarHBondContact O-N 3.18Å; Q129-L132 WeakPolarHBondContact O-CB 3.41Å; Q129-L132 PolarHBondContact O-N 3.17Å; L132-A134 PolarHBondContact O-N 3.21Å; L132-L135 PolarHBondContact O-N 2.96Å; L132-L135 VanDerWaalsContact O-N 3.15Å; L132-E136 WeakPolarHBondContact O-CB 2.98Å; L132-E136 PolarHBondContact O-N 3.38Å |
| 133 | E | 93.1 | Very high | 90.8 | Very high | 84 Ų | 84 | 103.1 Ų | 103.1 | 39% | 0.393 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.4 | -28.1 | 174.1 | -67.3 | 167.7 | -172.9 | 0 | 0 | 112.3 | Q129 R137 | Q129-E133 HydrophobicContact CG-CG 4.36Å; Q129-E133 WeakPolarHBondContact CG-OE1 3.44Å; Q129-E133 PolarHBondContact NE2-OE1 3.28Å; Q129-E133 WeakPolarHBondContact O-CG 3.49Å; Q129-E133 PolarHBondContact O-N 2.95Å; E133-R137 WeakPolarHBondContact O-CG 3.38Å; E133-R137 PolarHBondContact O-N 2.85Å; E133-R137 PolarHBondContact O-NE 2.89Å |
| 134 | A | 92.9 | Very high | 91.4 | Very high | 27 Ų | 27 | 105.2 Ų | 105.2 | 22% | 0.223 | 53% | 0.529 | C | S | . | . | H | α-helix | trans | -71.5 | -49.5 | 169.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | P130 R131 L132 E136 R137 D138 | P130-A134 VanDerWaalsContact O-CB 3.29Å; P130-A134 WeakPolarHBondContact O-CB 3.38Å; P130-A134 PolarHBondContact O-N 3.18Å; R131-A134 PolarHBondContact O-N 3.5Å; L132-A134 PolarHBondContact O-N 3.21Å; A134-E136 VanDerWaalsContact C-N 3.29Å; A134-E136 PolarHBondContact O-N 2.82Å; A134-R137 VanDerWaalsContact CA-NH2 3.32Å; A134-R137 PolarHBondContact O-N 2.88Å; A134-D138 VanDerWaalsContact O-CG 3.31Å; A134-D138 PolarHBondContact O-N 2.91Å |
| 135 | L | 94 | Very high | 92 | Very high | 105 Ų | 105 | 109.8 Ų | 109.8 | 55% | 0.55 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -61.8 | -36.9 | 178 | -177.1 | 62.5 | 0 | 0 | 0 | 112.2 | R131 L132 D138 V139 | R131-L135 WeakPolarHBondContact O-CB 3.4Å; R131-L135 PolarHBondContact O-N 3.42Å; L132-L135 PolarHBondContact O-N 2.96Å; L132-L135 VanDerWaalsContact O-N 3.15Å; L135-D138 PolarHBondContact O-N 2.93Å; L135-V139 WeakPolarHBondContact O-CB 3.45Å; L135-V139 VanDerWaalsContact O-CG2 3.26Å; L135-V139 WeakPolarHBondContact O-CG2 3.25Å; L135-V139 PolarHBondContact O-N 3.31Å |
| 136 | E | 94.6 | Very high | 92.7 | Very high | 127 Ų | 127 | 103.6 Ų | 103.6 | 59% | 0.593 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64 | -44.6 | 175 | -174.7 | 170.4 | -163.7 | 0 | 0 | 111.5 | L132 A134 V139 V140 | L132-E136 WeakPolarHBondContact O-CB 2.98Å; L132-E136 PolarHBondContact O-N 3.38Å; A134-E136 VanDerWaalsContact C-N 3.29Å; A134-E136 PolarHBondContact O-N 2.82Å; E136-V139 PolarHBondContact O-N 2.88Å; E136-V140 WeakPolarHBondContact O-CG2 3.14Å; E136-V140 PolarHBondContact O-N 3.3Å |
| 137 | R | 95.6 | Very high | 93.4 | Very high | 149 Ų | 149 | 104.1 Ų | 104.1 | 56% | 0.562 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -61.7 | -42.4 | 172.6 | -77.6 | -178.6 | -74.7 | 102 | -8.9 | 112.6 | E133 A134 V139 V140 Q141 | E133-R137 WeakPolarHBondContact O-CG 3.38Å; E133-R137 PolarHBondContact O-N 2.85Å; E133-R137 PolarHBondContact O-NE 2.89Å; A134-R137 VanDerWaalsContact CA-NH2 3.32Å; A134-R137 PolarHBondContact O-N 2.88Å; R137-V139 VanDerWaalsContact C-N 3.33Å; R137-V139 PolarHBondContact O-N 3.11Å; R137-V140 PolarHBondContact O-N 3.38Å; R137-Q141 WeakPolarHBondContact O-CB 3.39Å; R137-Q141 PolarHBondContact O-N 3.4Å |
| 138 | D | 96 | Very high | 94 | Very high | 91 Ų | 91 | 100 Ų | 100 | 49% | 0.487 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65 | -37.3 | 177.5 | -67.7 | -12.3 | 0 | 0 | 0 | 111.5 | A134 L135 L142 | A134-D138 VanDerWaalsContact O-CG 3.31Å; A134-D138 PolarHBondContact O-N 2.91Å; L135-D138 PolarHBondContact O-N 2.93Å; D138-L142 VanDerWaalsContact O-CB 3.25Å; D138-L142 WeakPolarHBondContact O-CB 3.48Å; D138-L142 PolarHBondContact O-N 3.19Å |
| 139 | V | 95.7 | Very high | 94.5 | Very high | 88 Ų | 88 | 100.7 Ų | 100.7 | 53% | 0.533 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.6 | -42.5 | 174.7 | 165.7 | 0 | 0 | 0 | 0 | 111.7 | L135 E136 R137 L142 N143 | L135-V139 WeakPolarHBondContact O-CB 3.45Å; L135-V139 VanDerWaalsContact O-CG2 3.26Å; L135-V139 WeakPolarHBondContact O-CG2 3.25Å; L135-V139 PolarHBondContact O-N 3.31Å; E136-V139 PolarHBondContact O-N 2.88Å; R137-V139 VanDerWaalsContact C-N 3.33Å; R137-V139 PolarHBondContact O-N 3.11Å; V139-L142 PolarHBondContact O-N 2.92Å; V139-N143 WeakPolarHBondContact O-CB 3.3Å; V139-N143 PolarHBondContact O-N 3.34Å |
| 140 | V | 96.1 | Very high | 94.9 | Very high | 80 Ų | 80 | 99.3 Ų | 99.3 | 49% | 0.485 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.3 | -49.9 | 173.6 | 170.7 | 0 | 0 | 0 | 0 | 110.3 | E136 R137 L142 N143 D144 | E136-V140 WeakPolarHBondContact O-CG2 3.14Å; E136-V140 PolarHBondContact O-N 3.3Å; R137-V140 PolarHBondContact O-N 3.38Å; V140-L142 VanDerWaalsContact C-N 3.32Å; V140-L142 PolarHBondContact O-N 2.86Å; V140-N143 WeakPolarHBondContact O-CB 3.41Å; V140-N143 PolarHBondContact O-N 3.17Å; V140-N143 VanDerWaalsContact O-N 3.09Å; V140-D144 PolarHBondContact O-N 2.91Å |
| 141 | Q | 96.8 | Very high | 95.3 | Very high | 111 Ų | 111 | 103.1 Ų | 103.1 | 52% | 0.519 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60.6 | -39.4 | 178.4 | -177.2 | 177.1 | -33.1 | 0 | 0 | 112.2 | R137 N143 D144 W145 | R137-Q141 WeakPolarHBondContact O-CB 3.39Å; R137-Q141 PolarHBondContact O-N 3.4Å; Q141-N143 VanDerWaalsContact C-N 3.34Å; Q141-D144 PolarHBondContact O-N 3.44Å; Q141-W145 WeakPolarHBondContact O-CB 3.29Å; Q141-W145 PolarHBondContact O-N 3.45Å |
| 142 | L | 96.4 | Very high | 95.7 | Very high | 125 Ų | 125 | 100.9 Ų | 100.9 | 65% | 0.654 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66.8 | -35.7 | 175.9 | -177.1 | 61.7 | 0 | 0 | 0 | 112.1 | D138 V139 V140 W145 A146 | D138-L142 VanDerWaalsContact O-CB 3.25Å; D138-L142 WeakPolarHBondContact O-CB 3.48Å; D138-L142 PolarHBondContact O-N 3.19Å; V139-L142 PolarHBondContact O-N 2.92Å; V140-L142 VanDerWaalsContact C-N 3.32Å; V140-L142 PolarHBondContact O-N 2.86Å; L142-W145 PolarHBondContact O-N 2.98Å; L142-A146 WeakPolarHBondContact O-CB 3.5Å; L142-A146 PolarHBondContact O-N 2.93Å |
| 143 | N | 96 | Very high | 95.9 | Very high | 110 Ų | 110 | 105.1 Ų | 105.1 | 59% | 0.588 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -68 | -43.2 | 175.6 | -166.4 | 32.8 | 0 | 0 | 0 | 111.5 | V139 V140 Q141 W145 A146 A147 | V139-N143 WeakPolarHBondContact O-CB 3.3Å; V139-N143 PolarHBondContact O-N 3.34Å; V140-N143 WeakPolarHBondContact O-CB 3.41Å; V140-N143 PolarHBondContact O-N 3.17Å; V140-N143 VanDerWaalsContact O-N 3.09Å; Q141-N143 VanDerWaalsContact C-N 3.34Å; N143-W145 VanDerWaalsContact C-N 3.32Å; N143-W145 PolarHBondContact O-N 3.46Å; N143-A146 WeakPolarHBondContact O-CB 3.43Å; N143-A146 PolarHBondContact O-N 3.09Å; N143-A146 VanDerWaalsContact O-N 3.17Å; N143-A147 PolarHBondContact O-N 2.89Å |
| 144 | D | 96.5 | Very high | 96.1 | Very high | 104 Ų | 104 | 104.2 Ų | 104.2 | 56% | 0.556 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -61 | -40.8 | 173.3 | -68.7 | -22.4 | 0 | 0 | 0 | 111.6 | V140 Q141 A147 G148 | V140-D144 PolarHBondContact O-N 2.91Å; Q141-D144 PolarHBondContact O-N 3.44Å; D144-A147 PolarHBondContact O-N 3.35Å; D144-G148 PolarHBondContact O-N 2.9Å |
| 145 | W | 97.1 | Very high | 96.3 | Very high | 192 Ų | 192 | 109.2 Ų | 109.2 | 73% | 0.727 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -64.6 | -39.3 | 173.7 | -85.9 | 55 | 0 | 0 | 0 | 112.5 | Q141 L142 N143 L149 | Q141-W145 WeakPolarHBondContact O-CB 3.29Å; Q141-W145 PolarHBondContact O-N 3.45Å; L142-W145 PolarHBondContact O-N 2.98Å; N143-W145 VanDerWaalsContact C-N 3.32Å; N143-W145 PolarHBondContact O-N 3.46Å; W145-L149 VanDerWaalsContact O-CB 3.31Å; W145-L149 WeakPolarHBondContact O-CB 3.35Å; W145-L149 PolarHBondContact O-N 3.2Å |
| 146 | A | 95.8 | Very high | 96.5 | Very high | 54 Ų | 54 | 110 Ų | 110 | 45% | 0.446 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -66.3 | -40 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | L142 N143 L149 S150 | L142-A146 WeakPolarHBondContact O-CB 3.5Å; L142-A146 PolarHBondContact O-N 2.93Å; N143-A146 WeakPolarHBondContact O-CB 3.43Å; N143-A146 PolarHBondContact O-N 3.09Å; N143-A146 VanDerWaalsContact O-N 3.17Å; A146-L149 PolarHBondContact O-N 3.35Å; A146-S150 WeakPolarHBondContact O-CB 3.36Å; A146-S150 PolarHBondContact O-N 3.29Å |
| 147 | A | 96.2 | Very high | 96.7 | Very high | 58 Ų | 58 | 110 Ų | 110 | 48% | 0.479 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.8 | -49.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | N143 D144 L149 S150 E151 | N143-A147 PolarHBondContact O-N 2.89Å; D144-A147 PolarHBondContact O-N 3.35Å; A147-L149 VanDerWaalsContact C-N 3.29Å; A147-L149 PolarHBondContact O-N 3.49Å; A147-S150 VanDerWaalsContact O-CB 3.3Å; A147-S150 WeakPolarHBondContact O-CB 3.43Å; A147-S150 PolarHBondContact O-N 3.06Å; A147-S150 VanDerWaalsContact O-N 3.11Å; A147-E151 PolarHBondContact O-N 3.03Å |
| 148 | G | 97.6 | Very high | 96.8 | Very high | 23 Ų | 23 | 104.6 Ų | 104.6 | 24% | 0.237 | 56% | 0.556 | C | S | . | * | H | α-helix | trans | -65 | -28.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114 | D144 K152 | D144-G148 PolarHBondContact O-N 2.9Å; G148-K152 WeakPolarHBondContact O-CB 3.32Å; G148-K152 WeakPolarHBondContact O-CD 3.4Å; G148-K152 VanDerWaalsContact O-CG 3.26Å; G148-K152 WeakPolarHBondContact O-CG 3.48Å; G148-K152 PolarHBondContact O-N 3.3Å; G148-K152 VanDerWaalsContact O-N 3.12Å |
| 149 | L | 96.7 | Very high | 96.9 | Very high | 123 Ų | 123 | 103.8 Ų | 103.8 | 64% | 0.644 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -74.8 | -36.1 | 171.8 | -172.5 | 64.1 | 0 | 0 | 0 | 111.8 | W145 A146 A147 R153 | W145-L149 VanDerWaalsContact O-CB 3.31Å; W145-L149 WeakPolarHBondContact O-CB 3.35Å; W145-L149 PolarHBondContact O-N 3.2Å; A146-L149 PolarHBondContact O-N 3.35Å; A147-L149 VanDerWaalsContact C-N 3.29Å; A147-L149 PolarHBondContact O-N 3.49Å; L149-R153 WeakPolarHBondContact O-CB 3.32Å; L149-R153 PolarHBondContact O-N 3.02Å |
| 150 | S | 96 | Very high | 97 | Very high | 80 Ų | 80 | 104.6 Ų | 104.6 | 56% | 0.559 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -62.7 | -46.9 | 172.3 | -172.4 | 0 | 0 | 0 | 0 | 111.5 | A146 A147 R153 A154 | A146-S150 WeakPolarHBondContact O-CB 3.36Å; A146-S150 PolarHBondContact O-N 3.29Å; A147-S150 VanDerWaalsContact O-CB 3.3Å; A147-S150 WeakPolarHBondContact O-CB 3.43Å; A147-S150 PolarHBondContact O-N 3.06Å; A147-S150 VanDerWaalsContact O-N 3.11Å; S150-R153 WeakPolarHBondContact O-CB 3.44Å; S150-R153 PolarHBondContact O-N 3.04Å; S150-A154 PolarHBondContact O-N 2.91Å |
| 151 | E | 97.4 | Very high | 97 | Very high | 143 Ų | 143 | 103.5 Ų | 103.5 | 67% | 0.668 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -60.2 | -50 | 176.1 | -176.2 | 179.6 | -150.3 | 0 | 0 | 111.6 | A147 R153 A154 Q155 | A147-E151 PolarHBondContact O-N 3.03Å; E151-R153 VanDerWaalsContact C-N 3.26Å; E151-R153 PolarHBondContact O-N 3.39Å; E151-A154 WeakPolarHBondContact O-CB 3.31Å; E151-A154 PolarHBondContact O-N 2.95Å; E151-A154 VanDerWaalsContact O-N 3.09Å; E151-Q155 PolarHBondContact O-N 3.03Å |
| 152 | K | 97.5 | Very high | 97.1 | Very high | 130 Ų | 130 | 102 Ų | 102 | 57% | 0.565 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -58.2 | -37.7 | 174.9 | -74.9 | 168.5 | -175.4 | 169.2 | 0 | 112.2 | G148 Q155 L156 | G148-K152 WeakPolarHBondContact O-CB 3.32Å; G148-K152 WeakPolarHBondContact O-CD 3.4Å; G148-K152 VanDerWaalsContact O-CG 3.26Å; G148-K152 WeakPolarHBondContact O-CG 3.48Å; G148-K152 PolarHBondContact O-N 3.3Å; G148-K152 VanDerWaalsContact O-N 3.12Å; K152-Q155 PolarHBondContact O-N 3.22Å; K152-L156 WeakPolarHBondContact O-CB 3.3Å; K152-L156 VanDerWaalsContact O-CD1 3.23Å; K152-L156 WeakPolarHBondContact O-CD1 3.48Å; K152-L156 PolarHBondContact O-N 3.15Å |
| 153 | R | 97 | Very high | 97.2 | Very high | 203 Ų | 203 | 101.1 Ų | 101.1 | 77% | 0.766 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -66.2 | -40.7 | 175.4 | -177.1 | 176.6 | -179.3 | 150.9 | 1.6 | 112 | L149 S150 E151 H157 | L149-R153 WeakPolarHBondContact O-CB 3.32Å; L149-R153 PolarHBondContact O-N 3.02Å; S150-R153 WeakPolarHBondContact O-CB 3.44Å; S150-R153 PolarHBondContact O-N 3.04Å; E151-R153 VanDerWaalsContact C-N 3.26Å; E151-R153 PolarHBondContact O-N 3.39Å; R153-H157 WeakPolarHBondContact O-CB 3.38Å; R153-H157 PolarHBondContact O-N 3.01Å |
| 154 | A | 96.7 | Very high | 97.3 | Very high | 65 Ų | 65 | 104.1 Ų | 104.1 | 54% | 0.537 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -65.1 | -42.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | S150 E151 H157 G158 | S150-A154 PolarHBondContact O-N 2.91Å; E151-A154 WeakPolarHBondContact O-CB 3.31Å; E151-A154 PolarHBondContact O-N 2.95Å; E151-A154 VanDerWaalsContact O-N 3.09Å; A154-H157 PolarHBondContact O-N 3.48Å; A154-G158 PolarHBondContact O-N 2.89Å |
| 155 | Q | 97.6 | Very high | 97.4 | Very high | 132 Ų | 132 | 103.8 Ų | 103.8 | 62% | 0.617 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -60.7 | -50.5 | 175.7 | -168.6 | -176.5 | 25.9 | 0 | 0 | 111.7 | E151 K152 H157 G158 S159 | E151-Q155 PolarHBondContact O-N 3.03Å; K152-Q155 PolarHBondContact O-N 3.22Å; Q155-H157 VanDerWaalsContact C-N 3.25Å; Q155-H157 PolarHBondContact O-N 2.92Å; Q155-G158 PolarHBondContact O-N 3.43Å; Q155-S159 PolarHBondContact O-N 2.97Å; Q155-S159 PolarHBondContact O-OG 3.49Å |
| 156 | L | 97.6 | Very high | 97.4 | Very high | 122 Ų | 122 | 96.8 Ų | 96.8 | 64% | 0.639 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -59.5 | -36.2 | 175.5 | -96.8 | 77.6 | 0 | 0 | 0 | 112.2 | K152 S159 L160 | K152-L156 WeakPolarHBondContact O-CB 3.3Å; K152-L156 VanDerWaalsContact O-CD1 3.23Å; K152-L156 WeakPolarHBondContact O-CD1 3.48Å; K152-L156 PolarHBondContact O-N 3.15Å; L156-S159 PolarHBondContact O-N 3.32Å; L156-L160 VanDerWaalsContact O-CB 3.32Å; L156-L160 WeakPolarHBondContact O-CB 3.45Å; L156-L160 PolarHBondContact O-N 3.24Å |
| 157 | H | 97.6 | Very high | 97.5 | Very high | 127 Ų | 127 | 97.3 Ų | 97.3 | 59% | 0.588 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -66.2 | -45.3 | 176.9 | -168 | 58.2 | 0 | 0 | 0 | 111.7 | R153 A154 Q155 S159 L160 T161 | R153-H157 WeakPolarHBondContact O-CB 3.38Å; R153-H157 PolarHBondContact O-N 3.01Å; A154-H157 PolarHBondContact O-N 3.48Å; Q155-H157 VanDerWaalsContact C-N 3.25Å; Q155-H157 PolarHBondContact O-N 2.92Å; H157-S159 PolarHBondContact O-N 3.19Å; H157-L160 PolarHBondContact O-N 2.9Å; H157-L160 VanDerWaalsContact O-N 3.15Å; H157-T161 PolarHBondContact O-N 3.29Å; H157-T161 PolarHBondContact O-OG1 2.9Å |
| 158 | G | 98.1 | Very high | 97.6 | Very high | 36 Ų | 36 | 97.5 Ų | 97.5 | 37% | 0.371 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.1 | -36 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | A154 Q155 T161 S162 | A154-G158 PolarHBondContact O-N 2.89Å; Q155-G158 PolarHBondContact O-N 3.43Å; G158-T161 PolarHBondContact O-OG1 2.93Å; G158-S162 VanDerWaalsContact O-CB 3.3Å; G158-S162 WeakPolarHBondContact O-CB 3.23Å; G158-S162 PolarHBondContact O-N 2.85Å |
| 159 | S | 98 | Very high | 97.7 | Very high | 74 Ų | 74 | 100.8 Ų | 100.8 | 52% | 0.517 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.8 | -38.1 | 170.8 | -60.9 | 0 | 0 | 0 | 0 | 112.2 | Q155 L156 H157 L163 | Q155-S159 PolarHBondContact O-N 2.97Å; Q155-S159 PolarHBondContact O-OG 3.49Å; L156-S159 PolarHBondContact O-N 3.32Å; H157-S159 PolarHBondContact O-N 3.19Å; S159-L163 VanDerWaalsContact O-CB 3.28Å; S159-L163 WeakPolarHBondContact O-CB 3.26Å; S159-L163 PolarHBondContact O-N 3.03Å |
| 160 | L | 97.8 | Very high | 97.7 | Very high | 104 Ų | 104 | 99.6 Ų | 99.6 | 55% | 0.545 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -71.1 | -36.1 | 178.9 | -176.9 | 63.6 | 0 | 0 | 0 | 112.7 | L156 H157 R164 | L156-L160 VanDerWaalsContact O-CB 3.32Å; L156-L160 WeakPolarHBondContact O-CB 3.45Å; L156-L160 PolarHBondContact O-N 3.24Å; H157-L160 PolarHBondContact O-N 2.9Å; H157-L160 VanDerWaalsContact O-N 3.15Å; L160-R164 WeakPolarHBondContact O-CB 3.45Å; L160-R164 PolarHBondContact O-N 3.09Å |
| 161 | T | 97.7 | Very high | 97.8 | Very high | 58 Ų | 58 | 101.6 Ų | 101.6 | 36% | 0.356 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.6 | -47.6 | 172.2 | 53.4 | 0 | 0 | 0 | 0 | 110.8 | H157 G158 L163 R164 D165 | H157-T161 PolarHBondContact O-N 3.29Å; H157-T161 PolarHBondContact O-OG1 2.9Å; G158-T161 PolarHBondContact O-OG1 2.93Å; T161-L163 VanDerWaalsContact C-N 3.3Å; T161-L163 PolarHBondContact O-N 2.96Å; T161-R164 WeakPolarHBondContact O-CA 3.46Å; T161-R164 WeakPolarHBondContact O-CB 3.48Å; T161-R164 PolarHBondContact O-N 3.12Å; T161-D165 PolarHBondContact O-N 2.93Å |
| 162 | S | 98.1 | Very high | 97.9 | Very high | 78 Ų | 78 | 101.3 Ų | 101.3 | 55% | 0.545 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -56.9 | -41.9 | 175.9 | -178.6 | 0 | 0 | 0 | 0 | 112.7 | G158 D165 A166 | G158-S162 VanDerWaalsContact O-CB 3.3Å; G158-S162 WeakPolarHBondContact O-CB 3.23Å; G158-S162 PolarHBondContact O-N 2.85Å; S162-D165 PolarHBondContact O-N 3.36Å; S162-A166 WeakPolarHBondContact O-CB 3.44Å; S162-A166 PolarHBondContact O-N 2.9Å |
