| 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 | 37.3 | Very low | 44.2 | Very low | 227 Ų | 227 | 144.6 Ų | 144.6 | 100% | 1.118 | 82% | 0.821 | S | S | * | * | 0 | 134.7 | 0 | -71.1 | 162.2 | 67.5 | 0 | 0 | 107.6 | |||||
| 2 | L | 39.3 | Very low | 44.5 | Very low | 165 Ų | 165 | 148.3 Ų | 148.3 | 86% | 0.864 | 83% | 0.826 | S | S | * | * | trans | 44.8 | 150.1 | 155.2 | -51.3 | 173.2 | 0 | 0 | 0 | 121.1 | ||||
| 3 | A | 44.8 | Very low | 44.4 | Very low | 80 Ų | 80 | 143.6 Ų | 143.6 | 66% | 0.661 | 81% | 0.81 | S | S | * | * | cis | -178.5 | 157.9 | -41.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 4 | V | 43.1 | Very low | 44.4 | Very low | 149 Ų | 149 | 139.4 Ų | 139.4 | 90% | 0.903 | 80% | 0.801 | S | S | * | * | trans | 69.5 | 130.4 | 164.5 | -175.9 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 5 | G | 46.7 | Very low | 44.5 | Very low | 78 Ų | 78 | 142.5 Ų | 142.5 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | -177.3 | 47.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 6 | Q | 41.8 | Very low | 45 | Very low | 178 Ų | 178 | 143.2 Ų | 143.2 | 83% | 0.832 | 80% | 0.802 | S | S | * | * | trans | -86.4 | 131.7 | -172.3 | -175.6 | 176.1 | 5.1 | 0 | 0 | 111.2 | ||||
| 7 | M | 51.9 | Low | 45.7 | Very low | 181 Ų | 181 | 145.1 Ų | 145.1 | 89% | 0.892 | 81% | 0.809 | S | S | * | * | trans | -135.3 | 114.3 | 162.2 | 48 | 138.2 | 59.1 | 0 | 0 | 109.5 | ||||
| 8 | D | 41.4 | Very low | 45.6 | Very low | 129 Ų | 129 | 143.2 Ų | 143.2 | 69% | 0.69 | 81% | 0.808 | S | S | * | * | trans | -82.6 | 139.2 | 170.3 | -164.4 | -74.4 | 0 | 0 | 0 | 109.3 | S10 | D8-S10 PolarHBondContact OD1-N 3.3Å; D8-S10 VanDerWaalsContact OD1-N 3.12Å; D8-S10 PolarHBondContact OD1-OG 3.15Å | ||
| 9 | G | 47.4 | Very low | 46.2 | Very low | 69 Ų | 69 | 142.4 Ų | 142.4 | 71% | 0.711 | 81% | 0.806 | S | S | * | * | trans | -138.7 | 46.3 | -174.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | R11 | G9-R11 PolarHBondContact O-N 3.07Š| ||
| 10 | S | 45.6 | Very low | 46.9 | Very low | 91 Ų | 91 | 140.8 Ų | 140.8 | 64% | 0.636 | 80% | 0.802 | S | S | * | * | trans | -44.1 | 104.7 | 179.9 | -75.6 | 0 | 0 | 0 | 0 | 114.3 | D8 | D8-S10 PolarHBondContact OD1-N 3.3Å; D8-S10 VanDerWaalsContact OD1-N 3.12Å; D8-S10 PolarHBondContact OD1-OG 3.15Å | ||
| 11 | R | 46.5 | Very low | 47.4 | Very low | 244 Ų | 244 | 140 Ų | 140 | 92% | 0.921 | 80% | 0.802 | S | S | * | * | trans | -124.4 | 75.7 | 161.6 | -84.7 | -171.2 | 163.8 | -99.9 | -2.8 | 110.6 | G9 S13 | G9-R11 PolarHBondContact O-N 3.07Å; R11-S13 PolarHBondContact O-N 3.4Å | ||
| 12 | Q | 48.1 | Very low | 48.2 | Very low | 189 Ų | 189 | 138.1 Ų | 138.1 | 88% | 0.883 | 80% | 0.795 | S | S | * | * | trans | -68.6 | 118.3 | 160.6 | -58.9 | -179.4 | 23.6 | 0 | 0 | 108.5 | ||||