| 163 | L | 98 | Very high | 97.9 | Very high | 108 Ų | 108 | 102.1 Ų | 102.1 | 57% | 0.565 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -65.6 | -39 | 174.8 | -178.7 | 61.4 | 0 | 0 | 0 | 112.4 | S159 T161 V167 | S159-L163 VanDerWaalsContact O-CB 3.28Å; S159-L163 WeakPolarHBondContact O-CB 3.26Å; S159-L163 PolarHBondContact O-N 3.03Å; T161-L163 VanDerWaalsContact C-N 3.3Å; T161-L163 PolarHBondContact O-N 2.96Å; L163-V167 WeakPolarHBondContact O-CG2 3.42Å; L163-V167 PolarHBondContact O-N 2.93Å |
| 164 | R | 98.2 | Very high | 98 | Very high | 172 Ų | 172 | 96.2 Ų | 96.2 | 65% | 0.649 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.5 | -48.7 | 174.4 | 173.7 | -180 | -66 | -135.1 | -5 | 111.2 | L160 T161 A166 V167 T168 | L160-R164 WeakPolarHBondContact O-CB 3.45Å; L160-R164 PolarHBondContact O-N 3.09Å; T161-R164 WeakPolarHBondContact O-CA 3.46Å; T161-R164 WeakPolarHBondContact O-CB 3.48Å; T161-R164 PolarHBondContact O-N 3.12Å; R164-A166 VanDerWaalsContact C-N 3.29Å; R164-A166 PolarHBondContact O-N 3.05Å; R164-V167 PolarHBondContact O-N 3.42Å; R164-V167 VanDerWaalsContact O-N 3.12Å; R164-T168 PolarHBondContact O-N 3.3Å; R164-T168 PolarHBondContact O-OG1 2.97Å |
| 165 | D | 98.2 | Very high | 98 | Very high | 97 Ų | 97 | 97 Ų | 97 | 52% | 0.519 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.8 | -36.5 | -177.6 | -57.1 | -22.2 | 0 | 0 | 0 | 111 | T161 S162 T168 Q169 | T161-D165 PolarHBondContact O-N 2.93Å; S162-D165 PolarHBondContact O-N 3.36Å; D165-T168 WeakPolarHBondContact CA-OG1 3.43Å; D165-T168 PolarHBondContact O-OG1 3.41Å; D165-Q169 WeakPolarHBondContact O-CB 3.36Å; D165-Q169 PolarHBondContact O-N 2.99Å |
| 166 | A | 98.2 | Very high | 98.1 | Very high | 45 Ų | 45 | 93.6 Ų | 93.6 | 37% | 0.372 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65 | -42 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | S162 R164 Q169 I170 | S162-A166 WeakPolarHBondContact O-CB 3.44Å; S162-A166 PolarHBondContact O-N 2.9Å; R164-A166 VanDerWaalsContact C-N 3.29Å; R164-A166 PolarHBondContact O-N 3.05Å; A166-Q169 PolarHBondContact O-N 3.43Å; A166-I170 WeakPolarHBondContact O-CD1 3.49Å; A166-I170 VanDerWaalsContact O-CG1 3.28Å; A166-I170 WeakPolarHBondContact O-CG1 3.28Å; A166-I170 PolarHBondContact O-N 2.91Å |
| 167 | V | 98.2 | Very high | 98.1 | Very high | 65 Ų | 65 | 92.4 Ų | 92.4 | 39% | 0.394 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63 | -47.3 | 175.2 | 167.4 | 0 | 0 | 0 | 0 | 111 | L163 R164 Q169 I170 E171 | L163-V167 WeakPolarHBondContact O-CG2 3.42Å; L163-V167 PolarHBondContact O-N 2.93Å; R164-V167 PolarHBondContact O-N 3.42Å; R164-V167 VanDerWaalsContact O-N 3.12Å; V167-Q169 VanDerWaalsContact C-N 3.31Å; V167-Q169 PolarHBondContact O-N 3.04Å; V167-I170 WeakPolarHBondContact O-CA 3.49Å; V167-I170 WeakPolarHBondContact O-CB 3.38Å; V167-I170 PolarHBondContact O-N 3.42Å; V167-E171 HydrophobicContact CG1-CG 4.43Å; V167-E171 WeakPolarHBondContact O-CG 3.4Å; V167-E171 PolarHBondContact O-N 2.97Å |
| 168 | T | 98.1 | Very high | 98.1 | Very high | 62 Ų | 62 | 90.6 Ų | 90.6 | 38% | 0.38 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.3 | -38.1 | 178.1 | 49.6 | 0 | 0 | 0 | 0 | 112 | R164 D165 I170 E171 E172 | R164-T168 PolarHBondContact O-N 3.3Å; R164-T168 PolarHBondContact O-OG1 2.97Å; D165-T168 WeakPolarHBondContact CA-OG1 3.43Å; D165-T168 PolarHBondContact O-OG1 3.41Å; T168-I170 VanDerWaalsContact C-N 3.31Å; T168-I170 PolarHBondContact O-N 3.12Å; T168-E171 PolarHBondContact O-N 3.4Å; T168-E172 WeakPolarHBondContact O-CG 3.48Å; T168-E172 PolarHBondContact O-N 2.88Å |
| 169 | Q | 98.3 | Very high | 98.1 | Very high | 92 Ų | 92 | 95.9 Ų | 95.9 | 43% | 0.43 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.6 | -32.1 | 174 | -175.4 | 175.1 | 106.8 | 0 | 0 | 112.8 | D165 A166 V167 R173 | D165-Q169 WeakPolarHBondContact O-CB 3.36Å; D165-Q169 PolarHBondContact O-N 2.99Å; A166-Q169 PolarHBondContact O-N 3.43Å; V167-Q169 VanDerWaalsContact C-N 3.31Å; V167-Q169 PolarHBondContact O-N 3.04Å; Q169-R173 WeakPolarHBondContact O-CB 3.26Å; Q169-R173 VanDerWaalsContact O-CG 3.29Å; Q169-R173 WeakPolarHBondContact O-CG 3.31Å; Q169-R173 PolarHBondContact O-N 2.85Å; Q169-R173 VanDerWaalsContact O-N 3.11Å |
| 170 | I | 98.1 | Very high | 98.2 | Very high | 99 Ų | 99 | 95.7 Ų | 95.7 | 51% | 0.508 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -71.2 | -41.6 | 173.7 | -71.2 | 163.9 | 0 | 0 | 0 | 110.5 | A166 V167 T168 R173 T174 | A166-I170 WeakPolarHBondContact O-CD1 3.49Å; A166-I170 VanDerWaalsContact O-CG1 3.28Å; A166-I170 WeakPolarHBondContact O-CG1 3.28Å; A166-I170 PolarHBondContact O-N 2.91Å; V167-I170 WeakPolarHBondContact O-CA 3.49Å; V167-I170 WeakPolarHBondContact O-CB 3.38Å; V167-I170 PolarHBondContact O-N 3.42Å; T168-I170 VanDerWaalsContact C-N 3.31Å; T168-I170 PolarHBondContact O-N 3.12Å; I170-R173 PolarHBondContact O-N 3.4Å; I170-T174 VanDerWaalsContact O-CB 3.26Å; I170-T174 WeakPolarHBondContact O-CB 3.46Å; I170-T174 PolarHBondContact O-N 3.32Å; I170-T174 PolarHBondContact O-OG1 3.01Å |
| 171 | E | 98.2 | Very high | 98.2 | Very high | 122 Ų | 122 | 97.3 Ų | 97.3 | 57% | 0.57 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62 | -46.5 | 175.6 | -69.8 | 175.4 | 159.7 | 0 | 0 | 111.7 | V167 T168 T174 S175 | V167-E171 HydrophobicContact CG1-CG 4.43Å; V167-E171 WeakPolarHBondContact O-CG 3.4Å; V167-E171 PolarHBondContact O-N 2.97Å; T168-E171 PolarHBondContact O-N 3.4Å; E171-T174 PolarHBondContact O-N 3.38Å; E171-S175 WeakPolarHBondContact O-CB 3.39Å; E171-S175 PolarHBondContact O-N 2.68Å |
| 172 | E | 98.3 | Very high | 98.2 | Very high | 137 Ų | 137 | 97.1 Ų | 97.1 | 64% | 0.64 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -58.6 | -49.1 | 175 | -75 | 179.1 | 165.4 | 0 | 0 | 112.2 | T168 T174 S175 A176 | T168-E172 WeakPolarHBondContact O-CG 3.48Å; T168-E172 PolarHBondContact O-N 2.88Å; E172-T174 VanDerWaalsContact C-N 3.34Å; E172-T174 PolarHBondContact O-N 2.95Å; E172-S175 PolarHBondContact O-N 2.84Å; E172-A176 WeakPolarHBondContact O-CB 3.49Å; E172-A176 PolarHBondContact O-N 2.97Å |
| 173 | R | 98.3 | Very high | 98.2 | Very high | 147 Ų | 147 | 97.8 Ų | 97.8 | 56% | 0.555 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.1 | -41.3 | 176.5 | -77.4 | 177.8 | 178.1 | 140.4 | 9.2 | 111.9 | Q169 I170 A176 V177 | Q169-R173 WeakPolarHBondContact O-CB 3.26Å; Q169-R173 VanDerWaalsContact O-CG 3.29Å; Q169-R173 WeakPolarHBondContact O-CG 3.31Å; Q169-R173 PolarHBondContact O-N 2.85Å; Q169-R173 VanDerWaalsContact O-N 3.11Å; I170-R173 PolarHBondContact O-N 3.4Å; R173-A176 PolarHBondContact O-N 2.9Å; R173-V177 WeakPolarHBondContact O-CB 3.32Å; R173-V177 VanDerWaalsContact O-CG2 3.31Å; R173-V177 WeakPolarHBondContact O-CG2 3.48Å; R173-V177 PolarHBondContact O-N 2.96Å |
| 174 | T | 98 | Very high | 98.2 | Very high | 78 Ų | 78 | 98.2 Ų | 98.2 | 48% | 0.479 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.8 | -46.7 | 178.4 | -58.9 | 0 | 0 | 0 | 0 | 110.3 | I170 E171 E172 A176 V177 T178 | I170-T174 VanDerWaalsContact O-CB 3.26Å; I170-T174 WeakPolarHBondContact O-CB 3.46Å; I170-T174 PolarHBondContact O-N 3.32Å; I170-T174 PolarHBondContact O-OG1 3.01Å; E171-T174 PolarHBondContact O-N 3.38Å; E172-T174 VanDerWaalsContact C-N 3.34Å; E172-T174 PolarHBondContact O-N 2.95Å; T174-A176 PolarHBondContact O-N 3.3Å; T174-V177 PolarHBondContact O-N 3.45Å; T174-T178 WeakPolarHBondContact O-CB 3.29Å; T174-T178 PolarHBondContact O-N 3.28Å; T174-T178 PolarHBondContact O-OG1 3.27Å |
| 175 | S | 98.4 | Very high | 98.2 | Very high | 82 Ų | 82 | 93.6 Ų | 93.6 | 57% | 0.573 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -58.1 | -45.5 | 174.7 | -176.4 | 0 | 0 | 0 | 0 | 112.5 | E171 E172 T178 K179 | E171-S175 WeakPolarHBondContact O-CB 3.39Å; E171-S175 PolarHBondContact O-N 2.68Å; E172-S175 PolarHBondContact O-N 2.84Å; S175-T178 PolarHBondContact O-N 3.45Å; S175-K179 WeakPolarHBondContact O-CB 3.28Å; S175-K179 PolarHBondContact O-N 3.48Å |
| 176 | A | 98.3 | Very high | 98.2 | Very high | 61 Ų | 61 | 92.1 Ų | 92.1 | 50% | 0.504 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.8 | -44.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | E172 R173 T174 K179 D180 | E172-A176 WeakPolarHBondContact O-CB 3.49Å; E172-A176 PolarHBondContact O-N 2.97Å; R173-A176 PolarHBondContact O-N 2.9Å; T174-A176 PolarHBondContact O-N 3.3Å; A176-K179 PolarHBondContact O-N 3.11Å; A176-D180 PolarHBondContact O-N 3.35Å |
| 177 | V | 98.2 | Very high | 98.2 | Very high | 97 Ų | 97 | 93 Ų | 93 | 59% | 0.588 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.8 | -42.1 | 176.2 | 169.1 | 0 | 0 | 0 | 0 | 111.4 | R173 T174 K179 D180 F181 | R173-V177 WeakPolarHBondContact O-CB 3.32Å; R173-V177 VanDerWaalsContact O-CG2 3.31Å; R173-V177 WeakPolarHBondContact O-CG2 3.48Å; R173-V177 PolarHBondContact O-N 2.96Å; T174-V177 PolarHBondContact O-N 3.45Å; V177-K179 VanDerWaalsContact C-N 3.3Å; V177-K179 PolarHBondContact O-N 3.01Å; V177-D180 PolarHBondContact O-N 2.97Å; V177-F181 VanDerWaalsContact O-CB 3.31Å; V177-F181 WeakPolarHBondContact O-CB 3.5Å; V177-F181 PolarHBondContact O-N 3.01Å |
| 178 | T | 98.3 | Very high | 98.3 | Very high | 88 Ų | 88 | 94 Ų | 94 | 54% | 0.54 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.5 | -40.1 | 175.1 | -58.1 | 0 | 0 | 0 | 0 | 111.6 | T174 S175 A182 | T174-T178 WeakPolarHBondContact O-CB 3.29Å; T174-T178 PolarHBondContact O-N 3.28Å; T174-T178 PolarHBondContact O-OG1 3.27Å; S175-T178 PolarHBondContact O-N 3.45Å; T178-A182 WeakPolarHBondContact O-CB 3.42Å; T178-A182 PolarHBondContact O-N 3.3Å |
| 179 | K | 98.3 | Very high | 98.3 | Very high | 147 Ų | 147 | 99 Ų | 99 | 64% | 0.639 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -67.9 | -44.6 | 177 | -173.1 | 177 | -180 | 179.7 | 0 | 112.6 | S175 A176 V177 A182 N183 | S175-K179 WeakPolarHBondContact O-CB 3.28Å; S175-K179 PolarHBondContact O-N 3.48Å; A176-K179 PolarHBondContact O-N 3.11Å; V177-K179 VanDerWaalsContact C-N 3.3Å; V177-K179 PolarHBondContact O-N 3.01Å; K179-A182 PolarHBondContact O-N 3.49Å; K179-N183 PolarHBondContact O-N 2.96Å; K179-N183 PolarHBondContact O-ND2 2.67Å |
| 180 | D | 98.3 | Very high | 98.2 | Very high | 70 Ų | 70 | 98.7 Ų | 98.7 | 37% | 0.374 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.4 | -42.3 | 174.7 | 173 | 64.6 | 0 | 0 | 0 | 111.8 | A176 V177 N183 K184 | A176-D180 PolarHBondContact O-N 3.35Å; V177-D180 PolarHBondContact O-N 2.97Å; D180-N183 WeakPolarHBondContact O-CB 3.49Å; D180-N183 PolarHBondContact O-N 3.44Å; D180-K184 VanDerWaalsContact CG-NZ 3.32Å; D180-K184 WeakPolarHBondContact O-CB 3.46Å; D180-K184 WeakPolarHBondContact O-CG 3.5Å; D180-K184 PolarHBondContact O-N 3.37Å; D180-K184 WeakPolarHBondContact OD1-CE 3.42Å; D180-K184 IonicContact OD1-NZ 2.77Å; D180-K184 PolarHBondContact OD1-NZ 3.08Å; D180-K184 WeakPolarHBondContact OD2-CE 3.31Å; D180-K184 IonicContact OD2-NZ 3.77Å; D180-K184 PolarHBondContact OD2-NZ 3.49Å |
| 181 | F | 98.2 | Very high | 98.3 | Very high | 138 Ų | 138 | 97.6 Ų | 97.6 | 61% | 0.605 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.7 | -45.8 | 175.1 | -175.4 | -100.7 | 0 | 0 | 0 | 112.1 | V177 N183 K184 V185 | V177-F181 VanDerWaalsContact O-CB 3.31Å; V177-F181 WeakPolarHBondContact O-CB 3.5Å; V177-F181 PolarHBondContact O-N 3.01Å; F181-N183 VanDerWaalsContact C-N 3.33Å; F181-N183 PolarHBondContact O-N 2.89Å; F181-K184 PolarHBondContact O-N 3.43Å; F181-V185 HydrophobicContact CD1-CG2 4.11Å; F181-V185 HydrophobicContact CE1-CG2 3.71Å; F181-V185 HydrophobicContact CE2-CG2 4.28Å; F181-V185 HydrophobicContact CZ-CG2 3.81Å; F181-V185 WeakPolarHBondContact O-CG2 3.25Å; F181-V185 PolarHBondContact O-N 2.81Å |
| 182 | A | 98 | Very high | 98.3 | Very high | 55 Ų | 55 | 95.1 Ų | 95.1 | 46% | 0.455 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -59.7 | -42.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | T178 K179 V185 S186 | T178-A182 WeakPolarHBondContact O-CB 3.42Å; T178-A182 PolarHBondContact O-N 3.3Å; K179-A182 PolarHBondContact O-N 3.49Å; A182-V185 PolarHBondContact O-N 3Å; A182-S186 PolarHBondContact O-N 3.4Å |
| 183 | N | 98.3 | Very high | 98.2 | Very high | 91 Ų | 91 | 95.1 Ų | 95.1 | 49% | 0.487 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.3 | -47.7 | 174.5 | -69 | -16 | 0 | 0 | 0 | 111.5 | K179 D180 F181 V185 S186 S187 | K179-N183 PolarHBondContact O-N 2.96Å; K179-N183 PolarHBondContact O-ND2 2.67Å; D180-N183 WeakPolarHBondContact O-CB 3.49Å; D180-N183 PolarHBondContact O-N 3.44Å; F181-N183 VanDerWaalsContact C-N 3.33Å; F181-N183 PolarHBondContact O-N 2.89Å; N183-V185 PolarHBondContact O-N 2.87Å; N183-S186 WeakPolarHBondContact O-CA 3.33Å; N183-S186 WeakPolarHBondContact O-CB 3.24Å; N183-S186 PolarHBondContact O-N 2.67Å; N183-S186 VanDerWaalsContact O-N 3.08Å; N183-S186 PolarHBondContact O-OG 3.32Å; N183-S187 PolarHBondContact O-N 3.19Å |
| 184 | K | 98.4 | Very high | 98.2 | Very high | 118 Ų | 118 | 96.5 Ų | 96.5 | 51% | 0.513 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.4 | -42.4 | 178.6 | -76.2 | 169.6 | 177.5 | 164.8 | 0 | 112.5 | D180 F181 S186 S187 V188 | D180-K184 VanDerWaalsContact CG-NZ 3.32Å; D180-K184 WeakPolarHBondContact O-CB 3.46Å; D180-K184 WeakPolarHBondContact O-CG 3.5Å; D180-K184 PolarHBondContact O-N 3.37Å; D180-K184 WeakPolarHBondContact OD1-CE 3.42Å; D180-K184 IonicContact OD1-NZ 2.77Å; D180-K184 PolarHBondContact OD1-NZ 3.08Å; D180-K184 WeakPolarHBondContact OD2-CE 3.31Å; D180-K184 IonicContact OD2-NZ 3.77Å; D180-K184 PolarHBondContact OD2-NZ 3.49Å; F181-K184 PolarHBondContact O-N 3.43Å; K184-S186 VanDerWaalsContact C-N 3.28Å; K184-S186 PolarHBondContact O-N 2.85Å; K184-S187 PolarHBondContact O-N 2.77Å; K184-V188 WeakPolarHBondContact O-CG2 3.14Å; K184-V188 PolarHBondContact O-N 3.19Å |
| 185 | V | 98.5 | Very high | 98.2 | Very high | 74 Ų | 74 | 98.9 Ų | 98.9 | 45% | 0.448 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60 | -38.3 | 172.2 | 170.1 | 0 | 0 | 0 | 0 | 111.2 | F181 A182 N183 R189 | F181-V185 HydrophobicContact CD1-CG2 4.11Å; F181-V185 HydrophobicContact CE1-CG2 3.71Å; F181-V185 HydrophobicContact CE2-CG2 4.28Å; F181-V185 HydrophobicContact CZ-CG2 3.81Å; F181-V185 WeakPolarHBondContact O-CG2 3.25Å; F181-V185 PolarHBondContact O-N 2.81Å; A182-V185 PolarHBondContact O-N 3Å; N183-V185 PolarHBondContact O-N 2.87Å; V185-R189 VanDerWaalsContact O-CB 3.25Å; V185-R189 WeakPolarHBondContact O-CB 3.29Å; V185-R189 PolarHBondContact O-N 2.96Å |
| 186 | S | 98.2 | Very high | 98.1 | Very high | 67 Ų | 67 | 99.5 Ų | 99.5 | 47% | 0.469 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -68 | -35.9 | 175.9 | 82.2 | 0 | 0 | 0 | 0 | 113.4 | A182 N183 K184 T190 | A182-S186 PolarHBondContact O-N 3.4Å; N183-S186 WeakPolarHBondContact O-CA 3.33Å; N183-S186 WeakPolarHBondContact O-CB 3.24Å; N183-S186 PolarHBondContact O-N 2.67Å; N183-S186 VanDerWaalsContact O-N 3.08Å; N183-S186 PolarHBondContact O-OG 3.32Å; K184-S186 VanDerWaalsContact C-N 3.28Å; K184-S186 PolarHBondContact O-N 2.85Å; S186-T190 PolarHBondContact O-N 2.88Å; S186-T190 PolarHBondContact O-OG1 2.88Å |
| 187 | S | 98.4 | Very high | 98.1 | Very high | 62 Ų | 62 | 97.8 Ų | 97.8 | 43% | 0.434 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.6 | -55.6 | 172.6 | -168 | 0 | 0 | 0 | 0 | 110.5 | N183 K184 R189 T190 D191 | N183-S187 PolarHBondContact O-N 3.19Å; K184-S187 PolarHBondContact O-N 2.77Å; S187-R189 PolarHBondContact O-N 2.93Å; S187-T190 CarbonylContact O-C 3.58Å; S187-T190 VanDerWaalsContact O-CA 3.29Å; S187-T190 WeakPolarHBondContact O-CA 3.35Å; S187-T190 VanDerWaalsContact O-CB 3.24Å; S187-T190 WeakPolarHBondContact O-CB 3.41Å; S187-T190 PolarHBondContact O-N 3.2Å; S187-D191 VanDerWaalsContact C-OD2 3.28Å; S187-D191 PolarHBondContact O-N 3.22Å; S187-D191 PolarHBondContact OG-OD2 3.31Å |
| 188 | V | 98.4 | Very high | 98.1 | Very high | 88 Ų | 88 | 97.3 Ų | 97.3 | 53% | 0.533 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -57.4 | -38.1 | -179.9 | 173.3 | 0 | 0 | 0 | 0 | 111.5 | K184 T190 D191 V192 | K184-V188 WeakPolarHBondContact O-CG2 3.14Å; K184-V188 PolarHBondContact O-N 3.19Å; V188-T190 PolarHBondContact O-N 3.39Å; V188-D191 PolarHBondContact O-N 3.24Å; V188-V192 HydrophobicContact CG1-CG2 4.37Å; V188-V192 WeakPolarHBondContact O-CB 3.42Å; V188-V192 VanDerWaalsContact O-CG2 3.29Å; V188-V192 WeakPolarHBondContact O-CG2 3.41Å; V188-V192 PolarHBondContact O-N 3.11Å |
| 189 | R | 98.1 | Very high | 98.1 | Very high | 166 Ų | 166 | 100.5 Ų | 100.5 | 63% | 0.626 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -68.9 | -18.4 | 174.6 | -161.3 | -172.2 | 175.2 | -174.6 | 1.5 | 113.4 | V185 S187 R193 | V185-R189 VanDerWaalsContact O-CB 3.25Å; V185-R189 WeakPolarHBondContact O-CB 3.29Å; V185-R189 PolarHBondContact O-N 2.96Å; S187-R189 PolarHBondContact O-N 2.93Å; R189-R193 WeakPolarHBondContact O-CG 3.4Å; R189-R193 PolarHBondContact O-NH1 3.05Å |