| 13 | S | 43 | Very low | 48.9 | Very low | 87 Ų | 87 | 134.7 Ų | 134.7 | 61% | 0.608 | 79% | 0.791 | S | S | * | * | trans | -147.8 | 72.5 | 160.6 | -165 | 0 | 0 | 0 | 0 | 109.1 | R11 F15 | R11-S13 PolarHBondContact O-N 3.4Å; S13-F15 PolarHBondContact O-N 3.07Å; S13-F15 VanDerWaalsContact O-N 3.15Å | ||
| 14 | A | 45.2 | Very low | 49.1 | Very low | 84 Ų | 84 | 135.6 Ų | 135.6 | 69% | 0.694 | 80% | 0.799 | S | S | * | * | trans | -71.5 | 102.2 | 171.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | L16 | A14-L16 HydrophobicContact CB-CG 4.4Å; A14-L16 PolarHBondContact O-N 3.29Å | ||
| 15 | F | 45.1 | Very low | 49.6 | Very low | 187 Ų | 187 | 136.3 Ų | 136.3 | 82% | 0.82 | 80% | 0.797 | S | S | * | * | trans | -71.1 | 76.6 | 165.6 | -76.1 | -79.8 | 0 | 0 | 0 | 109.6 | S13 | S13-F15 PolarHBondContact O-N 3.07Å; S13-F15 VanDerWaalsContact O-N 3.15Å | ||
| 16 | L | 53.5 | Low | 50 | Low | 153 Ų | 153 | 142.2 Ų | 142.2 | 80% | 0.801 | 80% | 0.803 | S | S | * | * | trans | -66.7 | 130.7 | 167.8 | -71.7 | 172.3 | 0 | 0 | 0 | 109.1 | A14 S18 | A14-L16 HydrophobicContact CB-CG 4.4Å; A14-L16 PolarHBondContact O-N 3.29Å; L16-S18 PolarHBondContact O-N 3.46Å | ||
| 17 | L | 56 | Low | 50.6 | Low | 176 Ų | 176 | 139 Ų | 139 | 92% | 0.921 | 80% | 0.8 | S | S | * | * | trans | -60.2 | 118.3 | 166.6 | -80 | 71.5 | 0 | 0 | 0 | 108.5 | ||||
| 18 | S | 44.4 | Very low | 50.1 | Low | 111 Ų | 111 | 138 Ų | 138 | 78% | 0.776 | 80% | 0.795 | S | S | * | * | trans | -136.7 | 123.5 | 160.6 | -163.6 | 0 | 0 | 0 | 0 | 110.4 | L16 | L16-S18 PolarHBondContact O-N 3.46Š| ||
| 19 | T | 56.5 | Low | 50.8 | Low | 127 Ų | 127 | 136.9 Ų | 136.9 | 78% | 0.779 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 136.5 | 174.4 | -12.3 | 0 | 0 | 0 | 0 | 110.1 | ||
| 20 | P | 61.2 | Low | 50.8 | Low | 111 Ų | 111 | 142.9 Ų | 142.9 | 72% | 0.721 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 134.1 | 174.3 | 29.3 | -33.8 | 0 | 0 | 0 | 110.9 | ||
| 21 | P | 56.5 | Low | 50.7 | Low | 123 Ų | 123 | 146.5 Ų | 146.5 | 80% | 0.799 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 126.3 | 174 | 29.1 | -32.5 | 0 | 0 | 0 | 111.4 | A23 | P21-A23 PolarHBondContact O-N 3.38Š|
| 22 | L | 53.8 | Low | 50.5 | Low | 188 Ų | 188 | 144.4 Ų | 144.4 | 98% | 0.984 | 81% | 0.809 | S | S | * | * | trans | -74.3 | 87.7 | 173 | -78.5 | 166.6 | 0 | 0 | 0 | 110.9 | ||||
| 23 | A | 53.8 | Low | 50.8 | Low | 94 Ų | 94 | 141.9 Ų | 141.9 | 78% | 0.777 | 81% | 0.807 | S | S | * | * | trans | -153.6 | 65.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | P21 | P21-A23 PolarHBondContact O-N 3.38Š| ||
| 24 | A | 48.9 | Very low | 51.3 | Low | 99 Ų | 99 | 143.1 Ų | 143.1 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | trans | -151.4 | 50.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 25 | L | 54.7 | Low | 51.1 | Low | 164 Ų | 164 | 146.2 Ų | 146.2 | 86% | 0.859 | 82% | 0.817 | S | S | * | * | trans | -139.1 | 82.3 | 168.6 | -89.4 | 173.3 | 0 | 0 | 0 | 109.3 | ||||