| 190 | T | 98.2 | Very high | 98.1 | Very high | 85 Ų | 85 | 97 Ų | 97 | 52% | 0.521 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -85.4 | -43.4 | 171.6 | -54.3 | 0 | 0 | 0 | 0 | 110.3 | S186 S187 V188 V192 R193 R194 | S186-T190 PolarHBondContact O-N 2.88Å; S186-T190 PolarHBondContact O-OG1 2.88Å; S187-T190 CarbonylContact O-C 3.58Å; S187-T190 VanDerWaalsContact O-CA 3.29Å; S187-T190 WeakPolarHBondContact O-CA 3.35Å; S187-T190 VanDerWaalsContact O-CB 3.24Å; S187-T190 WeakPolarHBondContact O-CB 3.41Å; S187-T190 PolarHBondContact O-N 3.2Å; V188-T190 PolarHBondContact O-N 3.39Å; T190-V192 PolarHBondContact O-N 2.86Å; T190-R193 PolarHBondContact O-N 2.97Å; T190-R194 PolarHBondContact O-N 3.47Å |
| 191 | D | 98.3 | Very high | 98.1 | Very high | 77 Ų | 77 | 99.4 Ų | 99.4 | 41% | 0.412 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61 | -42.8 | 176.2 | -60 | -46.7 | 0 | 0 | 0 | 111.9 | S187 V188 R193 R194 M195 | S187-D191 VanDerWaalsContact C-OD2 3.28Å; S187-D191 PolarHBondContact O-N 3.22Å; S187-D191 PolarHBondContact OG-OD2 3.31Å; V188-D191 PolarHBondContact O-N 3.24Å; D191-R193 PolarHBondContact O-N 3.38Å; D191-R194 CarbonylContact O-C 3.58Å; D191-R194 WeakPolarHBondContact O-CB 3.48Å; D191-R194 PolarHBondContact O-N 3.44Å; D191-R194 VanDerWaalsContact O-N 3.13Å; D191-M195 WeakPolarHBondContact O-CG 3.3Å; D191-M195 PolarHBondContact O-N 2.87Å |
| 192 | V | 98.1 | Very high | 98.1 | Very high | 69 Ų | 69 | 98.2 Ų | 98.2 | 42% | 0.418 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58 | -45.5 | 173.7 | 167.2 | 0 | 0 | 0 | 0 | 111.7 | V188 T190 R194 M195 D196 | V188-V192 HydrophobicContact CG1-CG2 4.37Å; V188-V192 WeakPolarHBondContact O-CB 3.42Å; V188-V192 VanDerWaalsContact O-CG2 3.29Å; V188-V192 WeakPolarHBondContact O-CG2 3.41Å; V188-V192 PolarHBondContact O-N 3.11Å; T190-V192 PolarHBondContact O-N 2.86Å; V192-R194 VanDerWaalsContact C-N 3.29Å; V192-R194 PolarHBondContact O-N 3.21Å; V192-M195 CarbonylContact O-C 3.53Å; V192-M195 WeakPolarHBondContact O-CA 3.5Å; V192-M195 WeakPolarHBondContact O-CB 3.46Å; V192-M195 PolarHBondContact O-N 3.31Å; V192-M195 VanDerWaalsContact O-N 3.11Å; V192-D196 PolarHBondContact O-N 3.44Å |
| 193 | R | 97 | Very high | 98.1 | Very high | 138 Ų | 138 | 99.3 Ų | 99.3 | 52% | 0.521 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.3 | -33.3 | 176.6 | -69.6 | -175.9 | -171.5 | 104.3 | -23.5 | 112.7 | R189 T190 D191 D196 G197 | R189-R193 WeakPolarHBondContact O-CG 3.4Å; R189-R193 PolarHBondContact O-NH1 3.05Å; T190-R193 PolarHBondContact O-N 2.97Å; D191-R193 PolarHBondContact O-N 3.38Å; R193-D196 PolarHBondContact O-N 3.13Å; R193-G197 PolarHBondContact O-N 3.02Å |
| 194 | R | 98.1 | Very high | 98.1 | Very high | 176 Ų | 176 | 97.8 Ų | 97.8 | 66% | 0.664 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66.7 | -39 | 172.9 | -176.6 | 179.9 | 174.1 | 81.2 | 6.5 | 110.8 | T190 D191 V192 G197 L198 | T190-R194 PolarHBondContact O-N 3.47Å; D191-R194 CarbonylContact O-C 3.58Å; D191-R194 WeakPolarHBondContact O-CB 3.48Å; D191-R194 PolarHBondContact O-N 3.44Å; D191-R194 VanDerWaalsContact O-N 3.13Å; V192-R194 VanDerWaalsContact C-N 3.29Å; V192-R194 PolarHBondContact O-N 3.21Å; R194-G197 PolarHBondContact O-N 2.86Å; R194-L198 HydrophobicContact CG-CD1 4.21Å; R194-L198 VanDerWaalsContact O-CG 3.3Å; R194-L198 WeakPolarHBondContact O-CG 3.29Å; R194-L198 PolarHBondContact O-N 3.47Å |
| 195 | M | 97.9 | Very high | 98.1 | Very high | 128 Ų | 128 | 96 Ų | 96 | 63% | 0.631 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -66.6 | -39.2 | 173.5 | -69.7 | 176.5 | 63.9 | 0 | 0 | 112.5 | D191 V192 G197 L198 R199 | D191-M195 WeakPolarHBondContact O-CG 3.3Å; D191-M195 PolarHBondContact O-N 2.87Å; V192-M195 CarbonylContact O-C 3.53Å; V192-M195 WeakPolarHBondContact O-CA 3.5Å; V192-M195 WeakPolarHBondContact O-CB 3.46Å; V192-M195 PolarHBondContact O-N 3.31Å; V192-M195 VanDerWaalsContact O-N 3.11Å; M195-G197 VanDerWaalsContact C-N 3.34Å; M195-L198 PolarHBondContact O-N 3.39Å; M195-R199 WeakPolarHBondContact O-CB 3.35Å; M195-R199 PolarHBondContact O-N 2.99Å |
| 196 | D | 97.4 | Very high | 98.1 | Very high | 94 Ų | 94 | 98.3 Ų | 98.3 | 50% | 0.503 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.4 | -41.6 | 174.1 | -66.5 | -32.4 | 0 | 0 | 0 | 111.4 | V192 R193 R199 S200 | V192-D196 PolarHBondContact O-N 3.44Å; R193-D196 PolarHBondContact O-N 3.13Å; D196-R199 WeakPolarHBondContact O-CB 3.48Å; D196-R199 PolarHBondContact O-N 3.03Å; D196-S200 PolarHBondContact O-N 2.94Å |
| 197 | G | 97.9 | Very high | 98.1 | Very high | 26 Ų | 26 | 99.4 Ų | 99.4 | 27% | 0.268 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -59.8 | -53.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | R193 R194 M195 R199 S200 E201 | R193-G197 PolarHBondContact O-N 3.02Å; R194-G197 PolarHBondContact O-N 2.86Å; M195-G197 VanDerWaalsContact C-N 3.34Å; G197-R199 VanDerWaalsContact C-N 3.25Å; G197-R199 PolarHBondContact O-N 2.98Å; G197-S200 PolarHBondContact O-N 3.39Å; G197-S200 PolarHBondContact O-OG 3.28Å; G197-E201 PolarHBondContact O-N 3.39Å |
| 198 | L | 98.2 | Very high | 98.1 | Very high | 86 Ų | 86 | 101.6 Ų | 101.6 | 45% | 0.45 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.8 | -31.7 | 177.4 | -70.7 | 168.5 | 0 | 0 | 0 | 112.9 | R194 M195 L202 | R194-L198 HydrophobicContact CG-CD1 4.21Å; R194-L198 VanDerWaalsContact O-CG 3.3Å; R194-L198 WeakPolarHBondContact O-CG 3.29Å; R194-L198 PolarHBondContact O-N 3.47Å; M195-L198 PolarHBondContact O-N 3.39Å; L198-L202 WeakPolarHBondContact O-CB 3.36Å; L198-L202 PolarHBondContact O-N 2.71Å |
| 199 | R | 98.4 | Very high | 98.1 | Very high | 155 Ų | 155 | 101.2 Ų | 101.2 | 59% | 0.585 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.1 | -48 | 169.9 | 162.3 | 175.3 | -81.2 | -72.3 | 5.4 | 110.9 | M195 D196 G197 E201 L202 D203 | M195-R199 WeakPolarHBondContact O-CB 3.35Å; M195-R199 PolarHBondContact O-N 2.99Å; D196-R199 WeakPolarHBondContact O-CB 3.48Å; D196-R199 PolarHBondContact O-N 3.03Å; G197-R199 VanDerWaalsContact C-N 3.25Å; G197-R199 PolarHBondContact O-N 2.98Å; R199-E201 VanDerWaalsContact C-N 3.29Å; R199-E201 PolarHBondContact O-N 2.82Å; R199-L202 WeakPolarHBondContact O-CB 3.28Å; R199-L202 PolarHBondContact O-N 3.34Å; R199-L202 VanDerWaalsContact O-N 3.14Å; R199-D203 VanDerWaalsContact CG-OD2 3.28Å; R199-D203 WeakPolarHBondContact CG-OD2 3.39Å; R199-D203 IonicContact NH1-OD1 3.94Å; R199-D203 IonicContact NH1-OD2 3.43Å; R199-D203 WeakPolarHBondContact O-CB 3.35Å; R199-D203 VanDerWaalsContact O-CG 3.27Å; R199-D203 PolarHBondContact O-N 3.26Å |
| 200 | S | 97.9 | Very high | 98.2 | Very high | 73 Ų | 73 | 94.8 Ų | 94.8 | 51% | 0.51 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.8 | -32.6 | 178.9 | 71.8 | 0 | 0 | 0 | 0 | 113.1 | D196 G197 S204 | D196-S200 PolarHBondContact O-N 2.94Å; G197-S200 PolarHBondContact O-N 3.39Å; G197-S200 PolarHBondContact O-OG 3.28Å; S200-S204 WeakPolarHBondContact O-CB 3.49Å; S200-S204 PolarHBondContact O-N 3.28Å; S200-S204 VanDerWaalsContact O-N 3.09Å |
| 201 | E | 98.3 | Very high | 98.2 | Very high | 122 Ų | 122 | 95.8 Ų | 95.8 | 57% | 0.57 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66.2 | -44.6 | 170.4 | -69.4 | 172.8 | -160.5 | 0 | 0 | 111.3 | G197 R199 S204 V205 | G197-E201 PolarHBondContact O-N 3.39Å; R199-E201 VanDerWaalsContact C-N 3.29Å; R199-E201 PolarHBondContact O-N 2.82Å; E201-S204 WeakPolarHBondContact O-CB 3.44Å; E201-S204 PolarHBondContact O-N 3.5Å; E201-V205 WeakPolarHBondContact O-CG2 3.43Å; E201-V205 PolarHBondContact O-N 2.83Å |
| 202 | L | 98.3 | Very high | 98.2 | Very high | 113 Ų | 113 | 97.2 Ų | 97.2 | 59% | 0.592 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.2 | -44.8 | 176.9 | -179.8 | 64.5 | 0 | 0 | 0 | 112.5 | L198 R199 S204 V205 L206 | L198-L202 WeakPolarHBondContact O-CB 3.36Å; L198-L202 PolarHBondContact O-N 2.71Å; R199-L202 WeakPolarHBondContact O-CB 3.28Å; R199-L202 PolarHBondContact O-N 3.34Å; R199-L202 VanDerWaalsContact O-N 3.14Å; L202-S204 VanDerWaalsContact C-N 3.29Å; L202-S204 PolarHBondContact O-N 3.05Å; L202-V205 PolarHBondContact O-N 2.86Å; L202-L206 WeakPolarHBondContact O-CB 3.45Å; L202-L206 PolarHBondContact O-N 2.92Å |
| 203 | D | 98.4 | Very high | 98.2 | Very high | 78 Ų | 78 | 100.9 Ų | 100.9 | 42% | 0.417 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.2 | -35.4 | 178.1 | -66.3 | -32.3 | 0 | 0 | 0 | 110.6 | R199 S207 | R199-D203 VanDerWaalsContact CG-OD2 3.28Å; R199-D203 WeakPolarHBondContact CG-OD2 3.39Å; R199-D203 IonicContact NH1-OD1 3.94Å; R199-D203 IonicContact NH1-OD2 3.43Å; R199-D203 WeakPolarHBondContact O-CB 3.35Å; R199-D203 VanDerWaalsContact O-CG 3.27Å; R199-D203 PolarHBondContact O-N 3.26Å; D203-S207 PolarHBondContact O-N 3.4Å; D203-S207 VanDerWaalsContact O-N 3.12Å |
| 204 | S | 98.4 | Very high | 98.3 | Very high | 59 Ų | 59 | 99.8 Ų | 99.8 | 41% | 0.413 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.7 | -44.6 | 172 | -179.1 | 0 | 0 | 0 | 0 | 112.8 | S200 E201 L202 L206 S207 Q208 | S200-S204 WeakPolarHBondContact O-CB 3.49Å; S200-S204 PolarHBondContact O-N 3.28Å; S200-S204 VanDerWaalsContact O-N 3.09Å; E201-S204 WeakPolarHBondContact O-CB 3.44Å; E201-S204 PolarHBondContact O-N 3.5Å; L202-S204 VanDerWaalsContact C-N 3.29Å; L202-S204 PolarHBondContact O-N 3.05Å; S204-L206 VanDerWaalsContact C-N 3.34Å; S204-L206 PolarHBondContact O-N 3.33Å; S204-S207 WeakPolarHBondContact O-CB 3.47Å; S204-S207 PolarHBondContact O-N 3.44Å; S204-Q208 WeakPolarHBondContact O-CG 3.5Å; S204-Q208 PolarHBondContact O-N 3.09Å; S204-Q208 PolarHBondContact OG-NE2 3.08Å |
| 205 | V | 98.3 | Very high | 98.3 | Very high | 79 Ų | 79 | 95.9 Ų | 95.9 | 48% | 0.479 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.1 | -40.9 | 175.4 | 169.2 | 0 | 0 | 0 | 0 | 111 | E201 L202 S207 Q208 V209 | E201-V205 WeakPolarHBondContact O-CG2 3.43Å; E201-V205 PolarHBondContact O-N 2.83Å; L202-V205 PolarHBondContact O-N 2.86Å; V205-S207 VanDerWaalsContact C-N 3.32Å; V205-S207 PolarHBondContact O-N 3Å; V205-Q208 PolarHBondContact O-N 3.11Å; V205-V209 HydrophobicContact CG1-CG2 4.44Å; V205-V209 WeakPolarHBondContact O-CG2 3.31Å; V205-V209 PolarHBondContact O-N 3.36Å |
| 206 | L | 98.6 | Very high | 98.3 | Very high | 124 Ų | 124 | 93.4 Ų | 93.4 | 65% | 0.649 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -59 | -43.5 | 175.6 | -165.4 | 79.1 | 0 | 0 | 0 | 111.4 | L202 S204 Q208 V209 G210 | L202-L206 WeakPolarHBondContact O-CB 3.45Å; L202-L206 PolarHBondContact O-N 2.92Å; S204-L206 VanDerWaalsContact C-N 3.34Å; S204-L206 PolarHBondContact O-N 3.33Å; L206-Q208 PolarHBondContact O-N 3.49Å; L206-V209 PolarHBondContact O-N 3.14Å; L206-G210 PolarHBondContact O-N 2.6Å; L206-G210 VanDerWaalsContact O-N 3.08Å |
| 207 | S | 98.3 | Very high | 98.3 | Very high | 89 Ų | 89 | 89.9 Ų | 89.9 | 62% | 0.622 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -63.4 | -38.5 | 175.8 | -169 | 0 | 0 | 0 | 0 | 112.8 | D203 S204 V205 G210 E211 | D203-S207 PolarHBondContact O-N 3.4Å; D203-S207 VanDerWaalsContact O-N 3.12Å; S204-S207 WeakPolarHBondContact O-CB 3.47Å; S204-S207 PolarHBondContact O-N 3.44Å; V205-S207 VanDerWaalsContact C-N 3.32Å; V205-S207 PolarHBondContact O-N 3Å; S207-G210 PolarHBondContact O-N 3.18Å; S207-E211 PolarHBondContact O-N 3.49Å; S207-E211 VanDerWaalsContact O-N 3.11Å |
| 208 | Q | 98.3 | Very high | 98.4 | Very high | 108 Ų | 108 | 94.9 Ų | 94.9 | 51% | 0.505 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -70.1 | -36.2 | 177.3 | -69.8 | 172.4 | 42.4 | 0 | 0 | 112.2 | S204 V205 L206 E211 L212 | S204-Q208 WeakPolarHBondContact O-CG 3.5Å; S204-Q208 PolarHBondContact O-N 3.09Å; S204-Q208 PolarHBondContact OG-NE2 3.08Å; V205-Q208 PolarHBondContact O-N 3.11Å; L206-Q208 PolarHBondContact O-N 3.49Å; Q208-E211 PolarHBondContact O-N 3.12Å; Q208-L212 WeakPolarHBondContact O-CB 3.5Å; Q208-L212 VanDerWaalsContact O-CG 3.31Å; Q208-L212 WeakPolarHBondContact O-CG 3.15Å; Q208-L212 PolarHBondContact O-N 3.42Å |
| 209 | V | 98.5 | Very high | 98.4 | Very high | 81 Ų | 81 | 94.1 Ų | 94.1 | 49% | 0.491 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63 | -44.7 | 173.8 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | V205 L206 E211 L212 E213 | V205-V209 HydrophobicContact CG1-CG2 4.44Å; V205-V209 WeakPolarHBondContact O-CG2 3.31Å; V205-V209 PolarHBondContact O-N 3.36Å; L206-V209 PolarHBondContact O-N 3.14Å; V209-E211 PolarHBondContact O-N 3.39Å; V209-L212 PolarHBondContact O-N 3.48Å; V209-E213 PolarHBondContact O-N 2.9Å |
| 210 | G | 98.5 | Very high | 98.4 | Very high | 30 Ų | 30 | 92.5 Ų | 92.5 | 31% | 0.309 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.5 | -43.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | L206 S207 L212 E213 D214 | L206-G210 PolarHBondContact O-N 2.6Å; L206-G210 VanDerWaalsContact O-N 3.08Å; S207-G210 PolarHBondContact O-N 3.18Å; G210-L212 VanDerWaalsContact C-N 3.3Å; G210-L212 PolarHBondContact O-N 3.22Å; G210-E213 PolarHBondContact O-N 2.93Å; G210-D214 PolarHBondContact O-N 3.21Å |
| 211 | E | 98.4 | Very high | 98.4 | Very high | 106 Ų | 106 | 96.8 Ų | 96.8 | 50% | 0.495 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.3 | -34.2 | 176.3 | -159.6 | -163.5 | 163.1 | 0 | 0 | 112.4 | S207 Q208 V209 K215 | S207-E211 PolarHBondContact O-N 3.49Å; S207-E211 VanDerWaalsContact O-N 3.11Å; Q208-E211 PolarHBondContact O-N 3.12Å; V209-E211 PolarHBondContact O-N 3.39Å; E211-K215 HydrophobicContact CG-CD 4.49Å; E211-K215 WeakPolarHBondContact O-CB 3.21Å; E211-K215 WeakPolarHBondContact O-CD 3.33Å; E211-K215 WeakPolarHBondContact O-CG 3.36Å; E211-K215 PolarHBondContact O-N 3.08Å; E211-K215 VanDerWaalsContact O-N 3.08Å; E211-K215 WeakPolarHBondContact OE1-CE 3.39Å; E211-K215 IonicContact OE1-NZ 3.19Å; E211-K215 PolarHBondContact OE1-NZ 3.27Å; E211-K215 IonicContact OE2-NZ 2.67Å |
| 212 | L | 98.4 | Very high | 98.4 | Very high | 107 Ų | 107 | 93.6 Ų | 93.6 | 56% | 0.56 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -71.6 | -36 | 174.2 | -73.5 | 169.4 | 0 | 0 | 0 | 112.5 | Q208 V209 G210 T216 | Q208-L212 WeakPolarHBondContact O-CB 3.5Å; Q208-L212 VanDerWaalsContact O-CG 3.31Å; Q208-L212 WeakPolarHBondContact O-CG 3.15Å; Q208-L212 PolarHBondContact O-N 3.42Å; V209-L212 PolarHBondContact O-N 3.48Å; G210-L212 VanDerWaalsContact C-N 3.3Å; G210-L212 PolarHBondContact O-N 3.22Å; L212-T216 WeakPolarHBondContact O-CB 3.41Å; L212-T216 PolarHBondContact O-N 2.97Å; L212-T216 PolarHBondContact O-OG1 2.7Å |
| 213 | E | 98.5 | Very high | 98.4 | Very high | 146 Ų | 146 | 93.3 Ų | 93.3 | 68% | 0.682 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.6 | -48.8 | 174 | -171.3 | 173.9 | 178.3 | 0 | 0 | 111 | V209 G210 K215 T216 G217 | V209-E213 PolarHBondContact O-N 2.9Å; G210-E213 PolarHBondContact O-N 2.93Å; E213-K215 PolarHBondContact O-N 2.86Å; E213-T216 PolarHBondContact O-N 3.31Å; E213-T216 VanDerWaalsContact O-N 3.15Å; E213-G217 PolarHBondContact O-N 3.48Å |
| 214 | D | 98.4 | Very high | 98.4 | Very high | 115 Ų | 115 | 94.7 Ų | 94.7 | 62% | 0.615 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -57.7 | -46 | 175.4 | -101.5 | -32.2 | 0 | 0 | 0 | 112.2 | G210 G217 Q218 | G210-D214 PolarHBondContact O-N 3.21Å; D214-G217 PolarHBondContact O-N 2.91Å; D214-Q218 WeakPolarHBondContact O-CB 3.35Å; D214-Q218 PolarHBondContact O-N 3.07Å |
| 215 | K | 98.3 | Very high | 98.4 | Very high | 94 Ų | 94 | 98.5 Ų | 98.5 | 41% | 0.409 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.9 | -42 | 175.2 | -77.6 | 168.8 | -177.2 | 167.2 | 0 | 111.9 | E211 E213 Q218 V219 | E211-K215 HydrophobicContact CG-CD 4.49Å; E211-K215 WeakPolarHBondContact O-CB 3.21Å; E211-K215 WeakPolarHBondContact O-CD 3.33Å; E211-K215 WeakPolarHBondContact O-CG 3.36Å; E211-K215 PolarHBondContact O-N 3.08Å; E211-K215 VanDerWaalsContact O-N 3.08Å; E211-K215 WeakPolarHBondContact OE1-CE 3.39Å; E211-K215 IonicContact OE1-NZ 3.19Å; E211-K215 PolarHBondContact OE1-NZ 3.27Å; E211-K215 IonicContact OE2-NZ 2.67Å; E213-K215 PolarHBondContact O-N 2.86Å; K215-Q218 PolarHBondContact O-N 2.87Å; K215-V219 WeakPolarHBondContact O-CG2 3.43Å; K215-V219 PolarHBondContact O-N 3.15Å |
| 216 | T | 98.2 | Very high | 98.4 | Very high | 77 Ų | 77 | 103.3 Ų | 103.3 | 47% | 0.472 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.3 | -51.4 | 178 | -59.1 | 0 | 0 | 0 | 0 | 110.2 | L212 E213 Q218 V219 E220 | L212-T216 WeakPolarHBondContact O-CB 3.41Å; L212-T216 PolarHBondContact O-N 2.97Å; L212-T216 PolarHBondContact O-OG1 2.7Å; E213-T216 PolarHBondContact O-N 3.31Å; E213-T216 VanDerWaalsContact O-N 3.15Å; T216-Q218 VanDerWaalsContact C-N 3.27Å; T216-Q218 PolarHBondContact O-N 2.87Å; T216-V219 PolarHBondContact O-N 3Å; T216-E220 WeakPolarHBondContact O-CG 3.37Å; T216-E220 PolarHBondContact O-N 3.41Å |
| 217 | G | 98.4 | Very high | 98.4 | Very high | 19 Ų | 19 | 102.7 Ų | 102.7 | 20% | 0.196 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -62.2 | -30.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | E213 D214 R221 | E213-G217 PolarHBondContact O-N 3.48Å; D214-G217 PolarHBondContact O-N 2.91Å; G217-R221 WeakPolarHBondContact O-CB 3.42Å; G217-R221 VanDerWaalsContact O-CG 3.25Å; G217-R221 WeakPolarHBondContact O-CG 3.25Å; G217-R221 PolarHBondContact O-N 2.91Å; G217-R221 VanDerWaalsContact O-N 3.14Å; G217-R221 PolarHBondContact O-NE 3.14Å |