| 26 | H | 55.6 | Low | 50.8 | Low | 201 Ų | 201 | 147.6 Ų | 147.6 | 93% | 0.931 | 82% | 0.818 | S | S | * | * | trans | 178.7 | 84.9 | 157 | -87 | 166.8 | 0 | 0 | 0 | 109.1 | ||||
| 27 | S | 53.9 | Low | 50.9 | Low | 111 Ų | 111 | 145.9 Ų | 145.9 | 78% | 0.776 | 82% | 0.816 | S | S | * | * | trans | -171.6 | 81.2 | 161 | 176.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 28 | M | 41.8 | Very low | 50.1 | Low | 159 Ų | 159 | 140.8 Ų | 140.8 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | S | Bend | trans | -161.3 | 106.9 | 149.9 | -78.8 | -43.2 | -72 | 0 | 0 | 109.1 | ||
| 29 | T | 54.5 | Low | 49.8 | Very low | 107 Ų | 107 | 146.1 Ų | 146.1 | 66% | 0.656 | 80% | 0.804 | S | S | * | * | trans | 35.1 | 105.1 | 141.2 | 59.3 | 0 | 0 | 0 | 0 | 117 | ||||
| 30 | E | 48.6 | Very low | 49.8 | Very low | 194 Ų | 194 | 145 Ų | 145 | 91% | 0.907 | 80% | 0.799 | S | S | * | * | 42.7 | 99.4 | 52.6 | -164 | 172.5 | -154.5 | 0 | 0 | 114.5 | |||||
| 31 | M | 44.1 | Very low | 48.6 | Very low | 167 Ų | 167 | 147 Ų | 147 | 82% | 0.823 | 80% | 0.803 | S | S | * | * | trans | -174.4 | 77 | 152.4 | 48.9 | 175.2 | -70.6 | 0 | 0 | 114.2 | ||||
| 32 | K | 42 | Very low | 47.6 | Very low | 201 Ų | 201 | 146.3 Ų | 146.3 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | trans | -166.8 | 104 | 144 | -147.7 | 102.4 | 176.7 | -169.3 | 0 | 112.7 | ||||
| 33 | T | 52.8 | Low | 46.7 | Very low | 136 Ų | 136 | 142.2 Ų | 142.2 | 83% | 0.834 | 79% | 0.788 | S | S | * | * | trans | -125.4 | 150 | 151.1 | 48.7 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 34 | P | 54.3 | Low | 45.7 | Very low | 113 Ų | 113 | 143.5 Ų | 143.5 | 73% | 0.734 | 79% | 0.786 | S | S | * | * | trans | -131.1 | 121.9 | 135 | 33 | -22.9 | 0 | 0 | 0 | 112.9 | ||||
| 35 | L | 41.4 | Very low | 45.1 | Very low | 148 Ų | 148 | 144.9 Ų | 144.9 | 78% | 0.775 | 79% | 0.789 | S | S | * | * | trans | 14.2 | 117.5 | 149 | -68 | 110.8 | 0 | 0 | 0 | 122.1 | ||||
| 36 | Y | 38.6 | Very low | 44.9 | Very low | 216 Ų | 216 | 142.1 Ų | 142.1 | 85% | 0.847 | 78% | 0.781 | S | S | * | * | 58.8 | 164.4 | 125.5 | -79.5 | -88.6 | 0 | 0 | 0 | 121.8 | |||||
| 37 | P | 55.6 | Low | 44.1 | Very low | 117 Ų | 117 | 140.6 Ų | 140.6 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | cis | -127.7 | 178.2 | -5.8 | 25.3 | -1.3 | 0 | 0 | 0 | 116.6 | ||||
| 38 | A | 39.6 | Very low | 43.2 | Very low | 70 Ų | 70 | 140.9 Ų | 140.9 | 58% | 0.579 | 78% | 0.781 | S | S | * | * | trans | -76.1 | 171.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 39 | Y | 38.2 | Very low | 43 | Very low | 223 Ų | 223 | 138.5 Ų | 138.5 | 88% | 0.875 | 78% | 0.781 | S | S | * | * | cis | -154.8 | -145 | 43.8 | -76.8 | -86.4 | 0 | 0 | 0 | 113 | ||||
| 40 | P | 56.4 | Low | 42.2 | Very low | 104 Ų | 104 | 140 Ų | 140 | 68% | 0.675 | 79% | 0.79 | S | S | * | * | -129.2 | -161.1 | -115.3 | 37.5 | -13.2 | 0 | 0 | 0 | 116.4 | |||||