| 218 | Q | 98.4 | Very high | 98.4 | Very high | 132 Ų | 132 | 100.4 Ų | 100.4 | 62% | 0.617 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -67.4 | -46 | 170.9 | -171.2 | -175.1 | 20 | 0 | 0 | 111.7 | D214 K215 T216 S222 | D214-Q218 WeakPolarHBondContact O-CB 3.35Å; D214-Q218 PolarHBondContact O-N 3.07Å; K215-Q218 PolarHBondContact O-N 2.87Å; T216-Q218 VanDerWaalsContact C-N 3.27Å; T216-Q218 PolarHBondContact O-N 2.87Å; Q218-S222 WeakPolarHBondContact O-CB 3.38Å; Q218-S222 PolarHBondContact O-N 3.08Å |
| 219 | V | 98.3 | Very high | 98.4 | Very high | 70 Ų | 70 | 99.7 Ų | 99.7 | 42% | 0.424 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61 | -49.1 | 177.3 | 169.2 | 0 | 0 | 0 | 0 | 110.4 | K215 T216 R221 S222 M223 | K215-V219 WeakPolarHBondContact O-CG2 3.43Å; K215-V219 PolarHBondContact O-N 3.15Å; T216-V219 PolarHBondContact O-N 3Å; V219-R221 PolarHBondContact O-N 3.11Å; V219-S222 CarbonylContact O-C 3.58Å; V219-S222 WeakPolarHBondContact O-CB 3.25Å; V219-S222 PolarHBondContact O-N 2.84Å; V219-S222 VanDerWaalsContact O-N 3.11Å; V219-S222 PolarHBondContact O-OG 3.5Å; V219-M223 HydrophobicContact CG1-CE 3.72Å; V219-M223 HydrophobicContact CG1-CG 4.29Å; V219-M223 HydrophobicContact CG1-SD 4.05Å; V219-M223 WeakPolarHBondContact O-CG 3.4Å; V219-M223 PolarHBondContact O-N 2.85Å |
| 220 | E | 98.6 | Very high | 98.4 | Very high | 120 Ų | 120 | 100.9 Ų | 100.9 | 56% | 0.561 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -55.9 | -52.8 | 177.1 | -72.3 | -179.9 | 164 | 0 | 0 | 112.1 | T216 S222 M223 V224 | T216-E220 WeakPolarHBondContact O-CG 3.37Å; T216-E220 PolarHBondContact O-N 3.41Å; E220-S222 PolarHBondContact O-N 2.73Å; E220-M223 PolarHBondContact O-N 3.13Å; E220-M223 VanDerWaalsContact O-N 3.08Å; E220-V224 WeakPolarHBondContact O-CG2 3.49Å; E220-V224 PolarHBondContact O-N 3.25Å |
| 221 | R | 98.5 | Very high | 98.4 | Very high | 164 Ų | 164 | 104.8 Ų | 104.8 | 62% | 0.619 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -56.1 | -38.7 | 176 | -75.5 | 175.5 | -72.3 | -174.8 | -4.3 | 111.9 | G217 V219 K225 | G217-R221 WeakPolarHBondContact O-CB 3.42Å; G217-R221 VanDerWaalsContact O-CG 3.25Å; G217-R221 WeakPolarHBondContact O-CG 3.25Å; G217-R221 PolarHBondContact O-N 2.91Å; G217-R221 VanDerWaalsContact O-N 3.14Å; G217-R221 PolarHBondContact O-NE 3.14Å; V219-R221 PolarHBondContact O-N 3.11Å; R221-K225 WeakPolarHBondContact O-CB 3.41Å; R221-K225 PolarHBondContact O-N 2.8Å; R221-K225 VanDerWaalsContact O-N 3.13Å |
| 222 | S | 98.4 | Very high | 98.4 | Very high | 54 Ų | 54 | 101.3 Ų | 101.3 | 38% | 0.378 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -70.8 | -35.9 | 177.1 | 85.2 | 0 | 0 | 0 | 0 | 113.3 | Q218 V219 E220 R226 | Q218-S222 WeakPolarHBondContact O-CB 3.38Å; Q218-S222 PolarHBondContact O-N 3.08Å; V219-S222 CarbonylContact O-C 3.58Å; V219-S222 WeakPolarHBondContact O-CB 3.25Å; V219-S222 PolarHBondContact O-N 2.84Å; V219-S222 VanDerWaalsContact O-N 3.11Å; V219-S222 PolarHBondContact O-OG 3.5Å; E220-S222 PolarHBondContact O-N 2.73Å; S222-R226 WeakPolarHBondContact O-CB 3.47Å; S222-R226 VanDerWaalsContact O-CG 3.25Å; S222-R226 WeakPolarHBondContact O-CG 3.47Å; S222-R226 PolarHBondContact O-N 3.01Å |
| 223 | M | 97.9 | Very high | 98.4 | Very high | 108 Ų | 108 | 99.1 Ų | 99.1 | 53% | 0.532 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -71.7 | -47.2 | 177.3 | -74.8 | -173.7 | 174.4 | 0 | 0 | 111 | V219 E220 K225 R226 I227 | V219-M223 HydrophobicContact CG1-CE 3.72Å; V219-M223 HydrophobicContact CG1-CG 4.29Å; V219-M223 HydrophobicContact CG1-SD 4.05Å; V219-M223 WeakPolarHBondContact O-CG 3.4Å; V219-M223 PolarHBondContact O-N 2.85Å; E220-M223 PolarHBondContact O-N 3.13Å; E220-M223 VanDerWaalsContact O-N 3.08Å; M223-K225 VanDerWaalsContact C-N 3.28Å; M223-K225 PolarHBondContact O-N 3.08Å; M223-R226 PolarHBondContact O-N 3.38Å; M223-I227 WeakPolarHBondContact O-CB 3.44Å; M223-I227 VanDerWaalsContact O-CG1 3.26Å; M223-I227 WeakPolarHBondContact O-CG1 3.44Å; M223-I227 PolarHBondContact O-N 3.07Å |
| 224 | V | 98.6 | Very high | 98.3 | Very high | 107 Ų | 107 | 94.5 Ų | 94.5 | 65% | 0.648 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -55.9 | -44.9 | 175.1 | 171.3 | 0 | 0 | 0 | 0 | 110.5 | E220 G228 | E220-V224 WeakPolarHBondContact O-CG2 3.49Å; E220-V224 PolarHBondContact O-N 3.25Å; V224-G228 PolarHBondContact O-N 3.31Å |
| 225 | K | 98.4 | Very high | 98.3 | Very high | 138 Ų | 138 | 93.3 Ų | 93.3 | 60% | 0.6 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61 | -52.7 | 174.2 | -178.4 | 173.8 | 177.8 | 179.2 | 0 | 112.2 | R221 M223 I227 G228 D229 | R221-K225 WeakPolarHBondContact O-CB 3.41Å; R221-K225 PolarHBondContact O-N 2.8Å; R221-K225 VanDerWaalsContact O-N 3.13Å; M223-K225 VanDerWaalsContact C-N 3.28Å; M223-K225 PolarHBondContact O-N 3.08Å; K225-I227 VanDerWaalsContact C-N 3.29Å; K225-I227 PolarHBondContact O-N 2.95Å; K225-G228 WeakPolarHBondContact O-CA 3.49Å; K225-G228 PolarHBondContact O-N 2.84Å; K225-G228 VanDerWaalsContact O-N 3.07Å; K225-D229 WeakPolarHBondContact CE-OD2 3.42Å; K225-D229 WeakPolarHBondContact CG-OD2 3.26Å; K225-D229 VanDerWaalsContact O-CG 3.28Å; K225-D229 PolarHBondContact O-N 3.44Å |
| 226 | R | 98.3 | Very high | 98.4 | Very high | 180 Ų | 180 | 93.7 Ų | 93.7 | 68% | 0.679 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -57.9 | -39.7 | -179.7 | -76.6 | 169.2 | 176.8 | -114.1 | 3 | 112.6 | S222 M223 V230 | S222-R226 WeakPolarHBondContact O-CB 3.47Å; S222-R226 VanDerWaalsContact O-CG 3.25Å; S222-R226 WeakPolarHBondContact O-CG 3.47Å; S222-R226 PolarHBondContact O-N 3.01Å; M223-R226 PolarHBondContact O-N 3.38Å; R226-V230 WeakPolarHBondContact O-CB 3.3Å; R226-V230 VanDerWaalsContact O-CG2 3.3Å; R226-V230 WeakPolarHBondContact O-CG2 3.47Å; R226-V230 PolarHBondContact O-N 2.84Å; R226-V230 VanDerWaalsContact O-N 3.08Å |
| 227 | I | 98.1 | Very high | 98.4 | Very high | 112 Ų | 112 | 98.7 Ų | 98.7 | 57% | 0.574 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.3 | -45.8 | 175.6 | -68.8 | 165.2 | 0 | 0 | 0 | 109.7 | M223 K225 V230 L231 | M223-I227 WeakPolarHBondContact O-CB 3.44Å; M223-I227 VanDerWaalsContact O-CG1 3.26Å; M223-I227 WeakPolarHBondContact O-CG1 3.44Å; M223-I227 PolarHBondContact O-N 3.07Å; K225-I227 VanDerWaalsContact C-N 3.29Å; K225-I227 PolarHBondContact O-N 2.95Å; I227-V230 PolarHBondContact O-N 3.36Å; I227-L231 VanDerWaalsContact O-CB 3.27Å; I227-L231 WeakPolarHBondContact O-CB 3.43Å; I227-L231 PolarHBondContact O-N 2.86Å |
| 228 | G | 98.6 | Very high | 98.4 | Very high | 41 Ų | 41 | 102.8 Ų | 102.8 | 42% | 0.423 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -58.5 | -47.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | V224 K225 V230 L231 G232 | V224-G228 PolarHBondContact O-N 3.31Å; K225-G228 WeakPolarHBondContact O-CA 3.49Å; K225-G228 PolarHBondContact O-N 2.84Å; K225-G228 VanDerWaalsContact O-N 3.07Å; G228-V230 PolarHBondContact O-N 3.07Å; G228-L231 PolarHBondContact O-N 3.18Å; G228-G232 PolarHBondContact O-N 3.26Å |
| 229 | D | 98.4 | Very high | 98.3 | Very high | 93 Ų | 93 | 99.7 Ų | 99.7 | 50% | 0.497 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.4 | -44.4 | 178.2 | -65.2 | -25.8 | 0 | 0 | 0 | 111.1 | K225 S233 | K225-D229 WeakPolarHBondContact CE-OD2 3.42Å; K225-D229 WeakPolarHBondContact CG-OD2 3.26Å; K225-D229 VanDerWaalsContact O-CG 3.28Å; K225-D229 PolarHBondContact O-N 3.44Å; D229-S233 WeakPolarHBondContact O-CB 3.39Å; D229-S233 PolarHBondContact O-N 2.85Å; D229-S233 VanDerWaalsContact O-N 3.07Å |
| 230 | V | 98.4 | Very high | 98.4 | Very high | 105 Ų | 105 | 101.4 Ų | 101.4 | 64% | 0.636 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -68.4 | -40.5 | 176.8 | 169.6 | 0 | 0 | 0 | 0 | 111.9 | R226 I227 G228 S234 | R226-V230 WeakPolarHBondContact O-CB 3.3Å; R226-V230 VanDerWaalsContact O-CG2 3.3Å; R226-V230 WeakPolarHBondContact O-CG2 3.47Å; R226-V230 PolarHBondContact O-N 2.84Å; R226-V230 VanDerWaalsContact O-N 3.08Å; I227-V230 PolarHBondContact O-N 3.36Å; G228-V230 PolarHBondContact O-N 3.07Å; V230-S234 WeakPolarHBondContact O-CB 3.38Å; V230-S234 PolarHBondContact O-N 2.81Å |
| 231 | L | 98.3 | Very high | 98.3 | Very high | 113 Ų | 113 | 101.5 Ų | 101.5 | 59% | 0.592 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -68.7 | -41.6 | -179.4 | -154.9 | 75.4 | 0 | 0 | 0 | 111.2 | I227 G228 S234 V235 | I227-L231 VanDerWaalsContact O-CB 3.27Å; I227-L231 WeakPolarHBondContact O-CB 3.43Å; I227-L231 PolarHBondContact O-N 2.86Å; G228-L231 PolarHBondContact O-N 3.18Å; L231-S234 WeakPolarHBondContact O-CB 3.27Å; L231-S234 PolarHBondContact O-N 2.93Å; L231-V235 WeakPolarHBondContact O-CG2 3.25Å; L231-V235 PolarHBondContact O-N 3.39Å |
| 232 | G | 98.4 | Very high | 98.3 | Very high | 32 Ų | 32 | 102.9 Ų | 102.9 | 33% | 0.33 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -59 | -51.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | G228 S234 V235 D236 | G228-G232 PolarHBondContact O-N 3.26Å; G232-S234 PolarHBondContact O-N 2.93Å; G232-V235 WeakPolarHBondContact O-CB 3.45Å; G232-V235 PolarHBondContact O-N 3.25Å; G232-D236 PolarHBondContact O-N 3.5Å |
| 233 | S | 98.3 | Very high | 98.3 | Very high | 62 Ų | 62 | 102.8 Ų | 102.8 | 43% | 0.434 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -58.5 | -34.5 | 175.6 | -173.5 | 0 | 0 | 0 | 0 | 112.9 | D229 R237 | D229-S233 WeakPolarHBondContact O-CB 3.39Å; D229-S233 PolarHBondContact O-N 2.85Å; D229-S233 VanDerWaalsContact O-N 3.07Å; S233-R237 WeakPolarHBondContact O-CB 3.34Å; S233-R237 WeakPolarHBondContact O-CD 3.4Å; S233-R237 WeakPolarHBondContact O-CG 3.46Å; S233-R237 PolarHBondContact O-N 2.93Å |
| 234 | S | 98.2 | Very high | 98.3 | Very high | 49 Ų | 49 | 99 Ų | 99 | 34% | 0.343 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.2 | -46 | 173.5 | -165.6 | 0 | 0 | 0 | 0 | 112 | V230 L231 G232 D236 R237 I238 | V230-S234 WeakPolarHBondContact O-CB 3.38Å; V230-S234 PolarHBondContact O-N 2.81Å; L231-S234 WeakPolarHBondContact O-CB 3.27Å; L231-S234 PolarHBondContact O-N 2.93Å; G232-S234 PolarHBondContact O-N 2.93Å; S234-D236 PolarHBondContact O-N 3.05Å; S234-R237 PolarHBondContact O-N 3.46Å; S234-I238 WeakPolarHBondContact O-CB 3.42Å; S234-I238 VanDerWaalsContact O-CG1 3.26Å; S234-I238 WeakPolarHBondContact O-CG1 3.49Å; S234-I238 PolarHBondContact O-N 2.83Å |
| 235 | V | 98.4 | Very high | 98.3 | Very high | 89 Ų | 89 | 97.1 Ų | 97.1 | 54% | 0.539 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.3 | -45 | 175.6 | 169.7 | 0 | 0 | 0 | 0 | 111.3 | L231 G232 R237 I238 S239 | L231-V235 WeakPolarHBondContact O-CG2 3.25Å; L231-V235 PolarHBondContact O-N 3.39Å; G232-V235 WeakPolarHBondContact O-CB 3.45Å; G232-V235 PolarHBondContact O-N 3.25Å; V235-R237 PolarHBondContact O-N 3.28Å; V235-I238 PolarHBondContact O-N 2.93Å; V235-S239 WeakPolarHBondContact O-CB 3.18Å; V235-S239 PolarHBondContact O-N 2.89Å |
| 236 | D | 98.4 | Very high | 98.3 | Very high | 103 Ų | 103 | 95.1 Ų | 95.1 | 55% | 0.551 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.2 | -43.3 | 176.5 | -70.7 | -31.1 | 0 | 0 | 0 | 111.9 | G232 S234 S239 N240 | G232-D236 PolarHBondContact O-N 3.5Å; S234-D236 PolarHBondContact O-N 3.05Å; D236-S239 PolarHBondContact O-N 3.23Å; D236-N240 WeakPolarHBondContact O-CB 3.39Å; D236-N240 PolarHBondContact O-N 3.29Å; D236-N240 PolarHBondContact O-ND2 2.9Å |
| 237 | R | 98.3 | Very high | 98.3 | Very high | 182 Ų | 182 | 93.6 Ų | 93.6 | 69% | 0.687 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.9 | -41.2 | 176.7 | -74 | 170.2 | 66.6 | -158.1 | -0.6 | 112 | S233 S234 V235 L241 | S233-R237 WeakPolarHBondContact O-CB 3.34Å; S233-R237 WeakPolarHBondContact O-CD 3.4Å; S233-R237 WeakPolarHBondContact O-CG 3.46Å; S233-R237 PolarHBondContact O-N 2.93Å; S234-R237 PolarHBondContact O-N 3.46Å; V235-R237 PolarHBondContact O-N 3.28Å; R237-L241 VanDerWaalsContact O-CB 3.25Å; R237-L241 WeakPolarHBondContact O-CB 3.26Å; R237-L241 PolarHBondContact O-N 3.03Å |
| 238 | I | 98.3 | Very high | 98.3 | Very high | 105 Ų | 105 | 93 Ų | 93 | 54% | 0.538 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.9 | -41.3 | 176.1 | -70.1 | 164.8 | 0 | 0 | 0 | 110.8 | S234 V235 L241 R242 | S234-I238 WeakPolarHBondContact O-CB 3.42Å; S234-I238 VanDerWaalsContact O-CG1 3.26Å; S234-I238 WeakPolarHBondContact O-CG1 3.49Å; S234-I238 PolarHBondContact O-N 2.83Å; V235-I238 PolarHBondContact O-N 2.93Å; I238-L241 PolarHBondContact O-N 3.39Å; I238-R242 WeakPolarHBondContact O-CB 3.39Å; I238-R242 PolarHBondContact O-N 2.96Å |
| 239 | S | 98.4 | Very high | 98.3 | Very high | 66 Ų | 66 | 94.4 Ų | 94.4 | 46% | 0.462 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.9 | -51.6 | 175.9 | -171.6 | 0 | 0 | 0 | 0 | 111.3 | V235 D236 L241 R242 S243 | V235-S239 WeakPolarHBondContact O-CB 3.18Å; V235-S239 PolarHBondContact O-N 2.89Å; D236-S239 PolarHBondContact O-N 3.23Å; S239-L241 VanDerWaalsContact C-N 3.35Å; S239-L241 PolarHBondContact O-N 3.41Å; S239-R242 WeakPolarHBondContact O-CB 3.45Å; S239-R242 PolarHBondContact O-N 2.85Å; S239-R242 VanDerWaalsContact O-N 3.15Å; S239-S243 PolarHBondContact O-N 2.93Å; S239-S243 PolarHBondContact O-OG 3.44Å |
| 240 | N | 98.4 | Very high | 98.3 | Very high | 106 Ų | 106 | 95.4 Ų | 95.4 | 57% | 0.567 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -59.9 | -41.8 | 176.4 | -79.8 | -68.2 | 0 | 0 | 0 | 112.7 | D236 S243 A244 | D236-N240 WeakPolarHBondContact O-CB 3.39Å; D236-N240 PolarHBondContact O-N 3.29Å; D236-N240 PolarHBondContact O-ND2 2.9Å; N240-S243 PolarHBondContact O-N 3.15Å; N240-A244 WeakPolarHBondContact O-CB 3.37Å; N240-A244 PolarHBondContact O-N 2.87Å |
| 241 | L | 98.3 | Very high | 98.3 | Very high | 123 Ų | 123 | 92.5 Ų | 92.5 | 64% | 0.644 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.7 | -39.4 | 175.8 | -178.7 | 61.7 | 0 | 0 | 0 | 111.9 | R237 I238 S239 A244 S245 | R237-L241 VanDerWaalsContact O-CB 3.25Å; R237-L241 WeakPolarHBondContact O-CB 3.26Å; R237-L241 PolarHBondContact O-N 3.03Å; I238-L241 PolarHBondContact O-N 3.39Å; S239-L241 VanDerWaalsContact C-N 3.35Å; S239-L241 PolarHBondContact O-N 3.41Å; L241-A244 PolarHBondContact O-N 3.16Å; L241-S245 WeakPolarHBondContact O-CB 3.33Å; L241-S245 PolarHBondContact O-N 3.31Å |
| 242 | R | 98.3 | Very high | 98.3 | Very high | 192 Ų | 192 | 91.2 Ų | 91.2 | 73% | 0.725 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.1 | -47.2 | 175.2 | -175.7 | 176 | -178.9 | 149.5 | 1.2 | 111.3 | I238 S239 A244 S245 E246 | I238-R242 WeakPolarHBondContact O-CB 3.39Å; I238-R242 PolarHBondContact O-N 2.96Å; S239-R242 WeakPolarHBondContact O-CB 3.45Å; S239-R242 PolarHBondContact O-N 2.85Å; S239-R242 VanDerWaalsContact O-N 3.15Å; R242-A244 VanDerWaalsContact C-N 3.3Å; R242-A244 PolarHBondContact O-N 3.3Å; R242-S245 PolarHBondContact O-N 3.37Å; R242-E246 PolarHBondContact O-N 3.33Å |
| 243 | S | 98.3 | Very high | 98.2 | Very high | 53 Ų | 53 | 92.6 Ų | 92.6 | 37% | 0.371 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.5 | -31.1 | 175.8 | -58 | 0 | 0 | 0 | 0 | 113.2 | S239 N240 R247 | S239-S243 PolarHBondContact O-N 2.93Å; S239-S243 PolarHBondContact O-OG 3.44Å; N240-S243 PolarHBondContact O-N 3.15Å; S243-R247 WeakPolarHBondContact O-CG 3.42Å; S243-R247 PolarHBondContact O-N 3.42Å; S243-R247 PolarHBondContact O-NE 3.12Å; S243-R247 VanDerWaalsContact O-NE 3.16Å |
| 244 | A | 98.2 | Very high | 98.2 | Very high | 27 Ų | 27 | 96 Ų | 96 | 22% | 0.223 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -70.5 | -44.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | N240 L241 R242 E246 R247 N248 | N240-A244 WeakPolarHBondContact O-CB 3.37Å; N240-A244 PolarHBondContact O-N 2.87Å; L241-A244 PolarHBondContact O-N 3.16Å; R242-A244 VanDerWaalsContact C-N 3.3Å; R242-A244 PolarHBondContact O-N 3.3Å; A244-E246 PolarHBondContact O-N 3.18Å; A244-R247 PolarHBondContact O-N 3.5Å; A244-N248 VanDerWaalsContact O-CG 3.29Å; A244-N248 PolarHBondContact O-N 3.4Å; A244-N248 PolarHBondContact O-OD1 3.49Å |
| 245 | S | 98.3 | Very high | 98.1 | Very high | 68 Ų | 68 | 98.9 Ų | 98.9 | 48% | 0.476 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.6 | -46.5 | 174.4 | -173.1 | 0 | 0 | 0 | 0 | 111.5 | L241 R242 R247 N248 T249 | L241-S245 WeakPolarHBondContact O-CB 3.33Å; L241-S245 PolarHBondContact O-N 3.31Å; R242-S245 PolarHBondContact O-N 3.37Å; S245-R247 PolarHBondContact O-N 2.87Å; S245-N248 PolarHBondContact O-N 2.92Å; S245-N248 VanDerWaalsContact O-N 3.12Å; S245-T249 PolarHBondContact O-N 3.14Å; S245-T249 PolarHBondContact O-OG1 2.95Å |
| 246 | E | 98.4 | Very high | 98.1 | Very high | 96 Ų | 96 | 102.2 Ų | 102.2 | 45% | 0.449 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63 | -38.9 | 178.1 | -163.8 | -168.2 | 136.7 | 0 | 0 | 112.9 | R242 A244 T249 K250 | R242-E246 PolarHBondContact O-N 3.33Å; A244-E246 PolarHBondContact O-N 3.18Å; E246-T249 PolarHBondContact O-N 3.29Å; E246-K250 WeakPolarHBondContact O-CG 3.33Å; E246-K250 PolarHBondContact O-N 3.18Å; E246-K250 WeakPolarHBondContact OE1-CE 3.33Å; E246-K250 IonicContact OE1-NZ 3.62Å; E246-K250 PolarHBondContact OE1-NZ 3.47Å |
| 247 | R | 98.3 | Very high | 98 | Very high | 148 Ų | 148 | 104.6 Ų | 104.6 | 56% | 0.558 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.9 | -42.3 | 172 | -81.1 | -179.3 | -84.5 | 113.8 | -8.7 | 111.8 | S243 A244 S245 K250 A251 | S243-R247 WeakPolarHBondContact O-CG 3.42Å; S243-R247 PolarHBondContact O-N 3.42Å; S243-R247 PolarHBondContact O-NE 3.12Å; S243-R247 VanDerWaalsContact O-NE 3.16Å; A244-R247 PolarHBondContact O-N 3.5Å; S245-R247 PolarHBondContact O-N 2.87Å; R247-K250 PolarHBondContact O-N 2.89Å; R247-A251 PolarHBondContact O-N 3.35Å |
| 248 | N | 98.1 | Very high | 97.9 | Very high | 101 Ų | 101 | 103.7 Ų | 103.7 | 54% | 0.54 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.2 | -42.1 | 177.7 | -69.4 | -1.5 | 0 | 0 | 0 | 111.8 | A244 S245 K250 A251 I252 | A244-N248 VanDerWaalsContact O-CG 3.29Å; A244-N248 PolarHBondContact O-N 3.4Å; A244-N248 PolarHBondContact O-OD1 3.49Å; S245-N248 PolarHBondContact O-N 2.92Å; S245-N248 VanDerWaalsContact O-N 3.12Å; N248-K250 PolarHBondContact O-N 2.95Å; N248-A251 PolarHBondContact O-N 3.22Å; N248-I252 WeakPolarHBondContact O-CG1 3.37Å; N248-I252 PolarHBondContact O-N 3.05Å |
| 249 | T | 98.4 | Very high | 97.9 | Very high | 70 Ų | 70 | 103.5 Ų | 103.5 | 43% | 0.429 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.1 | -47.7 | 173.4 | -58.7 | 0 | 0 | 0 | 0 | 111.2 | S245 E246 A251 I252 D253 | S245-T249 PolarHBondContact O-N 3.14Å; S245-T249 PolarHBondContact O-OG1 2.95Å; E246-T249 PolarHBondContact O-N 3.29Å; T249-A251 VanDerWaalsContact C-N 3.3Å; T249-A251 PolarHBondContact O-N 3.01Å; T249-I252 PolarHBondContact O-N 2.91Å; T249-D253 PolarHBondContact O-N 2.6Å |
| 250 | K | 98.1 | Very high | 97.8 | Very high | 114 Ų | 114 | 104 Ų | 104 | 50% | 0.496 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.3 | -37.6 | 176.8 | -73.7 | 168 | 175.2 | 173.4 | 0 | 112.6 | E246 R247 N248 Q254 | E246-K250 WeakPolarHBondContact O-CG 3.33Å; E246-K250 PolarHBondContact O-N 3.18Å; E246-K250 WeakPolarHBondContact OE1-CE 3.33Å; E246-K250 IonicContact OE1-NZ 3.62Å; E246-K250 PolarHBondContact OE1-NZ 3.47Å; R247-K250 PolarHBondContact O-N 2.89Å; N248-K250 PolarHBondContact O-N 2.95Å; K250-Q254 WeakPolarHBondContact O-CG 3.42Å; K250-Q254 PolarHBondContact O-N 3.25Å; K250-Q254 VanDerWaalsContact O-N 3.09Å |
| 251 | A | 97.9 | Very high | 97.7 | Very high | 43 Ų | 43 | 104.5 Ų | 104.5 | 36% | 0.355 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.8 | -41.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | R247 N248 T249 D253 Q254 L255 | R247-A251 PolarHBondContact O-N 3.35Å; N248-A251 PolarHBondContact O-N 3.22Å; T249-A251 VanDerWaalsContact C-N 3.3Å; T249-A251 PolarHBondContact O-N 3.01Å; A251-D253 VanDerWaalsContact C-N 3.34Å; A251-D253 PolarHBondContact O-N 3.09Å; A251-Q254 PolarHBondContact O-N 3.48Å; A251-L255 WeakPolarHBondContact O-CG 3.42Å; A251-L255 PolarHBondContact O-N 3.39Å |
| 252 | I | 97.9 | Very high | 97.6 | Very high | 86 Ų | 86 | 103.7 Ų | 103.7 | 44% | 0.441 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61 | -42.5 | 175.1 | -71.3 | 164.9 | 0 | 0 | 0 | 110.8 | N248 T249 Q254 L255 R256 | N248-I252 WeakPolarHBondContact O-CG1 3.37Å; N248-I252 PolarHBondContact O-N 3.05Å; T249-I252 PolarHBondContact O-N 2.91Å; I252-Q254 VanDerWaalsContact C-N 3.35Å; I252-Q254 PolarHBondContact O-N 3.23Å; I252-L255 PolarHBondContact O-N 2.96Å; I252-R256 HydrophobicContact CG2-CG 4.47Å; I252-R256 WeakPolarHBondContact O-CB 3.35Å; I252-R256 VanDerWaalsContact O-CG 3.31Å; I252-R256 WeakPolarHBondContact O-CG 3.31Å; I252-R256 PolarHBondContact O-N 2.87Å |
| 253 | D | 97.6 | Very high | 97.6 | Very high | 62 Ų | 62 | 98.2 Ų | 98.2 | 33% | 0.332 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -72.5 | -25.5 | 178.5 | -68.6 | -28.6 | 0 | 0 | 0 | 113.2 | T249 A251 R256 K257 | T249-D253 PolarHBondContact O-N 2.6Å; A251-D253 VanDerWaalsContact C-N 3.34Å; A251-D253 PolarHBondContact O-N 3.09Å; D253-R256 WeakPolarHBondContact OD1-CD 3.39Å; D253-R256 IonicContact OD1-CZ 3.21Å; D253-R256 IonicContact OD1-NH1 2.81Å; D253-R256 PolarHBondContact OD1-NH1 3.27Å; D253-K257 WeakPolarHBondContact O-CG 3.47Å; D253-K257 PolarHBondContact O-N 3.4Å |
| 254 | Q | 97.6 | Very high | 97.5 | Very high | 132 Ų | 132 | 98.5 Ų | 98.5 | 62% | 0.617 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -69.8 | -43.2 | 167.2 | -74.9 | 174.6 | 5 | 0 | 0 | 111.9 | K250 A251 I252 K257 R258 | K250-Q254 WeakPolarHBondContact O-CG 3.42Å; K250-Q254 PolarHBondContact O-N 3.25Å; K250-Q254 VanDerWaalsContact O-N 3.09Å; A251-Q254 PolarHBondContact O-N 3.48Å; I252-Q254 VanDerWaalsContact C-N 3.35Å; I252-Q254 PolarHBondContact O-N 3.23Å; Q254-K257 PolarHBondContact O-N 3.16Å; Q254-R258 PolarHBondContact O-N 3.49Å; Q254-R258 VanDerWaalsContact O-N 3.16Å |
| 255 | L | 97 | Very high | 97.5 | Very high | 111 Ų | 111 | 101.8 Ų | 101.8 | 58% | 0.581 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63 | -44 | 175.6 | -70.2 | 170.7 | 0 | 0 | 0 | 111.5 | A251 I252 K257 R258 I259 | A251-L255 WeakPolarHBondContact O-CG 3.42Å; A251-L255 PolarHBondContact O-N 3.39Å; I252-L255 PolarHBondContact O-N 2.96Å; L255-K257 PolarHBondContact O-N 3.23Å; L255-R258 PolarHBondContact O-N 3Å; L255-I259 WeakPolarHBondContact O-CG1 3.18Å; L255-I259 PolarHBondContact O-N 3.05Å |
| 256 | R | 97.3 | Very high | 97.4 | Very high | 159 Ų | 159 | 103.5 Ų | 103.5 | 60% | 0.6 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -55.6 | -33.7 | 173.8 | -77.5 | 167.8 | 166.3 | 170.4 | -6.6 | 113.5 | I252 D253 P260 | I252-R256 HydrophobicContact CG2-CG 4.47Å; I252-R256 WeakPolarHBondContact O-CB 3.35Å; I252-R256 VanDerWaalsContact O-CG 3.31Å; I252-R256 WeakPolarHBondContact O-CG 3.31Å; I252-R256 PolarHBondContact O-N 2.87Å; D253-R256 WeakPolarHBondContact OD1-CD 3.39Å; D253-R256 IonicContact OD1-CZ 3.21Å; D253-R256 IonicContact OD1-NH1 2.81Å; D253-R256 PolarHBondContact OD1-NH1 3.27Å; R256-P260 WeakPolarHBondContact O-CD 3.39Å |
| 257 | K | 96.4 | Very high | 97.4 | Very high | 152 Ų | 152 | 103.6 Ų | 103.6 | 66% | 0.661 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -75.8 | -33.4 | 175.5 | -73.2 | 173.3 | -179.2 | -175.6 | 0 | 113.1 | D253 Q254 L255 P260 | D253-K257 WeakPolarHBondContact O-CG 3.47Å; D253-K257 PolarHBondContact O-N 3.4Å; Q254-K257 PolarHBondContact O-N 3.16Å; L255-K257 PolarHBondContact O-N 3.23Å; K257-P260 WeakPolarHBondContact O-CD 3.24Å; K257-P260 WeakPolarHBondContact O-CG 3.5Å |
| 258 | R | 97.3 | Very high | 97.4 | Very high | 163 Ų | 163 | 101.6 Ų | 101.6 | 62% | 0.615 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -79 | -25.1 | 178 | -73.2 | -171.9 | 165.8 | -172.8 | -2.9 | 114.6 | Q254 L255 E261 L262 | Q254-R258 PolarHBondContact O-N 3.49Å; Q254-R258 VanDerWaalsContact O-N 3.16Å; L255-R258 PolarHBondContact O-N 3Å; R258-E261 WeakPolarHBondContact O-CB 3.45Å; R258-E261 PolarHBondContact O-N 3.23Å; R258-L262 WeakPolarHBondContact O-CG 3.45Å; R258-L262 PolarHBondContact O-N 2.96Å |
| 259 | I | 97.1 | Very high | 97.3 | Very high | 101 Ų | 101 | 101.9 Ų | 101.9 | 52% | 0.518 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -54.8 | -51.6 | 176.8 | -74 | 165.5 | 0 | 0 | 0 | 112.7 | L255 E261 L262 V263 | L255-I259 WeakPolarHBondContact O-CG1 3.18Å; L255-I259 PolarHBondContact O-N 3.05Å; I259-E261 VanDerWaalsContact C-N 3.31Å; I259-E261 PolarHBondContact O-N 3.23Å; I259-L262 PolarHBondContact O-N 3.31Å; I259-V263 WeakPolarHBondContact O-CG2 3.4Å; I259-V263 PolarHBondContact O-N 2.77Å |
| 260 | P | 96.7 | Very high | 97.3 | Very high | 77 Ų | 77 | 101.4 Ų | 101.4 | 50% | 0.5 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.7 | -29.2 | 177.4 | 25.5 | -35 | 0 | 0 | 0 | 113.6 | R256 K257 A264 | R256-P260 WeakPolarHBondContact O-CD 3.39Å; K257-P260 WeakPolarHBondContact O-CD 3.24Å; K257-P260 WeakPolarHBondContact O-CG 3.5Å; P260-A264 WeakPolarHBondContact O-CB 3.34Å; P260-A264 PolarHBondContact O-N 3.4Å |
| 261 | E | 96.1 | Very high | 97.3 | Very high | 116 Ų | 116 | 101.3 Ų | 101.3 | 54% | 0.542 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.3 | -42.5 | 172.6 | -59.7 | 172.1 | 166.6 | 0 | 0 | 111 | R258 I259 M265 | R258-E261 WeakPolarHBondContact O-CB 3.45Å; R258-E261 PolarHBondContact O-N 3.23Å; I259-E261 VanDerWaalsContact C-N 3.31Å; I259-E261 PolarHBondContact O-N 3.23Å; E261-M265 WeakPolarHBondContact O-CG 3.44Å; E261-M265 PolarHBondContact O-N 3.35Å |
| 262 | L | 96.8 | Very high | 97.3 | Very high | 106 Ų | 106 | 106.3 Ų | 106.3 | 56% | 0.555 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -67.1 | -43.7 | 176.4 | -73.1 | 162.9 | 0 | 0 | 0 | 112.2 | R258 I259 M265 D266 | R258-L262 WeakPolarHBondContact O-CG 3.45Å; R258-L262 PolarHBondContact O-N 2.96Å; I259-L262 PolarHBondContact O-N 3.31Å; L262-M265 HydrophobicContact CD2-CE 3.95Å; L262-M265 HydrophobicContact CG-CE 4.48Å; L262-M265 PolarHBondContact O-N 2.91Å; L262-D266 PolarHBondContact O-N 3.36Å |
| 263 | V | 97.4 | Very high | 97.2 | Very high | 78 Ų | 78 | 107 Ų | 107 | 47% | 0.473 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60.7 | -47.1 | 176.5 | 171.8 | 0 | 0 | 0 | 0 | 110.9 | I259 M265 D266 D267 | I259-V263 WeakPolarHBondContact O-CG2 3.4Å; I259-V263 PolarHBondContact O-N 2.77Å; V263-M265 PolarHBondContact O-N 2.98Å; V263-D266 WeakPolarHBondContact O-CB 3.34Å; V263-D266 PolarHBondContact O-N 3.25Å; V263-D267 PolarHBondContact O-N 3.25Å |
| 264 | A | 97.2 | Very high | 97.2 | Very high | 59 Ų | 59 | 112.7 Ų | 112.7 | 49% | 0.488 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.3 | -28.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | P260 Q268 | P260-A264 WeakPolarHBondContact O-CB 3.34Å; P260-A264 PolarHBondContact O-N 3.4Å; A264-Q268 WeakPolarHBondContact O-CB 3.33Å; A264-Q268 PolarHBondContact O-N 3.21Å |
| 265 | M | 97.1 | Very high | 97.2 | Very high | 96 Ų | 96 | 113 Ų | 113 | 47% | 0.473 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -75.2 | -36.4 | 171.6 | -72.5 | -173.2 | -66.7 | 0 | 0 | 112.5 | E261 L262 V263 Q268 I269 | E261-M265 WeakPolarHBondContact O-CG 3.44Å; E261-M265 PolarHBondContact O-N 3.35Å; L262-M265 HydrophobicContact CD2-CE 3.95Å; L262-M265 HydrophobicContact CG-CE 4.48Å; L262-M265 PolarHBondContact O-N 2.91Å; V263-M265 PolarHBondContact O-N 2.98Å; M265-Q268 PolarHBondContact O-N 3.04Å; M265-I269 WeakPolarHBondContact O-CB 3.42Å; M265-I269 WeakPolarHBondContact O-CD1 3.41Å; M265-I269 VanDerWaalsContact O-CG1 3.24Å; M265-I269 WeakPolarHBondContact O-CG1 3.43Å; M265-I269 PolarHBondContact O-N 2.96Å |
| 266 | D | 97.4 | Very high | 97.2 | Very high | 104 Ų | 104 | 113.7 Ų | 113.7 | 56% | 0.556 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -67.3 | -41.8 | 176.6 | -162.9 | 54.9 | 0 | 0 | 0 | 111.7 | L262 V263 I269 S270 | L262-D266 PolarHBondContact O-N 3.36Å; V263-D266 WeakPolarHBondContact O-CB 3.34Å; V263-D266 PolarHBondContact O-N 3.25Å; D266-I269 PolarHBondContact O-N 3.34Å; D266-S270 VanDerWaalsContact O-CB 3.31Å; D266-S270 WeakPolarHBondContact O-CB 3.31Å; D266-S270 PolarHBondContact O-N 2.86Å; D266-S270 PolarHBondContact O-OG 2.88Å |
| 267 | D | 97.7 | Very high | 97.1 | Very high | 97 Ų | 97 | 111.7 Ų | 111.7 | 52% | 0.519 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -56.8 | -49.8 | 169.5 | -71.5 | -37.8 | 0 | 0 | 0 | 110.8 | V263 I269 S270 D271 | V263-D267 PolarHBondContact O-N 3.25Å; D267-I269 VanDerWaalsContact C-N 3.34Å; D267-I269 PolarHBondContact O-N 2.83Å; D267-S270 WeakPolarHBondContact O-CB 3.47Å; D267-S270 PolarHBondContact O-N 3.34Å; D267-D271 PolarHBondContact O-N 3.3Å |
| 268 | Q | 98 | Very high | 97.1 | Very high | 107 Ų | 107 | 106.9 Ų | 106.9 | 50% | 0.5 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.6 | -36.8 | 179.8 | -172.3 | -177 | 46.5 | 0 | 0 | 113 | A264 M265 R272 | A264-Q268 WeakPolarHBondContact O-CB 3.33Å; A264-Q268 PolarHBondContact O-N 3.21Å; M265-Q268 PolarHBondContact O-N 3.04Å; Q268-R272 WeakPolarHBondContact O-CB 3.33Å; Q268-R272 WeakPolarHBondContact O-CG 3.37Å; Q268-R272 PolarHBondContact O-N 2.87Å |
| 269 | I | 97.4 | Very high | 97 | Very high | 106 Ų | 106 | 100.3 Ų | 100.3 | 54% | 0.544 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -69.9 | -40 | 175.7 | -71.9 | 165.7 | 0 | 0 | 0 | 110.1 | M265 D266 D267 R272 L273 | M265-I269 WeakPolarHBondContact O-CB 3.42Å; M265-I269 WeakPolarHBondContact O-CD1 3.41Å; M265-I269 VanDerWaalsContact O-CG1 3.24Å; M265-I269 WeakPolarHBondContact O-CG1 3.43Å; M265-I269 PolarHBondContact O-N 2.96Å; D266-I269 PolarHBondContact O-N 3.34Å; D267-I269 VanDerWaalsContact C-N 3.34Å; D267-I269 PolarHBondContact O-N 2.83Å; I269-R272 PolarHBondContact O-N 2.88Å; I269-L273 WeakPolarHBondContact O-CB 3.5Å; I269-L273 PolarHBondContact O-N 3.19Å |
| 270 | S | 97.7 | Very high | 97 | Very high | 61 Ų | 61 | 104.1 Ų | 104.1 | 43% | 0.427 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.7 | -43.9 | 177.7 | -64 | 0 | 0 | 0 | 0 | 112.5 | D266 D267 L273 R274 | D266-S270 VanDerWaalsContact O-CB 3.31Å; D266-S270 WeakPolarHBondContact O-CB 3.31Å; D266-S270 PolarHBondContact O-N 2.86Å; D266-S270 PolarHBondContact O-OG 2.88Å; D267-S270 WeakPolarHBondContact O-CB 3.47Å; D267-S270 PolarHBondContact O-N 3.34Å; S270-L273 PolarHBondContact O-N 2.9Å; S270-R274 WeakPolarHBondContact O-CB 3.5Å; S270-R274 PolarHBondContact O-N 3.01Å |
| 271 | D | 97.4 | Very high | 96.9 | Very high | 111 Ų | 111 | 102.4 Ų | 102.4 | 59% | 0.594 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.5 | -41.8 | 174.4 | -90.4 | -19.1 | 0 | 0 | 0 | 112.2 | D267 R274 E275 | D267-D271 PolarHBondContact O-N 3.3Å; D271-R274 WeakPolarHBondContact O-CB 3.38Å; D271-R274 PolarHBondContact O-N 3.1Å; D271-E275 PolarHBondContact O-N 2.92Å |
| 272 | R | 97.6 | Very high | 96.9 | Very high | 149 Ų | 149 | 105.1 Ų | 105.1 | 56% | 0.562 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.1 | -39.5 | 174.7 | -78.7 | 175.5 | 164.9 | -179.7 | -2.7 | 112.8 | Q268 I269 R274 E275 L276 | Q268-R272 WeakPolarHBondContact O-CB 3.33Å; Q268-R272 WeakPolarHBondContact O-CG 3.37Å; Q268-R272 PolarHBondContact O-N 2.87Å; I269-R272 PolarHBondContact O-N 2.88Å; R272-R274 VanDerWaalsContact C-N 3.35Å; R272-E275 PolarHBondContact O-N 3.47Å; R272-L276 WeakPolarHBondContact O-CB 3.46Å; R272-L276 WeakPolarHBondContact O-CG 3.24Å; R272-L276 PolarHBondContact O-N 3.39Å |
| 273 | L | 97.3 | Very high | 96.9 | Very high | 100 Ų | 100 | 105.9 Ų | 105.9 | 52% | 0.524 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.2 | -45.4 | 174.6 | -179.9 | 61 | 0 | 0 | 0 | 110.3 | I269 S270 E275 L276 E277 | I269-L273 WeakPolarHBondContact O-CB 3.5Å; I269-L273 PolarHBondContact O-N 3.19Å; S270-L273 PolarHBondContact O-N 2.9Å; L273-E275 VanDerWaalsContact C-N 3.35Å; L273-E275 PolarHBondContact O-N 3.43Å; L273-L276 PolarHBondContact O-N 2.81Å; L273-E277 WeakPolarHBondContact O-CG 3.36Å; L273-E277 PolarHBondContact O-N 3.07Å |
| 274 | R | 97.1 | Very high | 96.8 | Very high | 182 Ų | 182 | 106 Ų | 106 | 69% | 0.687 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.3 | -38.5 | 176.7 | -170.3 | 178.8 | -173.6 | 170.4 | 3.2 | 112.7 | S270 D271 R272 S278 | S270-R274 WeakPolarHBondContact O-CB 3.5Å; S270-R274 PolarHBondContact O-N 3.01Å; D271-R274 WeakPolarHBondContact O-CB 3.38Å; D271-R274 PolarHBondContact O-N 3.1Å; R272-R274 VanDerWaalsContact C-N 3.35Å; R274-S278 PolarHBondContact O-N 2.9Å |
| 275 | E | 97.1 | Very high | 96.7 | Very high | 138 Ų | 138 | 111 Ų | 111 | 65% | 0.645 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.2 | -49.6 | 171.9 | -175.2 | 177.5 | -159.2 | 0 | 0 | 111 | D271 R272 L273 E277 S278 G279 | D271-E275 PolarHBondContact O-N 2.92Å; R272-E275 PolarHBondContact O-N 3.47Å; L273-E275 VanDerWaalsContact C-N 3.35Å; L273-E275 PolarHBondContact O-N 3.43Å; E275-E277 PolarHBondContact O-N 3.4Å; E275-S278 WeakPolarHBondContact O-CB 3.42Å; E275-S278 PolarHBondContact O-N 3.24Å; E275-S278 VanDerWaalsContact O-N 3.11Å; E275-S278 PolarHBondContact O-OG 3.4Å; E275-G279 PolarHBondContact O-N 3.47Å |
| 276 | L | 96.9 | Very high | 96.6 | Very high | 126 Ų | 126 | 110.4 Ų | 110.4 | 66% | 0.66 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61.9 | -38.5 | 178.5 | -73.1 | 170.9 | 0 | 0 | 0 | 112.8 | R272 L273 G279 R280 | R272-L276 WeakPolarHBondContact O-CB 3.46Å; R272-L276 WeakPolarHBondContact O-CG 3.24Å; R272-L276 PolarHBondContact O-N 3.39Å; L273-L276 PolarHBondContact O-N 2.81Å; L276-G279 PolarHBondContact O-N 3.29Å; L276-R280 WeakPolarHBondContact O-CB 3.5Å; L276-R280 PolarHBondContact O-N 2.98Å |
| 277 | E | 96.3 | Very high | 96.5 | Very high | 116 Ų | 116 | 111.4 Ų | 111.4 | 54% | 0.542 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.5 | -41.5 | 172.2 | -74.3 | -169.8 | 149.5 | 0 | 0 | 111.8 | L273 E275 G279 R280 A281 | L273-E277 WeakPolarHBondContact O-CG 3.36Å; L273-E277 PolarHBondContact O-N 3.07Å; E275-E277 PolarHBondContact O-N 3.4Å; E277-G279 VanDerWaalsContact C-N 3.32Å; E277-G279 PolarHBondContact O-N 2.87Å; E277-R280 PolarHBondContact O-N 2.73Å; E277-A281 WeakPolarHBondContact O-CB 3.48Å; E277-A281 PolarHBondContact O-N 3.39Å |