| 41 | L | 34.8 | Very low | 41.9 | Very low | 151 Ų | 151 | 135.7 Ų | 135.7 | 79% | 0.791 | 78% | 0.781 | S | S | * | * | trans | 98.4 | 118.5 | 168.2 | -74.6 | 99.9 | 0 | 0 | 0 | 120 | ||||
| 42 | S | 35.6 | Very low | 42.4 | Very low | 110 Ų | 110 | 133.2 Ų | 133.2 | 77% | 0.769 | 78% | 0.777 | S | S | * | * | 24.9 | 124.4 | 122.4 | -45.2 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 43 | S | 34.7 | Very low | 42.1 | Very low | 102 Ų | 102 | 128.1 Ų | 128.1 | 71% | 0.713 | 77% | 0.773 | S | S | * | * | 171.8 | 134.3 | 108.1 | -167 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 44 | T | 34.5 | Very low | 41.1 | Very low | 120 Ų | 120 | 127.6 Ų | 127.6 | 74% | 0.736 | 77% | 0.769 | S | S | * | * | trans | 27 | 115.2 | 138.2 | -33.3 | 0 | 0 | 0 | 0 | 120 | ||||
| 45 | C | 34.6 | Very low | 40.4 | Very low | 128 Ų | 128 | 128.3 Ų | 128.3 | 87% | 0.865 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 123.2 | 159.7 | -57.6 | 0 | 0 | 0 | 0 | 110.5 | ||
| 46 | P | 50.7 | Low | 40.4 | Very low | 107 Ų | 107 | 126.3 Ų | 126.3 | 70% | 0.695 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 137.4 | 171.9 | 33.3 | -30.8 | 0 | 0 | 0 | 112 | ||
| 47 | N | 39.3 | Very low | 41.5 | Very low | 169 Ų | 169 | 121 Ų | 121 | 90% | 0.904 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 135.5 | 157.9 | -84 | -16.3 | 0 | 0 | 0 | 109.1 | ||
| 48 | S | 35.4 | Very low | 41.1 | Very low | 116 Ų | 116 | 122.3 Ų | 122.3 | 81% | 0.811 | 76% | 0.763 | S | S | * | * | trans | -113.7 | 108 | 169.3 | -68.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 49 | S | 38.3 | Very low | 41.9 | Very low | 110 Ų | 110 | 124.6 Ų | 124.6 | 77% | 0.769 | 77% | 0.772 | S | S | * | * | trans | -93.2 | 143.4 | 167.1 | 51.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 50 | T | 37.7 | Very low | 41.8 | Very low | 139 Ų | 139 | 117.9 Ų | 117.9 | 85% | 0.853 | 77% | 0.771 | S | S | * | * | trans | -133 | 123.1 | 165.9 | -41.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 51 | S | 41 | Very low | 40.9 | Very low | 103 Ų | 103 | 116.3 Ų | 116.3 | 72% | 0.72 | 77% | 0.773 | S | S | * | * | trans | -93.9 | -157.4 | 176.3 | -35.4 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 52 | P | 55.2 | Low | 41.2 | Very low | 115 Ų | 115 | 118.1 Ų | 118.1 | 75% | 0.747 | 78% | 0.78 | S | S | * | * | cis | -143.5 | 166.6 | 13.7 | 42.9 | -23.1 | 0 | 0 | 0 | 119.2 | ||||
| 53 | A | 34.7 | Very low | 41.4 | Very low | 94 Ų | 94 | 117 Ų | 117 | 78% | 0.777 | 78% | 0.778 | S | S | * | * | trans | 57.4 | 162.2 | 146.5 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 54 | T | 33.3 | Very low | 41.6 | Very low | 124 Ų | 124 | 118.4 Ų | 118.4 | 76% | 0.761 | 78% | 0.781 | S | S | * | * | cis | -139.2 | 161.5 | 9.6 | 61.8 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 55 | T | 39 | Very low | 41.8 | Very