| 278 | S | 95.4 | Very high | 96.2 | Very high | 51 Ų | 51 | 110.2 Ų | 110.2 | 36% | 0.357 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.7 | -38.6 | 174.3 | 89.5 | 0 | 0 | 0 | 0 | 111.9 | R274 E275 A281 R282 | R274-S278 PolarHBondContact O-N 2.9Å; E275-S278 WeakPolarHBondContact O-CB 3.42Å; E275-S278 PolarHBondContact O-N 3.24Å; E275-S278 VanDerWaalsContact O-N 3.11Å; E275-S278 PolarHBondContact O-OG 3.4Å; S278-A281 PolarHBondContact O-N 2.89Å; S278-R282 WeakPolarHBondContact O-CG 3.39Å; S278-R282 PolarHBondContact O-N 3.2Å |
| 279 | G | 96.3 | Very high | 96.1 | Very high | 26 Ų | 26 | 111.5 Ų | 111.5 | 27% | 0.268 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -64.9 | -47.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | E275 L276 E277 A281 R282 L283 | E275-G279 PolarHBondContact O-N 3.47Å; L276-G279 PolarHBondContact O-N 3.29Å; E277-G279 VanDerWaalsContact C-N 3.32Å; E277-G279 PolarHBondContact O-N 2.87Å; G279-A281 VanDerWaalsContact C-N 3.31Å; G279-A281 PolarHBondContact O-N 3.44Å; G279-R282 WeakPolarHBondContact O-CB 3.42Å; G279-R282 PolarHBondContact O-N 2.84Å; G279-R282 VanDerWaalsContact O-N 3.07Å; G279-L283 WeakPolarHBondContact O-CG 3.48Å; G279-L283 PolarHBondContact O-N 3.2Å |
| 280 | R | 96.3 | Very high | 95.8 | Very high | 181 Ų | 181 | 109.1 Ų | 109.1 | 68% | 0.683 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -56.7 | -44 | 171.7 | 179.2 | -178.3 | 172.6 | -165.6 | -2.4 | 111.1 | L276 E277 R282 L283 V284 | L276-R280 WeakPolarHBondContact O-CB 3.5Å; L276-R280 PolarHBondContact O-N 2.98Å; E277-R280 PolarHBondContact O-N 2.73Å; R280-R282 VanDerWaalsContact C-N 3.3Å; R280-R282 PolarHBondContact O-N 3.11Å; R280-L283 PolarHBondContact O-N 3.45Å; R280-V284 WeakPolarHBondContact O-CG2 3.43Å; R280-V284 PolarHBondContact O-N 2.89Å |
| 281 | A | 95.5 | Very high | 95.5 | Very high | 40 Ų | 40 | 108.8 Ų | 108.8 | 33% | 0.331 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.4 | -29 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | E277 S278 G279 R285 | E277-A281 WeakPolarHBondContact O-CB 3.48Å; E277-A281 PolarHBondContact O-N 3.39Å; S278-A281 PolarHBondContact O-N 2.89Å; G279-A281 VanDerWaalsContact C-N 3.31Å; G279-A281 PolarHBondContact O-N 3.44Å; A281-R285 WeakPolarHBondContact O-CG 2.95Å; A281-R285 PolarHBondContact O-N 3.11Å; A281-R285 PolarHBondContact O-NH1 3.29Å |
| 282 | R | 95.9 | Very high | 95.2 | Very high | 173 Ų | 173 | 107.6 Ų | 107.6 | 65% | 0.653 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -70.2 | -46.7 | 169.7 | -70.1 | 170.9 | -176.1 | 174.6 | 3.5 | 111 | S278 G279 R280 V284 R285 T286 | S278-R282 WeakPolarHBondContact O-CG 3.39Å; S278-R282 PolarHBondContact O-N 3.2Å; G279-R282 WeakPolarHBondContact O-CB 3.42Å; G279-R282 PolarHBondContact O-N 2.84Å; G279-R282 VanDerWaalsContact O-N 3.07Å; R280-R282 VanDerWaalsContact C-N 3.3Å; R280-R282 PolarHBondContact O-N 3.11Å; R282-V284 VanDerWaalsContact C-N 3.35Å; R282-V284 PolarHBondContact O-N 3.06Å; R282-R285 PolarHBondContact O-N 2.92Å; R282-T286 PolarHBondContact O-N 3.49Å; R282-T286 PolarHBondContact O-OG1 3.17Å |
| 283 | L | 95.7 | Very high | 95 | Very high | 122 Ų | 122 | 103.8 Ų | 103.8 | 64% | 0.639 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.8 | -37.5 | 178.2 | -71.1 | 172.1 | 0 | 0 | 0 | 113.1 | G279 R280 T286 L287 | G279-L283 WeakPolarHBondContact O-CG 3.48Å; G279-L283 PolarHBondContact O-N 3.2Å; R280-L283 PolarHBondContact O-N 3.45Å; L283-T286 WeakPolarHBondContact CA-OG1 3.36Å; L283-T286 PolarHBondContact O-N 2.94Å; L283-T286 PolarHBondContact O-OG1 3.2Å; L283-T286 VanDerWaalsContact O-OG1 3.1Å; L283-L287 VanDerWaalsContact O-CB 3.24Å; L283-L287 WeakPolarHBondContact O-CB 3.45Å; L283-L287 PolarHBondContact O-N 3.35Å |
| 284 | V | 96.3 | Very high | 94.7 | Very high | 80 Ų | 80 | 106.6 Ų | 106.6 | 49% | 0.485 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.6 | -45.5 | 173.6 | 169.3 | 0 | 0 | 0 | 0 | 110.7 | R280 R282 T286 L287 T288 | R280-V284 WeakPolarHBondContact O-CG2 3.43Å; R280-V284 PolarHBondContact O-N 2.89Å; R282-V284 VanDerWaalsContact C-N 3.35Å; R282-V284 PolarHBondContact O-N 3.06Å; V284-T286 PolarHBondContact O-N 3.37Å; V284-L287 PolarHBondContact O-N 2.82Å; V284-T288 PolarHBondContact O-N 2.86Å; V284-T288 PolarHBondContact O-OG1 3.35Å; V284-T288 VanDerWaalsContact O-OG1 3.11Å |
| 285 | R | 94.9 | Very high | 94.4 | Very high | 166 Ų | 166 | 101.8 Ų | 101.8 | 63% | 0.626 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62 | -42.9 | 177.5 | -69.7 | 175.3 | -173.3 | 100.4 | -12.3 | 112.4 | A281 R282 T288 F289 | A281-R285 WeakPolarHBondContact O-CG 2.95Å; A281-R285 PolarHBondContact O-N 3.11Å; A281-R285 PolarHBondContact O-NH1 3.29Å; R282-R285 PolarHBondContact O-N 2.92Å; R285-T288 PolarHBondContact O-N 3.04Å; R285-F289 WeakPolarHBondContact O-CB 3.38Å; R285-F289 PolarHBondContact O-N 3.13Å |
| 286 | T | 94.6 | Very high | 94.2 | Very high | 83 Ų | 83 | 101.5 Ų | 101.5 | 51% | 0.509 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -70.7 | -33.2 | 178.2 | 55.6 | 0 | 0 | 0 | 0 | 112.4 | R282 L283 V284 F289 A290 | R282-T286 PolarHBondContact O-N 3.49Å; R282-T286 PolarHBondContact O-OG1 3.17Å; L283-T286 WeakPolarHBondContact CA-OG1 3.36Å; L283-T286 PolarHBondContact O-N 2.94Å; L283-T286 PolarHBondContact O-OG1 3.2Å; L283-T286 VanDerWaalsContact O-OG1 3.1Å; V284-T286 PolarHBondContact O-N 3.37Å; T286-F289 PolarHBondContact O-N 3.48Å; T286-A290 WeakPolarHBondContact O-CB 3.35Å; T286-A290 PolarHBondContact O-N 3.43Å |
| 287 | L | 94.6 | Very high | 94 | Very high | 124 Ų | 124 | 99.5 Ų | 99.5 | 65% | 0.649 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -66.7 | -44.1 | 173.2 | -171.1 | 155.4 | 0 | 0 | 0 | 111.6 | L283 V284 A290 A291 | L283-L287 VanDerWaalsContact O-CB 3.24Å; L283-L287 WeakPolarHBondContact O-CB 3.45Å; L283-L287 PolarHBondContact O-N 3.35Å; V284-L287 PolarHBondContact O-N 2.82Å; L287-A290 PolarHBondContact O-N 2.97Å; L287-A291 WeakPolarHBondContact O-CB 3.36Å; L287-A291 PolarHBondContact O-N 3.35Å |
| 288 | T | 92.6 | Very high | 93.7 | Very high | 73 Ų | 73 | 96.8 Ų | 96.8 | 45% | 0.448 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.1 | -47.6 | 172.8 | -58.3 | 0 | 0 | 0 | 0 | 111.1 | V284 R285 A290 A291 D292 | V284-T288 PolarHBondContact O-N 2.86Å; V284-T288 PolarHBondContact O-OG1 3.35Å; V284-T288 VanDerWaalsContact O-OG1 3.11Å; R285-T288 PolarHBondContact O-N 3.04Å; T288-A290 VanDerWaalsContact C-N 3.33Å; T288-A290 PolarHBondContact O-N 3Å; T288-A291 CarbonylContact O-C 3.5Å; T288-A291 WeakPolarHBondContact O-CA 3.43Å; T288-A291 WeakPolarHBondContact O-CB 3.38Å; T288-A291 PolarHBondContact O-N 2.97Å; T288-D292 PolarHBondContact O-N 3.46Å |
| 289 | F | 94.4 | Very high | 93.5 | Very high | 133 Ų | 133 | 96.6 Ų | 96.6 | 58% | 0.583 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60.6 | -39.1 | 176.9 | 178.8 | -107.8 | 0 | 0 | 0 | 113.1 | R285 T286 D292 I293 | R285-F289 WeakPolarHBondContact O-CB 3.38Å; R285-F289 PolarHBondContact O-N 3.13Å; T286-F289 PolarHBondContact O-N 3.48Å; F289-D292 PolarHBondContact O-N 2.91Å; F289-I293 HydrophobicContact CD1-CD1 3.92Å; F289-I293 HydrophobicContact CE1-CD1 3.44Å; F289-I293 VanDerWaalsContact CE1-CD1 3.44Å; F289-I293 HydrophobicContact CE1-CG1 4.48Å; F289-I293 HydrophobicContact CE2-CD1 4.39Å; F289-I293 HydrophobicContact CZ-CD1 3.72Å; F289-I293 HydrophobicContact CZ-CG1 4.46Å; F289-I293 WeakPolarHBondContact O-CG1 3.4Å; F289-I293 PolarHBondContact O-N 3.43Å |
| 290 | A | 92.3 | Very high | 93.2 | Very high | 57 Ų | 57 | 99.9 Ų | 99.9 | 47% | 0.471 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67 | -35.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | T286 L287 T288 I293 K294 | T286-A290 WeakPolarHBondContact O-CB 3.35Å; T286-A290 PolarHBondContact O-N 3.43Å; L287-A290 PolarHBondContact O-N 2.97Å; T288-A290 VanDerWaalsContact C-N 3.33Å; T288-A290 PolarHBondContact O-N 3Å; A290-I293 PolarHBondContact O-N 3.35Å; A290-K294 PolarHBondContact O-N 3.32Å; A290-K294 VanDerWaalsContact O-N 3.13Å |
| 291 | A | 90.8 | Very high | 92.9 | Very high | 54 Ų | 54 | 99.2 Ų | 99.2 | 45% | 0.446 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.3 | -37.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L287 T288 K294 P295 | L287-A291 WeakPolarHBondContact O-CB 3.36Å; L287-A291 PolarHBondContact O-N 3.35Å; T288-A291 CarbonylContact O-C 3.5Å; T288-A291 WeakPolarHBondContact O-CA 3.43Å; T288-A291 WeakPolarHBondContact O-CB 3.38Å; T288-A291 PolarHBondContact O-N 2.97Å; A291-K294 WeakPolarHBondContact O-CB 3.44Å; A291-K294 PolarHBondContact O-N 3.47Å; A291-P295 WeakPolarHBondContact O-CD 3.48Å |
| 292 | D | 91.9 | Very high | 92.7 | Very high | 86 Ų | 86 | 104.2 Ų | 104.2 | 46% | 0.46 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -71.1 | -26.4 | 174.8 | -67.4 | -28.4 | 0 | 0 | 0 | 113.4 | T288 F289 P295 K296 | T288-D292 PolarHBondContact O-N 3.46Å; F289-D292 PolarHBondContact O-N 2.91Å; D292-P295 WeakPolarHBondContact O-CD 3.49Å; D292-K296 WeakPolarHBondContact O-CG 3.36Å |
| 293 | I | 93.1 | Very high | 92.5 | Very high | 68 Ų | 68 | 98.7 Ų | 98.7 | 35% | 0.349 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -73.1 | -37.1 | 172.1 | -76.3 | 173.8 | 0 | 0 | 0 | 111.2 | F289 A290 K296 V297 | F289-I293 HydrophobicContact CD1-CD1 3.92Å; F289-I293 HydrophobicContact CE1-CD1 3.44Å; F289-I293 VanDerWaalsContact CE1-CD1 3.44Å; F289-I293 HydrophobicContact CE1-CG1 4.48Å; F289-I293 HydrophobicContact CE2-CD1 4.39Å; F289-I293 HydrophobicContact CZ-CD1 3.72Å; F289-I293 HydrophobicContact CZ-CG1 4.46Å; F289-I293 WeakPolarHBondContact O-CG1 3.4Å; F289-I293 PolarHBondContact O-N 3.43Å; A290-I293 PolarHBondContact O-N 3.35Å; I293-K296 WeakPolarHBondContact O-CB 3.48Å; I293-K296 PolarHBondContact O-N 2.81Å; I293-V297 HydrophobicContact CG2-CG2 3.66Å; I293-V297 PolarHBondContact O-N 3.1Å |
| 294 | K | 91.2 | Very high | 92.1 | Very high | 160 Ų | 160 | 100 Ų | 100 | 70% | 0.696 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -51.3 | -49.6 | -177.2 | -169.3 | 178.3 | -179.7 | -178.9 | 0 | 114.5 | A290 A291 A298 | A290-K294 PolarHBondContact O-N 3.32Å; A290-K294 VanDerWaalsContact O-N 3.13Å; A291-K294 WeakPolarHBondContact O-CB 3.44Å; A291-K294 PolarHBondContact O-N 3.47Å; K294-A298 WeakPolarHBondContact O-CB 3.42Å; K294-A298 PolarHBondContact O-N 2.88Å |
| 295 | P | 90.6 | Very high | 91.7 | Very high | 81 Ų | 81 | 97.9 Ų | 97.9 | 53% | 0.526 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -70.3 | -30.4 | 176.9 | 28.4 | -35.2 | 0 | 0 | 0 | 112.8 | A291 D292 A298 S299 | A291-P295 WeakPolarHBondContact O-CD 3.48Å; D292-P295 WeakPolarHBondContact O-CD 3.49Å; P295-A298 PolarHBondContact O-N 3.04Å; P295-S299 PolarHBondContact O-N 3.32Å |
| 296 | K | 92.4 | Very high | 91.3 | Very high | 132 Ų | 132 | 92 Ų | 92 | 57% | 0.574 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.6 | -47.7 | 176.1 | -63.6 | 175.2 | -175.5 | 175.6 | 0 | 110.8 | D292 I293 A298 S299 I300 | D292-K296 WeakPolarHBondContact O-CG 3.36Å; I293-K296 WeakPolarHBondContact O-CB 3.48Å; I293-K296 PolarHBondContact O-N 2.81Å; K296-A298 VanDerWaalsContact C-N 3.31Å; K296-A298 PolarHBondContact O-N 2.92Å; K296-S299 PolarHBondContact O-N 3.01Å; K296-I300 VanDerWaalsContact O-CG1 3.32Å; K296-I300 WeakPolarHBondContact O-CG1 3.44Å; K296-I300 PolarHBondContact O-N 3.25Å |
| 297 | V | 91.9 | Very high | 91.1 | Very high | 83 Ų | 83 | 93.6 Ų | 93.6 | 50% | 0.503 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.5 | -36 | 174.4 | 175.9 | 0 | 0 | 0 | 0 | 111.3 | I293 I300 K301 | I293-V297 HydrophobicContact CG2-CG2 3.66Å; I293-V297 PolarHBondContact O-N 3.1Å; V297-I300 PolarHBondContact O-N 3.28Å; V297-K301 WeakPolarHBondContact O-CB 3.16Å; V297-K301 PolarHBondContact O-N 3.13Å |
| 298 | A | 90.1 | Very high | 90.7 | Very high | 59 Ų | 59 | 94.1 Ų | 94.1 | 49% | 0.488 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.6 | -39.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | K294 P295 K296 R302 | K294-A298 WeakPolarHBondContact O-CB 3.42Å; K294-A298 PolarHBondContact O-N 2.88Å; P295-A298 PolarHBondContact O-N 3.04Å; K296-A298 VanDerWaalsContact C-N 3.31Å; K296-A298 PolarHBondContact O-N 2.92Å; A298-R302 PolarHBondContact O-N 3.01Å |
| 299 | S | 91.4 | Very high | 90.5 | Very high | 47 Ų | 47 | 94.4 Ų | 94.4 | 33% | 0.329 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64 | -51.8 | 171.6 | -165.4 | 0 | 0 | 0 | 0 | 110.4 | P295 K296 K301 R302 D303 | P295-S299 PolarHBondContact O-N 3.32Å; K296-S299 PolarHBondContact O-N 3.01Å; S299-K301 PolarHBondContact O-N 2.97Å; S299-K301 VanDerWaalsContact O-N 3.16Å; S299-R302 CarbonylContact O-C 3.58Å; S299-R302 WeakPolarHBondContact O-CA 3.37Å; S299-R302 WeakPolarHBondContact O-CB 3.43Å; S299-R302 PolarHBondContact O-N 3.49Å; S299-R302 PolarHBondContact OG-NH2 3.42Å; S299-R302 VanDerWaalsContact OG-NH2 3.1Å; S299-D303 VanDerWaalsContact C-OD2 3.24Å; S299-D303 VanDerWaalsContact O-CG 3.31Å; S299-D303 PolarHBondContact O-N 2.94Å; S299-D303 PolarHBondContact OG-OD2 3.03Å |
| 300 | I | 90.2 | Very high | 90.2 | Very high | 95 Ų | 95 | 93.6 Ų | 93.6 | 49% | 0.487 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -52 | -44.2 | 178.6 | -68.2 | 164.2 | 0 | 0 | 0 | 110.6 | K296 V297 D303 F304 | K296-I300 VanDerWaalsContact O-CG1 3.32Å; K296-I300 WeakPolarHBondContact O-CG1 3.44Å; K296-I300 PolarHBondContact O-N 3.25Å; V297-I300 PolarHBondContact O-N 3.28Å; I300-D303 PolarHBondContact O-N 2.87Å; I300-F304 HydrophobicContact CG2-CD2 3.76Å; I300-F304 HydrophobicContact CG2-CE2 3.86Å; I300-F304 WeakPolarHBondContact O-CD2 3.47Å; I300-F304 PolarHBondContact O-N 2.89Å |
| 301 | K | 91 | Very high | 90.1 | Very high | 167 Ų | 167 | 95 Ų | 95 | 73% | 0.726 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.6 | -41 | 174.8 | -173.6 | 176.7 | 179.2 | -179.6 | 0 | 113.1 | V297 S299 D303 G305 | V297-K301 WeakPolarHBondContact O-CB 3.16Å; V297-K301 PolarHBondContact O-N 3.13Å; S299-K301 PolarHBondContact O-N 2.97Å; S299-K301 VanDerWaalsContact O-N 3.16Å; K301-D303 VanDerWaalsContact C-N 3.34Å; K301-G305 PolarHBondContact O-N 2.9Å |
| 302 | R | 91.1 | Very high | 89.9 | Confident | 145 Ų | 145 | 95.4 Ų | 95.4 | 55% | 0.547 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.1 | -39.3 | 174.4 | -173.8 | -165.5 | 53.4 | 53.8 | 9.5 | 111.4 | A298 S299 G305 A306 | A298-R302 PolarHBondContact O-N 3.01Å; S299-R302 CarbonylContact O-C 3.58Å; S299-R302 WeakPolarHBondContact O-CA 3.37Å; S299-R302 WeakPolarHBondContact O-CB 3.43Å; S299-R302 PolarHBondContact O-N 3.49Å; S299-R302 PolarHBondContact OG-NH2 3.42Å; S299-R302 VanDerWaalsContact OG-NH2 3.1Å; R302-G305 PolarHBondContact O-N 3.13Å; R302-A306 WeakPolarHBondContact O-CB 3.46Å; R302-A306 PolarHBondContact O-N 2.78Å |
| 303 | D | 90.8 | Very high | 89.9 | Confident | 57 Ų | 57 | 95.1 Ų | 95.1 | 31% | 0.305 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -69.3 | -44.5 | 179.9 | -65.7 | -50.3 | 0 | 0 | 0 | 110.7 | S299 I300 K301 G305 A306 F307 | S299-D303 VanDerWaalsContact C-OD2 3.24Å; S299-D303 VanDerWaalsContact O-CG 3.31Å; S299-D303 PolarHBondContact O-N 2.94Å; S299-D303 PolarHBondContact OG-OD2 3.03Å; I300-D303 PolarHBondContact O-N 2.87Å; K301-D303 VanDerWaalsContact C-N 3.34Å; D303-G305 PolarHBondContact O-N 3.3Å; D303-A306 WeakPolarHBondContact O-CB 3.14Å; D303-A306 PolarHBondContact O-N 2.96Å; D303-A306 VanDerWaalsContact O-N 3.13Å; D303-F307 WeakPolarHBondContact O-CD2 3.48Å; D303-F307 PolarHBondContact O-N 3.16Å; D303-F307 VanDerWaalsContact O-N 3.13Å |
| 304 | F | 87.8 | Confident | 89.8 | Confident | 149 Ų | 149 | 96.4 Ų | 96.4 | 65% | 0.654 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -59 | -45 | 169 | -89.6 | -76.9 | 0 | 0 | 0 | 112.8 | I300 A306 F307 E308 | I300-F304 HydrophobicContact CG2-CD2 3.76Å; I300-F304 HydrophobicContact CG2-CE2 3.86Å; I300-F304 WeakPolarHBondContact O-CD2 3.47Å; I300-F304 PolarHBondContact O-N 2.89Å; F304-A306 PolarHBondContact O-N 2.74Å; F304-F307 PolarHBondContact O-N 3.45Å; F304-F307 VanDerWaalsContact O-N 3.07Å; F304-E308 PolarHBondContact O-N 3.5Å |
| 305 | G | 87.6 | Confident | 89.7 | Confident | 37 Ų | 37 | 93.1 Ų | 93.1 | 38% | 0.381 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.5 | -17 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | K301 R302 D303 P309 | K301-G305 PolarHBondContact O-N 2.9Å; R302-G305 PolarHBondContact O-N 3.13Å; D303-G305 PolarHBondContact O-N 3.3Å; G305-P309 WeakPolarHBondContact O-CD 3.45Å |
| 306 | A | 87.2 | Confident | 89.7 | Confident | 41 Ų | 41 | 94.6 Ų | 94.6 | 34% | 0.339 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -85.2 | -26.1 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | R302 D303 F304 Q310 | R302-A306 WeakPolarHBondContact O-CB 3.46Å; R302-A306 PolarHBondContact O-N 2.78Å; D303-A306 WeakPolarHBondContact O-CB 3.14Å; D303-A306 PolarHBondContact O-N 2.96Å; D303-A306 VanDerWaalsContact O-N 3.13Å; F304-A306 PolarHBondContact O-N 2.74Å; A306-Q310 WeakPolarHBondContact O-CG 3.32Å |
| 307 | F | 89.3 | Confident | 89.6 | Confident | 117 Ų | 117 | 95.4 Ų | 95.4 | 51% | 0.513 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -75.8 | -32.7 | 169.7 | -70.3 | -61.6 | 0 | 0 | 0 | 112.6 | D303 F304 Q310 V311 | D303-F307 WeakPolarHBondContact O-CD2 3.48Å; D303-F307 PolarHBondContact O-N 3.16Å; D303-F307 VanDerWaalsContact O-N 3.13Å; F304-F307 PolarHBondContact O-N 3.45Å; F304-F307 VanDerWaalsContact O-N 3.07Å; F307-Q310 CarbonylContact O-C 3.59Å; F307-Q310 WeakPolarHBondContact O-CA 3.45Å; F307-Q310 WeakPolarHBondContact O-CB 3.43Å; F307-Q310 PolarHBondContact O-N 2.97Å; F307-V311 WeakPolarHBondContact O-CG2 3.49Å; F307-V311 PolarHBondContact O-N 2.89Å |
| 308 | E | 88.1 | Confident | 89.4 | Confident | 135 Ų | 135 | 96.5 Ų | 96.5 | 63% | 0.631 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -51.5 | -47.9 | -179.2 | -168.7 | 166.9 | -172.7 | 0 | 0 | 114.7 | F304 Q310 S312 | F304-E308 PolarHBondContact O-N 3.5Å; E308-Q310 PolarHBondContact O-N 3.05Å; E308-S312 WeakPolarHBondContact O-CB 3.39Å; E308-S312 PolarHBondContact O-N 2.95Å; E308-S312 PolarHBondContact O-OG 3.07Å |
| 309 | P | 86.9 | Confident | 89.3 | Confident | 79 Ų | 79 | 95.5 Ų | 95.5 | 51% | 0.513 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -70.4 | -27.5 | 173.2 | 28.1 | -35.4 | 0 | 0 | 0 | 113.6 | G305 S312 D313 | G305-P309 WeakPolarHBondContact O-CD 3.45Å; P309-S312 PolarHBondContact O-N 3.44Å; P309-D313 WeakPolarHBondContact O-CB 3.35Å; P309-D313 PolarHBondContact O-N 3.43Å |
| 310 | Q | 89.1 | Confident | 89.2 | Confident | 117 Ų | 117 | 101.6 Ų | 101.6 | 55% | 0.547 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -71.2 | -41.2 | 176.2 | -61.6 | 177.6 | 9 | 0 | 0 | 111.5 | A306 F307 E308 S312 L314 | A306-Q310 WeakPolarHBondContact O-CG 3.32Å; F307-Q310 CarbonylContact O-C 3.59Å; F307-Q310 WeakPolarHBondContact O-CA 3.45Å; F307-Q310 WeakPolarHBondContact O-CB 3.43Å; F307-Q310 PolarHBondContact O-N 2.97Å; E308-Q310 PolarHBondContact O-N 3.05Å; Q310-S312 VanDerWaalsContact C-N 3.34Å; Q310-L314 VanDerWaalsContact O-CB 3.3Å; Q310-L314 WeakPolarHBondContact O-CB 3.46Å; Q310-L314 PolarHBondContact O-N 3.19Å |
| 311 | V | 88.8 | Confident | 89.1 | Confident | 87 Ų | 87 | 102.3 Ų | 102.3 | 53% | 0.527 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63 | -43.7 | 171.2 | 174 | 0 | 0 | 0 | 0 | 109.8 | F307 L314 T315 | F307-V311 WeakPolarHBondContact O-CG2 3.49Å; F307-V311 PolarHBondContact O-N 2.89Å; V311-L314 PolarHBondContact O-N 2.96Å; V311-T315 WeakPolarHBondContact O-CB 3.43Å; V311-T315 PolarHBondContact O-N 3.09Å; V311-T315 PolarHBondContact O-OG1 3.38Å; V311-T315 VanDerWaalsContact O-OG1 3.09Å |
| 312 | S | 88.4 | Confident | 88.9 | Confident | 62 Ų | 62 | 97 Ų | 97 | 43% | 0.434 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.6 | -43.4 | 177.7 | -54.8 | 0 | 0 | 0 | 0 | 113 | E308 P309 Q310 T315 L316 | E308-S312 WeakPolarHBondContact O-CB 3.39Å; E308-S312 PolarHBondContact O-N 2.95Å; E308-S312 PolarHBondContact O-OG 3.07Å; P309-S312 PolarHBondContact O-N 3.44Å; Q310-S312 VanDerWaalsContact C-N 3.34Å; S312-T315 PolarHBondContact O-N 2.83Å; S312-L316 WeakPolarHBondContact O-CG 3.5Å; S312-L316 PolarHBondContact O-N 3.41Å |
| 313 | D | 90.8 | Very high | 88.7 | Confident | 80 Ų | 80 | 96.6 Ų | 96.6 | 43% | 0.428 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.2 | -46.1 | 171.7 | 175.1 | 69.6 | 0 | 0 | 0 | 111.3 | P309 T315 L316 R317 | P309-D313 WeakPolarHBondContact O-CB 3.35Å; P309-D313 PolarHBondContact O-N 3.43Å; D313-T315 VanDerWaalsContact C-N 3.33Å; D313-T315 PolarHBondContact O-N 3.36Å; D313-L316 PolarHBondContact O-N 2.83Å; D313-R317 WeakPolarHBondContact O-CB 3.3Å; D313-R317 VanDerWaalsContact O-CG 3.3Å; D313-R317 WeakPolarHBondContact O-CG 3.38Å; D313-R317 PolarHBondContact O-N 3.09Å; D313-R317 WeakPolarHBondContact OD2-CD 3.04Å; D313-R317 IonicContact OD2-NH1 2.68Å; D313-R317 PolarHBondContact OD2-NH1 2.92Å |
| 314 | L | 90.9 | Very high | 88.6 | Confident | 95 Ų | 95 | 98.2 Ų | 98.2 | 50% | 0.497 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.9 | -41.3 | 179.4 | -171.8 | 64.4 | 0 | 0 | 0 | 111.6 | Q310 V311 R317 I318 | Q310-L314 VanDerWaalsContact O-CB 3.3Å; Q310-L314 WeakPolarHBondContact O-CB 3.46Å; Q310-L314 PolarHBondContact O-N 3.19Å; V311-L314 PolarHBondContact O-N 2.96Å; L314-R317 PolarHBondContact O-N 3.27Å; L314-I318 HydrophobicContact CG-CD1 4.08Å; L314-I318 WeakPolarHBondContact O-CB 3.3Å; L314-I318 WeakPolarHBondContact O-CD1 3.49Å; L314-I318 VanDerWaalsContact O-CG1 3.22Å; L314-I318 WeakPolarHBondContact O-CG1 3.34Å; L314-I318 PolarHBondContact O-N 2.8Å |
| 315 | T | 88.8 | Confident | 88.6 | Confident | 90 Ų | 90 | 96.4 Ų | 96.4 | 55% | 0.552 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.6 | -44 | 173.3 | -61.6 | 0 | 0 | 0 | 0 | 111.9 | V311 S312 D313 R317 I318 G319 | V311-T315 WeakPolarHBondContact O-CB 3.43Å; V311-T315 PolarHBondContact O-N 3.09Å; V311-T315 PolarHBondContact O-OG1 3.38Å; V311-T315 VanDerWaalsContact O-OG1 3.09Å; S312-T315 PolarHBondContact O-N 2.83Å; D313-T315 VanDerWaalsContact C-N 3.33Å; D313-T315 PolarHBondContact O-N 3.36Å; T315-R317 VanDerWaalsContact C-N 3.34Å; T315-R317 PolarHBondContact O-N 3.46Å; T315-I318 PolarHBondContact O-N 2.8Å; T315-G319 PolarHBondContact O-N 2.98Å |
| 316 | L | 90.3 | Very high | 88.5 | Confident | 112 Ų | 112 | 97 Ų | 97 | 59% | 0.586 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.9 | -37.9 | 175.3 | -77.6 | 170.7 | 0 | 0 | 0 | 112.4 | S312 D313 G319 R320 | S312-L316 WeakPolarHBondContact O-CG 3.5Å; S312-L316 PolarHBondContact O-N 3.41Å; D313-L316 PolarHBondContact O-N 2.83Å; L316-G319 PolarHBondContact O-N 3.23Å; L316-R320 WeakPolarHBondContact O-CG 3.22Å; L316-R320 PolarHBondContact O-N 2.94Å |
| 317 | R | 90.9 | Very high | 88.5 | Confident | 149 Ų | 149 | 99.4 Ų | 99.4 | 56% | 0.562 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -70.2 | -39 | 176.6 | -73.8 | 171.5 | 62.9 | -167.2 | -2.7 | 112.2 | D313 L314 T315 G319 R320 L321 | D313-R317 WeakPolarHBondContact O-CB 3.3Å; D313-R317 VanDerWaalsContact O-CG 3.3Å; D313-R317 WeakPolarHBondContact O-CG 3.38Å; D313-R317 PolarHBondContact O-N 3.09Å; D313-R317 WeakPolarHBondContact OD2-CD 3.04Å; D313-R317 IonicContact OD2-NH1 2.68Å; D313-R317 PolarHBondContact OD2-NH1 2.92Å; L314-R317 PolarHBondContact O-N 3.27Å; T315-R317 VanDerWaalsContact C-N 3.34Å; T315-R317 PolarHBondContact O-N 3.46Å; R317-G319 VanDerWaalsContact C-N 3.32Å; R317-R320 PolarHBondContact O-N 3.39Å; R317-L321 WeakPolarHBondContact O-CB 3.43Å; R317-L321 PolarHBondContact O-N 2.94Å |
| 318 | I | 88.5 | Confident | 88.3 | Confident | 106 Ų | 106 | 101.4 Ų | 101.4 | 54% | 0.544 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.6 | -41.9 | 170.6 | -71.1 | 164 | 0 | 0 | 0 | 110.2 | L314 T315 L321 A322 | L314-I318 HydrophobicContact CG-CD1 4.08Å; L314-I318 WeakPolarHBondContact O-CB 3.3Å; L314-I318 WeakPolarHBondContact O-CD1 3.49Å; L314-I318 VanDerWaalsContact O-CG1 3.22Å; L314-I318 WeakPolarHBondContact O-CG1 3.34Å; L314-I318 PolarHBondContact O-N 2.8Å; T315-I318 PolarHBondContact O-N 2.8Å; I318-L321 PolarHBondContact O-N 2.87Å; I318-A322 WeakPolarHBondContact O-CB 3.48Å; I318-A322 PolarHBondContact O-N 3.47Å |
| 319 | G | 88.1 | Confident | 88.2 | Confident | 39 Ų | 39 | 102 Ų | 102 | 40% | 0.402 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59 | -50 | 175 | 0 | 0 | 0 | 0 | 0 | 112.7 | T315 L316 R317 L321 A322 E323 | T315-G319 PolarHBondContact O-N 2.98Å; L316-G319 PolarHBondContact O-N 3.23Å; R317-G319 VanDerWaalsContact C-N 3.32Å; G319-L321 PolarHBondContact O-N 3.22Å; G319-A322 WeakPolarHBondContact O-CB 3.47Å; G319-A322 PolarHBondContact O-N 3.49Å; G319-E323 PolarHBondContact O-N 2.88Å |
| 320 | R | 87.8 | Confident | 88 | Confident | 175 Ų | 175 | 103.8 Ų | 103.8 | 66% | 0.66 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -60.9 | -43.8 | 174 | -69.1 | -177.4 | -164.9 | 179 | 6 | 112.3 | L316 R317 A322 E323 D324 | L316-R320 WeakPolarHBondContact O-CG 3.22Å; L316-R320 PolarHBondContact O-N 2.94Å; R317-R320 PolarHBondContact O-N 3.39Å; R320-A322 PolarHBondContact O-N 3.47Å; R320-E323 WeakPolarHBondContact O-CA 3.49Å; R320-E323 WeakPolarHBondContact O-CB 3.49Å; R320-E323 PolarHBondContact O-N 3.32Å; R320-E323 VanDerWaalsContact O-N 3.09Å; R320-D324 WeakPolarHBondContact O-CB 3.34Å; R320-D324 PolarHBondContact O-N 2.89Å |
| 321 | L | 88.3 | Confident | 87.8 | Confident | 109 Ų | 109 | 102.6 Ų | 102.6 | 57% | 0.571 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.5 | -29.6 | 178.8 | -152.4 | 84.9 | 0 | 0 | 0 | 112.3 | R317 I318 G319 L325 | R317-L321 WeakPolarHBondContact O-CB 3.43Å; R317-L321 PolarHBondContact O-N 2.94Å; I318-L321 PolarHBondContact O-N 2.87Å; G319-L321 PolarHBondContact O-N 3.22Å; L321-L325 VanDerWaalsContact O-CB 3.27Å; L321-L325 WeakPolarHBondContact O-CB 3.18Å; L321-L325 WeakPolarHBondContact O-CD1 3.42Å; L321-L325 VanDerWaalsContact O-CG 3.31Å; L321-L325 WeakPolarHBondContact O-CG 3.4Å; L321-L325 PolarHBondContact O-N 3.33Å |
| 322 | A | 86.6 | Confident | 87.5 | Confident | 57 Ų | 57 | 102.2 Ų | 102.2 | 47% | 0.471 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -74.5 | -38.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | I318 G319 R320 L325 S326 | I318-A322 WeakPolarHBondContact O-CB 3.48Å; I318-A322 PolarHBondContact O-N 3.47Å; G319-A322 WeakPolarHBondContact O-CB 3.47Å; G319-A322 PolarHBondContact O-N 3.49Å; R320-A322 PolarHBondContact O-N 3.47Å; A322-L325 PolarHBondContact O-N 2.81Å; A322-S326 WeakPolarHBondContact O-CB 3.46Å; A322-S326 PolarHBondContact O-N 2.95Å |
| 323 | E | 88.1 | Confident | 87.1 | Confident | 135 Ų | 135 | 101.7 Ų | 101.7 | 63% | 0.631 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.1 | -53.1 | 170.5 | -158.6 | 86.2 | -127.2 | 0 | 0 | 110.3 | G319 R320 L325 S326 E327 | G319-E323 PolarHBondContact O-N 2.88Å; R320-E323 WeakPolarHBondContact O-CA 3.49Å; R320-E323 WeakPolarHBondContact O-CB 3.49Å; R320-E323 PolarHBondContact O-N 3.32Å; R320-E323 VanDerWaalsContact O-N 3.09Å; E323-L325 VanDerWaalsContact C-N 3.27Å; E323-L325 PolarHBondContact O-N 2.68Å; E323-S326 PolarHBondContact O-N 2.87Å; E323-S326 PolarHBondContact O-OG 2.75Å; E323-E327 PolarHBondContact O-N 3.03Å |
| 324 | D | 88.8 | Confident | 86.7 | Confident | 91 Ų | 91 | 103.4 Ų | 103.4 | 49% | 0.487 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -55.7 | -39 | 176 | -61.8 | -24 | 0 | 0 | 0 | 111.8 | R320 R328 | R320-D324 WeakPolarHBondContact O-CB 3.34Å; R320-D324 PolarHBondContact O-N 2.89Å; D324-R328 WeakPolarHBondContact O-CB 3.45Å; D324-R328 WeakPolarHBondContact O-CG 3.23Å; D324-R328 PolarHBondContact O-N 3.41Å |
| 325 | L | 88.4 | Confident | 86.2 | Confident | 111 Ų | 111 | 104.1 Ų | 104.1 | 58% | 0.581 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -69.2 | -40.5 | 175 | -88.8 | 165.7 | 0 | 0 | 0 | 112.4 | L321 A322 E323 E327 R328 E329 | L321-L325 VanDerWaalsContact O-CB 3.27Å; L321-L325 WeakPolarHBondContact O-CB 3.18Å; L321-L325 WeakPolarHBondContact O-CD1 3.42Å; L321-L325 VanDerWaalsContact O-CG 3.31Å; L321-L325 WeakPolarHBondContact O-CG 3.4Å; L321-L325 PolarHBondContact O-N 3.33Å; A322-L325 PolarHBondContact O-N 2.81Å; E323-L325 VanDerWaalsContact C-N 3.27Å; E323-L325 PolarHBondContact O-N 2.68Å; L325-E327 VanDerWaalsContact C-N 3.32Å; L325-R328 PolarHBondContact O-N 3.17Å; L325-E329 WeakPolarHBondContact O-CB 3.24Å; L325-E329 PolarHBondContact O-N 3.01Å |
| 326 | S | 85.4 | Confident | 85.7 | Confident | 50 Ų | 50 | 108 Ų | 108 | 35% | 0.35 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -68.1 | -33.5 | 176.2 | 80.1 | 0 | 0 | 0 | 0 | 112.1 | A322 E323 E329 R330 | A322-S326 WeakPolarHBondContact O-CB 3.46Å; A322-S326 PolarHBondContact O-N 2.95Å; E323-S326 PolarHBondContact O-N 2.87Å; E323-S326 PolarHBondContact O-OG 2.75Å; S326-E329 PolarHBondContact O-N 2.81Å; S326-R330 WeakPolarHBondContact O-CB 3.29Å; S326-R330 PolarHBondContact O-N 2.83Å |
| 327 | E | 86.4 | Confident | 85.2 | Confident | 92 Ų | 92 | 108.9 Ų | 108.9 | 43% | 0.43 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66 | -46.2 | 171.8 | -173.8 | 128.8 | -79.5 | 0 | 0 | 110.5 | E323 L325 E329 R330 E331 | E323-E327 PolarHBondContact O-N 3.03Å; L325-E327 VanDerWaalsContact C-N 3.32Å; E327-E329 VanDerWaalsContact C-N 3.33Å; E327-E329 PolarHBondContact O-N 2.91Å; E327-R330 CarbonylContact O-C 3.53Å; E327-R330 WeakPolarHBondContact O-CA 3.44Å; E327-R330 VanDerWaalsContact O-CB 3.29Å; E327-R330 WeakPolarHBondContact O-CB 3.44Å; E327-R330 PolarHBondContact O-N 3.28Å; E327-R330 VanDerWaalsContact O-N 3.15Å; E327-R330 IonicContact OE1-CZ 3.78Å; E327-R330 IonicContact OE1-NH1 2.6Å; E327-R330 PolarHBondContact OE1-NH1 2.87Å; E327-R330 IonicContact OE1-NH2 3.79Å; E327-R330 PolarHBondContact OE1-NH2 3.15Å; E327-E331 WeakPolarHBondContact O-CG 3.37Å; E327-E331 PolarHBondContact O-N 3.42Å |
| 328 | R | 84.9 | Confident | 84.5 | Confident | 159 Ų | 159 | 105 Ų | 105 | 60% | 0.6 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.6 | -37.1 | 172.5 | -81.9 | -74.9 | 172.7 | 87.4 | 4.6 | 113.8 | D324 L325 R330 E331 I332 | D324-R328 WeakPolarHBondContact O-CB 3.45Å; D324-R328 WeakPolarHBondContact O-CG 3.23Å; D324-R328 PolarHBondContact O-N 3.41Å; L325-R328 PolarHBondContact O-N 3.17Å; R328-R330 VanDerWaalsContact C-N 3.32Å; R328-E331 WeakPolarHBondContact CD-OE2 3.41Å; R328-E331 IonicContact NE-OE2 3.17Å; R328-E331 PolarHBondContact NE-OE2 2.91Å; R328-E331 VanDerWaalsContact NE-OE2 3.17Å; R328-E331 PolarHBondContact O-N 2.98Å; R328-I332 WeakPolarHBondContact O-CB 3.31Å; R328-I332 WeakPolarHBondContact O-CD1 3.48Å; R328-I332 WeakPolarHBondContact O-CG1 3.27Å; R328-I332 PolarHBondContact O-N 3.22Å |
| 329 | E | 85.5 | Confident | 83.9 | Confident | 146 Ų | 146 | 105 Ų | 105 | 68% | 0.682 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -68.4 | -34.6 | 175.7 | -171 | 162 | -149.1 | 0 | 0 | 111.3 | L325 S326 E327 I332 A333 | L325-E329 WeakPolarHBondContact O-CB 3.24Å; L325-E329 PolarHBondContact O-N 3.01Å; S326-E329 PolarHBondContact O-N 2.81Å; E327-E329 VanDerWaalsContact C-N 3.33Å; E327-E329 PolarHBondContact O-N 2.91Å; E329-I332 PolarHBondContact O-N 3.47Å; E329-A333 WeakPolarHBondContact O-CB 3.45Å; E329-A333 PolarHBondContact O-N 2.82Å |
| 330 | R | 83.6 | Confident | 83.3 | Confident | 118 Ų | 118 | 109.1 Ų | 109.1 | 45% | 0.445 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -66.2 | -48.1 | 170.9 | -154 | -167 | -39.6 | 120.8 | 2.7 | 112.2 | S326 E327 R328 I332 A333 E334 | S326-R330 WeakPolarHBondContact O-CB 3.29Å; S326-R330 PolarHBondContact O-N 2.83Å; E327-R330 CarbonylContact O-C 3.53Å; E327-R330 WeakPolarHBondContact O-CA 3.44Å; E327-R330 VanDerWaalsContact O-CB 3.29Å; E327-R330 WeakPolarHBondContact O-CB 3.44Å; E327-R330 PolarHBondContact O-N 3.28Å; E327-R330 VanDerWaalsContact O-N 3.15Å; E327-R330 IonicContact OE1-CZ 3.78Å; E327-R330 IonicContact OE1-NH1 2.6Å; E327-R330 PolarHBondContact OE1-NH1 2.87Å; E327-R330 IonicContact OE1-NH2 3.79Å; E327-R330 PolarHBondContact OE1-NH2 3.15Å; R328-R330 VanDerWaalsContact C-N 3.32Å; R330-I332 VanDerWaalsContact C-N 3.27Å; R330-I332 PolarHBondContact O-N 3.47Å; R330-A333 WeakPolarHBondContact O-CB 3.49Å; R330-A333 PolarHBondContact O-N 3.08Å; R330-A333 VanDerWaalsContact O-N 3.08Å; R330-E334 PolarHBondContact O-N 3.35Å |
| 331 | E | 85.1 | Confident | 82.7 | Confident | 92 Ų | 92 | 105.7 Ų | 105.7 | 43% | 0.43 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -56.5 | -41 | 172.9 | -72.5 | -178.9 | 164.7 | 0 | 0 | 111.1 | E327 R328 E334 L335 | E327-E331 WeakPolarHBondContact O-CG 3.37Å; E327-E331 PolarHBondContact O-N 3.42Å; R328-E331 WeakPolarHBondContact CD-OE2 3.41Å; R328-E331 IonicContact NE-OE2 3.17Å; R328-E331 PolarHBondContact NE-OE2 2.91Å; R328-E331 VanDerWaalsContact NE-OE2 3.17Å; R328-E331 PolarHBondContact O-N 2.98Å; E331-E334 PolarHBondContact O-N 3.43Å; E331-L335 VanDerWaalsContact O-CB 3.24Å; E331-L335 WeakPolarHBondContact O-CB 3.42Å; E331-L335 VanDerWaalsContact O-CG 3.23Å; E331-L335 WeakPolarHBondContact O-CG 3.19Å; E331-L335 PolarHBondContact O-N 2.83Å |
| 332 | I | 82.4 | Confident | 81.8 | Confident | 79 Ų | 79 | 105.9 Ų | 105.9 | 41% | 0.405 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.6 | -34.9 | 176.5 | -72.5 | 165 | 0 | 0 | 0 | 111.7 | R328 E329 R330 R336 | R328-I332 WeakPolarHBondContact O-CB 3.31Å; R328-I332 WeakPolarHBondContact O-CD1 3.48Å; R328-I332 WeakPolarHBondContact O-CG1 3.27Å; R328-I332 PolarHBondContact O-N 3.22Å; E329-I332 PolarHBondContact O-N 3.47Å; R330-I332 VanDerWaalsContact C-N 3.27Å; R330-I332 PolarHBondContact O-N 3.47Å; I332-R336 WeakPolarHBondContact O-CB 3.49Å; I332-R336 WeakPolarHBondContact O-CG 3.42Å; I332-R336 PolarHBondContact O-N 2.94Å |
| 333 | A | 80.2 | Confident | 81 | Confident | 51 Ų | 51 | 106.6 Ų | 106.6 | 42% | 0.421 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -67.4 | -46.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | E329 R330 R336 Q337 | E329-A333 WeakPolarHBondContact O-CB 3.45Å; E329-A333 PolarHBondContact O-N 2.82Å; R330-A333 WeakPolarHBondContact O-CB 3.49Å; R330-A333 PolarHBondContact O-N 3.08Å; R330-A333 VanDerWaalsContact O-N 3.08Å; A333-R336 PolarHBondContact O-N 3.03Å; A333-Q337 WeakPolarHBondContact O-CB 3.46Å; A333-Q337 PolarHBondContact O-N 3.44Å |
| 334 | E | 81.8 | Confident | 79.9 | Confident | 116 Ų | 116 | 103 Ų | 103 | 54% | 0.542 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.9 | -45.7 | 174.3 | -71.8 | -178.7 | -177.4 | 0 | 0 | 111.4 | R330 E331 R336 Q337 T338 | R330-E334 PolarHBondContact O-N 3.35Å; E331-E334 PolarHBondContact O-N 3.43Å; E334-R336 PolarHBondContact O-N 2.95Å; E334-Q337 CarbonylContact O-C 3.58Å; E334-Q337 WeakPolarHBondContact O-CA 3.49Å; E334-Q337 WeakPolarHBondContact O-CB 3.35Å; E334-Q337 PolarHBondContact O-N 3.34Å; E334-T338 WeakPolarHBondContact O-CG2 3.37Å; E334-T338 PolarHBondContact O-N 3.44Å |
| 335 | L | 80.8 | Confident | 78.8 | Confident | 110 Ų | 110 | 102.9 Ų | 102.9 | 58% | 0.576 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -59.3 | -45.5 | 175.3 | -78.7 | 168.1 | 0 | 0 | 0 | 111.6 | E331 Q337 T338 L339 | E331-L335 VanDerWaalsContact O-CB 3.24Å; E331-L335 WeakPolarHBondContact O-CB 3.42Å; E331-L335 VanDerWaalsContact O-CG 3.23Å; E331-L335 WeakPolarHBondContact O-CG 3.19Å; E331-L335 PolarHBondContact O-N 2.83Å; L335-Q337 VanDerWaalsContact C-N 3.26Å; L335-Q337 PolarHBondContact O-N 2.93Å; L335-T338 PolarHBondContact O-N 2.76Å; L335-T338 PolarHBondContact O-OG1 3.43Å; L335-L339 WeakPolarHBondContact O-CB 3.22Å; L335-L339 PolarHBondContact O-N 3.19Å |
| 336 | R | 78.2 | Confident | 77.6 | Confident | 170 Ų | 170 | 103.8 Ų | 103.8 | 64% | 0.642 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -58 | -38.3 | 172.5 | -78.5 | 169.3 | 173.9 | 170 | 0.1 | 112.2 | I332 A333 E334 L339 L340 | I332-R336 WeakPolarHBondContact O-CB 3.49Å; I332-R336 WeakPolarHBondContact O-CG 3.42Å; I332-R336 PolarHBondContact O-N 2.94Å; A333-R336 PolarHBondContact O-N 3.03Å; E334-R336 PolarHBondContact O-N 2.95Å; R336-L339 WeakPolarHBondContact O-CB 3.47Å; R336-L339 PolarHBondContact O-N 3.39Å; R336-L340 WeakPolarHBondContact O-CG 3.48Å; R336-L340 PolarHBondContact O-N 3.33Å |
| 337 | Q | 79 | Confident | 76.7 | Confident | 131 Ų | 131 | 102.9 Ų | 102.9 | 61% | 0.612 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -71.3 | -36.7 | 178 | -163.6 | 165.2 | -10.7 | 0 | 0 | 112.2 | A333 E334 L335 L339 L340 N341 | A333-Q337 WeakPolarHBondContact O-CB 3.46Å; A333-Q337 PolarHBondContact O-N 3.44Å; E334-Q337 CarbonylContact O-C 3.58Å; E334-Q337 WeakPolarHBondContact O-CA 3.49Å; E334-Q337 WeakPolarHBondContact O-CB 3.35Å; E334-Q337 PolarHBondContact O-N 3.34Å; L335-Q337 VanDerWaalsContact C-N 3.26Å; L335-Q337 PolarHBondContact O-N 2.93Å; Q337-L339 VanDerWaalsContact C-N 3.34Å; Q337-L340 PolarHBondContact O-N 3.09Å; Q337-N341 VanDerWaalsContact O-CG 3.24Å; Q337-N341 PolarHBondContact O-N 3.47Å; Q337-N341 VanDerWaalsContact O-N 3.09Å; Q337-N341 PolarHBondContact O-ND2 3.13Å |
| 338 | T | 77.3 | Confident | 75.4 | Confident | 68 Ų | 68 | 104 Ų | 104 | 42% | 0.417 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.3 | -34.8 | 168.8 | 65.7 | 0 | 0 | 0 | 0 | 112.4 | E334 L335 N341 L342 | E334-T338 WeakPolarHBondContact O-CG2 3.37Å; E334-T338 PolarHBondContact O-N 3.44Å; L335-T338 PolarHBondContact O-N 2.76Å; L335-T338 PolarHBondContact O-OG1 3.43Å; T338-N341 PolarHBondContact O-N 2.93Å; T338-L342 WeakPolarHBondContact O-CB 3.48Å; T338-L342 WeakPolarHBondContact O-CG 3.45Å; T338-L342 PolarHBondContact O-N 2.83Å |
| 339 | L | 75.9 | Confident | 74.3 | Confident | 106 Ų | 106 | 101.6 Ų | 101.6 | 56% | 0.555 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -66.4 | -43.5 | 175.9 | -127.7 | 169.2 | 0 | 0 | 0 | 111.2 | L335 R336 Q337 N341 L342 T343 | L335-L339 WeakPolarHBondContact O-CB 3.22Å; L335-L339 PolarHBondContact O-N 3.19Å; R336-L339 WeakPolarHBondContact O-CB 3.47Å; R336-L339 PolarHBondContact O-N 3.39Å; Q337-L339 VanDerWaalsContact C-N 3.34Å; L339-N341 VanDerWaalsContact C-N 3.32Å; L339-N341 PolarHBondContact O-N 2.86Å; L339-L342 PolarHBondContact O-N 3.18Å; L339-T343 PolarHBondContact O-N 2.87Å; L339-T343 PolarHBondContact O-OG1 3.17Å; L339-T343 VanDerWaalsContact O-OG1 3.13Å |
| 340 | L | 74.4 | Confident | 73.1 | Confident | 125 Ų | 125 | 97.6 Ų | 97.6 | 65% | 0.654 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.4 | -41.9 | 172.7 | -73.6 | 168.6 | 0 | 0 | 0 | 112 | R336 Q337 T343 A344 | R336-L340 WeakPolarHBondContact O-CG 3.48Å; R336-L340 PolarHBondContact O-N 3.33Å; Q337-L340 PolarHBondContact O-N 3.09Å; L340-T343 PolarHBondContact O-N 3.43Å; L340-A344 PolarHBondContact O-N 3.13Å; L340-A344 VanDerWaalsContact O-N 3.08Å |
| 341 | N | 75.4 | Confident | 72 | Confident | 104 Ų | 104 | 96.1 Ų | 96.1 | 56% | 0.556 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65.5 | -38.7 | 175 | -66.2 | -16.2 | 0 | 0 | 0 | 112 | Q337 T338 L339 A344 V345 | Q337-N341 VanDerWaalsContact O-CG 3.24Å; Q337-N341 PolarHBondContact O-N 3.47Å; Q337-N341 VanDerWaalsContact O-N 3.09Å; Q337-N341 PolarHBondContact O-ND2 3.13Å; T338-N341 PolarHBondContact O-N 2.93Å; L339-N341 VanDerWaalsContact C-N 3.32Å; L339-N341 PolarHBondContact O-N 2.86Å; N341-A344 WeakPolarHBondContact O-CB 3.41Å; N341-A344 PolarHBondContact O-N 3.3Å; N341-V345 WeakPolarHBondContact O-CG2 3.47Å; N341-V345 PolarHBondContact O-N 3.35Å |
| 342 | L | 70.6 | Confident | 70.8 | Confident | 112 Ų | 112 | 95 Ų | 95 | 59% | 0.586 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -68.6 | -39.7 | 176.2 | -78.1 | 164.9 | 0 | 0 | 0 | 112.3 | T338 L339 A344 V345 E346 | T338-L342 WeakPolarHBondContact O-CB 3.48Å; T338-L342 WeakPolarHBondContact O-CG 3.45Å; T338-L342 PolarHBondContact O-N 2.83Å; L339-L342 PolarHBondContact O-N 3.18Å; L342-A344 VanDerWaalsContact C-N 3.28Å; L342-A344 PolarHBondContact O-N 3.46Å; L342-V345 CarbonylContact O-C 3.6Å; L342-V345 PolarHBondContact O-N 3.47Å; L342-E346 WeakPolarHBondContact O-CB 3.36Å; L342-E346 PolarHBondContact O-N 2.82Å |
| 343 | T | 67.9 | Low | 69.6 | Low | 72 Ų | 72 | 95.4 Ų | 95.4 | 44% | 0.442 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.6 | -29.4 | 174.6 | -59.3 | 0 | 0 | 0 | 0 | 112.1 | L339 L340 G347 | L339-T343 PolarHBondContact O-N 2.87Å; L339-T343 PolarHBondContact O-OG1 3.17Å; L339-T343 VanDerWaalsContact O-OG1 3.13Å; L340-T343 PolarHBondContact O-N 3.43Å; T343-G347 PolarHBondContact O-N 3.06Å |
| 344 | A | 65.2 | Low | 68.6 | Low | 59 Ų | 59 | 100.3 Ų | 100.3 | 49% | 0.488 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.8 | -46.6 | 169.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | L340 N341 L342 E346 G347 D348 | L340-A344 PolarHBondContact O-N 3.13Å; L340-A344 VanDerWaalsContact O-N 3.08Å; N341-A344 WeakPolarHBondContact O-CB 3.41Å; N341-A344 PolarHBondContact O-N 3.3Å; L342-A344 VanDerWaalsContact C-N 3.28Å; L342-A344 PolarHBondContact O-N 3.46Å; A344-E346 VanDerWaalsContact C-N 3.34Å; A344-E346 PolarHBondContact O-N 2.99Å; A344-G347 WeakPolarHBondContact O-CA 3.43Å; A344-G347 PolarHBondContact O-N 3.08Å; A344-G347 VanDerWaalsContact O-N 3.13Å; A344-D348 PolarHBondContact O-N 3.43Å |
| 345 | V | 67.4 | Low | 67.5 | Low | 89 Ų | 89 | 100.6 Ų | 100.6 | 54% | 0.539 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.7 | -35.6 | 176.1 | 174 | 0 | 0 | 0 | 0 | 112.3 | N341 L342 G347 D348 L349 | N341-V345 WeakPolarHBondContact O-CG2 3.47Å; N341-V345 PolarHBondContact O-N 3.35Å; L342-V345 CarbonylContact O-C 3.6Å; L342-V345 PolarHBondContact O-N 3.47Å; V345-G347 VanDerWaalsContact C-N 3.33Å; V345-D348 PolarHBondContact O-N 3.2Å; V345-L349 WeakPolarHBondContact O-CB 3.45Å; V345-L349 PolarHBondContact O-N 2.93Å |
| 346 | E | 61.4 | Low | 66.4 | Low | 130 Ų | 130 | 100.2 Ų | 100.2 | 61% | 0.607 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -64.5 | -38.3 | 172.2 | -173.9 | 178.6 | -168 | 0 | 0 | 111.5 | L342 A344 L349 S350 | L342-E346 WeakPolarHBondContact O-CB 3.36Å; L342-E346 PolarHBondContact O-N 2.82Å; A344-E346 VanDerWaalsContact C-N 3.34Å; A344-E346 PolarHBondContact O-N 2.99Å; E346-L349 PolarHBondContact O-N 3.03Å; E346-S350 PolarHBondContact O-N 2.71Å |
| 347 | G | 66.8 | Low | 65.3 | Low | 32 Ų | 32 | 96 Ų | 96 | 33% | 0.33 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -56 | -53.5 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | T343 A344 V345 L349 S350 V351 | T343-G347 PolarHBondContact O-N 3.06Å; A344-G347 WeakPolarHBondContact O-CA 3.43Å; A344-G347 PolarHBondContact O-N 3.08Å; A344-G347 VanDerWaalsContact O-N 3.13Å; V345-G347 VanDerWaalsContact C-N 3.33Å; G347-L349 VanDerWaalsContact C-N 3.34Å; G347-L349 PolarHBondContact O-N 3.2Å; G347-S350 WeakPolarHBondContact O-CB 3.38Å; G347-S350 PolarHBondContact O-N 3.44Å; G347-S350 PolarHBondContact O-OG 3.12Å; G347-V351 PolarHBondContact O-N 3.37Å |
| 348 | D | 60.4 | Low | 64.2 | Low | 115 Ų | 115 | 98 Ų | 98 | 62% | 0.615 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -60.1 | -42.3 | 177.2 | -69.5 | -26.5 | 0 | 0 | 0 | 112 | A344 V345 S350 V351 T352 | A344-D348 PolarHBondContact O-N 3.43Å; V345-D348 PolarHBondContact O-N 3.2Å; D348-S350 VanDerWaalsContact C-N 3.29Å; D348-S350 PolarHBondContact O-N 3.39Å; D348-V351 WeakPolarHBondContact O-CB 3.46Å; D348-V351 PolarHBondContact O-N 3.4Å; D348-V351 VanDerWaalsContact O-N 3.12Å; D348-T352 PolarHBondContact O-N 3.01Å |
| 349 | L | 60.2 | Low | 63.2 | Low | 108 Ų | 108 | 101.3 Ų | 101.3 | 57% | 0.565 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -65.8 | -30.8 | 178.7 | -165.2 | 68.5 | 0 | 0 | 0 | 112.5 | V345 E346 G347 V351 T352 T353 | V345-L349 WeakPolarHBondContact O-CB 3.45Å; V345-L349 PolarHBondContact O-N 2.93Å; E346-L349 PolarHBondContact O-N 3.03Å; G347-L349 VanDerWaalsContact C-N 3.34Å; G347-L349 PolarHBondContact O-N 3.2Å; L349-V351 VanDerWaalsContact C-N 3.29Å; L349-V351 PolarHBondContact O-N 2.94Å; L349-T352 WeakPolarHBondContact CA-OG1 3.45Å; L349-T352 PolarHBondContact O-OG1 3.38Å; L349-T353 WeakPolarHBondContact O-CB 3.49Å; L349-T353 PolarHBondContact O-N 2.68Å; L349-T353 PolarHBondContact O-OG1 3.47Å |
| 350 | S | 61.1 | Low | 62 | Low | 63 Ų | 63 | 100.1 Ų | 100.1 | 44% | 0.441 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67.5 | -29.7 | 174.3 | 84.3 | 0 | 0 | 0 | 0 | 112.8 | E346 G347 D348 | E346-S350 PolarHBondContact O-N 2.71Å; G347-S350 WeakPolarHBondContact O-CB 3.38Å; G347-S350 PolarHBondContact O-N 3.44Å; G347-S350 PolarHBondContact O-OG 3.12Å; D348-S350 VanDerWaalsContact C-N 3.29Å; D348-S350 PolarHBondContact O-N 3.39Å |
| 351 | V | 60.9 | Low | 60.6 | Low | 86 Ų | 86 | 101.6 Ų | 101.6 | 52% | 0.521 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -73.5 | -48.2 | 175.8 | 178.4 | 0 | 0 | 0 | 0 | 110.1 | G347 D348 L349 T353 K354 Q355 | G347-V351 PolarHBondContact O-N 3.37Å; D348-V351 WeakPolarHBondContact O-CB 3.46Å; D348-V351 PolarHBondContact O-N 3.4Å; D348-V351 VanDerWaalsContact O-N 3.12Å; L349-V351 VanDerWaalsContact C-N 3.29Å; L349-V351 PolarHBondContact O-N 2.94Å; V351-T353 VanDerWaalsContact C-N 3.31Å; V351-T353 PolarHBondContact O-N 3.39Å; V351-K354 PolarHBondContact O-N 3.28Å; V351-Q355 PolarHBondContact O-N 3.46Å |
| 352 | T | 59.9 | Low | 59.3 | Low | 68 Ų | 68 | 104.3 Ų | 104.3 | 42% | 0.417 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.2 | -35.9 | 178.5 | 55.3 | 0 | 0 | 0 | 0 | 112.4 | D348 L349 K354 Q355 V356 | D348-T352 PolarHBondContact O-N 3.01Å; L349-T352 WeakPolarHBondContact CA-OG1 3.45Å; L349-T352 PolarHBondContact O-OG1 3.38Å; T352-K354 VanDerWaalsContact C-N 3.32Å; T352-K354 PolarHBondContact O-N 3.47Å; T352-Q355 PolarHBondContact O-N 3.43Å; T352-V356 PolarHBondContact O-N 3.4Å |
| 353 | T | 56.3 | Low | 58 | Low | 88 Ų | 88 | 104.5 Ų | 104.5 | 54% | 0.54 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -63.3 | -37.6 | 179.2 | -57.2 | 0 | 0 | 0 | 0 | 112.1 | L349 V351 Q355 V356 | L349-T353 WeakPolarHBondContact O-CB 3.49Å; L349-T353 PolarHBondContact O-N 2.68Å; L349-T353 PolarHBondContact O-OG1 3.47Å; V351-T353 VanDerWaalsContact C-N 3.31Å; V351-T353 PolarHBondContact O-N 3.39Å; T353-Q355 VanDerWaalsContact C-N 3.3Å; T353-Q355 PolarHBondContact O-N 2.88Å; T353-V356 PolarHBondContact O-N 3.31Å |
| 354 | K | 59.8 | Low | 56.7 | Low | 154 Ų | 154 | 108.2 Ų | 108.2 | 67% | 0.67 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -69.2 | -25.2 | 176.3 | -75.2 | 179.1 | 177.6 | 175.6 | 0 | 113.8 | V351 T352 V356 S357 | V351-K354 PolarHBondContact O-N 3.28Å; T352-K354 VanDerWaalsContact C-N 3.32Å; T352-K354 PolarHBondContact O-N 3.47Å; K354-V356 VanDerWaalsContact C-N 3.32Å; K354-S357 PolarHBondContact O-OG 3.17Å |
| 355 | Q | 58 | Low | 55.7 | Low | 123 Ų | 123 | 113 Ų | 113 | 58% | 0.575 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -76.2 | -19.2 | 175.8 | -67.3 | -179.6 | -39.7 | 0 | 0 | 112.9 | V351 T352 T353 I359 | V351-Q355 PolarHBondContact O-N 3.46Å; T352-Q355 PolarHBondContact O-N 3.43Å; T353-Q355 VanDerWaalsContact C-N 3.3Å; T353-Q355 PolarHBondContact O-N 2.88Å; Q355-I359 WeakPolarHBondContact O-CD1 3.45Å |
| 356 | V | 59.2 | Low | 54.5 | Low | 102 Ų | 102 | 112 Ų | 112 | 62% | 0.618 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -83 | -31.6 | 177.1 | 178.3 | 0 | 0 | 0 | 0 | 111.7 | T352 T353 K354 E358 I359 | T352-V356 PolarHBondContact O-N 3.4Å; T353-V356 PolarHBondContact O-N 3.31Å; K354-V356 VanDerWaalsContact C-N 3.32Å; V356-E358 PolarHBondContact O-N 3.24Å; V356-I359 PolarHBondContact O-N 3.22Å |
| 357 | S | 54.4 | Low | 53.5 | Low | 82 Ų | 82 | 114.7 Ų | 114.7 | 57% | 0.573 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.5 | -16.6 | -178.9 | 41 | 0 | 0 | 0 | 0 | 115.3 | K354 | K354-S357 PolarHBondContact O-OG 3.17Š|
| 358 | E | 56.3 | Low | 52.7 | Low | 171 Ų | 171 | 120.5 Ų | 120.5 | 80% | 0.799 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | -1.2 | 177.8 | -65.6 | -174.4 | 133.2 | 0 | 0 | 113.7 | V356 | V356-E358 PolarHBondContact O-N 3.24Š|
| 359 | I | 55.1 | Low | 51.7 | Low | 138 Ų | 138 | 122 Ų | 122 | 71% | 0.708 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.2 | -15.9 | -172.5 | -64.3 | 176.6 | 0 | 0 | 0 | 112.9 | Q355 V356 | Q355-I359 WeakPolarHBondContact O-CD1 3.45Å; V356-I359 PolarHBondContact O-N 3.22Å |
| 360 | A | 50.9 | Low | 50.8 | Low | 82 Ų | 82 | 123.5 Ų | 123.5 | 68% | 0.678 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -88.4 | -15 | -169.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | L362 | A360-L362 PolarHBondContact O-N 3.37Š|
| 361 | D | 46.1 | Very low | 50.1 | Low | 156 Ų | 156 | 127.6 Ų | 127.6 | 83% | 0.834 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -91.6 | 19.2 | -164.4 | -98.2 | -4.1 | 0 | 0 | 0 | 115.5 | ||
| 362 | L | 47.3 | Very low | 49.1 | Very low | 161 Ų | 161 | 137 Ų | 137 | 84% | 0.843 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -136.7 | 15.5 | -165.5 | -100 | 174.7 | 0 | 0 | 0 | 119.1 | A360 | A360-L362 PolarHBondContact O-N 3.37Š|
| 363 | S | 43.1 | Very low | 48.5 | Very low | 116 Ų | 116 | 140.5 Ų | 140.5 | 81% | 0.811 | 75% | 0.753 | S | S | * | * | trans | -174.5 | 144.2 | 164.7 | -87.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 364 | D | 40.8 | Very low | 48.1 | Very low | 149 Ų | 149 | 143.3 Ų | 143.3 | 80% | 0.797 | 76% | 0.764 | S | S | * | * | cis | -159.4 | 174.8 | -32.1 | -160.4 | -0.3 | 0 | 0 | 0 | 108.1 | ||||
| 365 | I | 44.4 | Very low | 47.5 | Very low | 159 Ų | 159 | 142.7 Ų | 142.7 | 82% | 0.815 | 77% | 0.769 | S | S | * | * | trans | -65.5 | 136.6 | -175.2 | -69.1 | 166 | 0 | 0 | 0 | 113 | ||||
| 366 | G | 41.7 | Very low | 46.9 | Very low | 70 Ų | 70 | 143.8 Ų | 143.8 | 72% | 0.722 | 78% | 0.781 | S | S | * | * | trans | -168.7 | 41.3 | -179 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 367 | E | 41.5 | Very low | 46.1 | Very low | 185 Ų | 185 | 146.4 Ų | 146.4 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | trans | 45.9 | 141.9 | 160.2 | -62.2 | -168.4 | 151.5 | 0 | 0 | 121.3 | ||||
| 368 | M | 49.3 | Very low | 45.5 | Very low | 155 Ų | 155 | 150.7 Ų | 150.7 | 76% | 0.764 | 81% | 0.805 | S | S | * | * | cis | -177.8 | 150.9 | -26.5 | -116.9 | -91.7 | -88.9 | 0 | 0 | 107.4 | ||||
| 369 | Q | 40 | Very low | 44.8 | Very low | 146 Ų | 146 | 149.3 Ų | 149.3 | 68% | 0.682 | 81% | 0.806 | S | S | * | * | trans | 65.7 | 111.2 | 170.4 | -54.2 | -178.6 | 2.6 | 0 | 0 | 120 | ||||
| 370 | N | 41 | Very low | 44 | Very low | 139 Ų | 139 | 150.2 Ų | 150.2 | 74% | 0.743 | 81% | 0.813 | S | S | * | * | 174.5 | 118.4 | 102.2 | -92.7 | -80.8 | 0 | 0 | 0 | 108.1 | |||||
| 371 | L | 45.5 | Very low | 43.4 | Very low | 150 Ų | 150 | 155.8 Ų | 155.8 | 79% | 0.785 | 83% | 0.825 | S | S | * | * | 72 | 73.1 | 62.9 | -71.9 | 171.3 | 0 | 0 | 0 | 115.6 | |||||
| 372 | K | 39.9 | Very low | 43.1 | Very low | 284 Ų | 284 | 155.8 Ų | 155.8 | 100% | 1.235 | 82% | 0.824 | S | S | * | * | -157.5 | 0 | 116 | -117.8 | 178 | -177.7 | 176.9 | 0 | 113.2 |
Retrieved 372 of 372 residues in 293.1 ms
(Link to these results)