low | 129 Ų | 129 | 118 Ų | 118 | 79% | 0.791 | 78% | 0.783 | S | S | * | * | 176.4 | 147.3 | 62.3 | -87.6 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 56 | S | 41.6 | Very low | 42.1 | Very low | 106 Ų | 106 | 117.5 Ų | 117.5 | 74% | 0.741 | 78% | 0.781 | S | S | * | * | trans | -109.3 | 172.4 | 167 | -131 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 57 | P | 61.7 | Low | 42.2 | Very low | 103 Ų | 103 | 118.6 Ų | 118.6 | 67% | 0.669 | 79% | 0.788 | S | S | * | * | cis | -134.4 | -159.5 | 31 | 39.6 | -16.5 | 0 | 0 | 0 | 112.1 | ||||
| 58 | N | 46.4 | Very low | 41.9 | Very low | 145 Ų | 145 | 113.7 Ų | 113.7 | 78% | 0.775 | 78% | 0.778 | S | S | * | * | cis | -160.4 | -171.7 | 24.8 | -129.8 | -14.4 | 0 | 0 | 0 | 110 | ||||
| 59 | P | 56.1 | Low | 42.4 | Very low | 119 Ų | 119 | 116 Ų | 116 | 77% | 0.773 | 78% | 0.779 | S | S | * | * | trans | -123.4 | 176.3 | -139.3 | 38.5 | -18.2 | 0 | 0 | 0 | 116.1 | ||||
| 60 | G | 36.8 | Very low | 42.3 | Very low | 82 Ų | 82 | 119.8 Ų | 119.8 | 85% | 0.845 | 78% | 0.782 | S | S | * | * | trans | -170.7 | 119.2 | 166.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 61 | G | 36.7 | Very low | 42.2 | Very low | 71 Ų | 71 | 118.5 Ų | 118.5 | 73% | 0.732 | 78% | 0.779 | S | S | * | * | trans | -124.2 | 162.9 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 62 | M | 42.5 | Very low | 42.1 | Very low | 189 Ų | 189 | 118.2 Ų | 118.2 | 93% | 0.931 | 78% | 0.777 | S | S | * | * | trans | -161.7 | 154.6 | 153.2 | 51.5 | -167.9 | 77.6 | 0 | 0 | 110.6 | ||||
| 63 | A | 38.5 | Very low | 41.3 | Very low | 87 Ų | 87 | 119.2 Ų | 119.2 | 72% | 0.719 | 78% | 0.781 | S | S | * | * | trans | -75.7 | 172.9 | -173.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 64 | V | 39.4 | Very low | 41.3 | Very low | 131 Ų | 131 | 118.5 Ų | 118.5 | 79% | 0.794 | 78% | 0.783 | S | S | * | * | -166.7 | 150 | 59 | -76.1 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 65 | S | 38.6 | Very low | 41.6 | Very low | 110 Ų | 110 | 120.3 Ų | 120.3 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | trans | 43.2 | 104.4 | 142.7 | -53.2 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 66 | S | 40.6 | Very low | 41.6 | Very low | 118 Ų | 118 | 120 Ų | 120 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | 26 | 162.2 | 115 | -63.1 | 0 | 0 | 0 | 0 | 123.2 | |||||
| 67 | P | 53.2 | Low | 41.5 | Very low | 130 Ų | 130 | 120.9 Ų | 120.9 | 84% | 0.844 | 80% | 0.796 | S | S | * | * | cis | -139.4 | 173.9 | -28.7 | 38 | -20.2 | 0 | 0 | 0 | 115 | ||||
| 68 | G | 34.2 | Very low | 40.1 | Very low | 67 Ų | 67 | 119.7 Ų | 119.7 | 69% | 0.691 | 80% | 0.802 | S | S | * | * | trans | -169 | 110.6 | 168.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 69 | I | 45.2 | Very low | 39.8 | Very low | 163 Ų | 163 | 121.3 Ų | 121.3 | 84% | 0.836 | 81% | 0.81 | S | S | * | * | trans | 23.8 | 104 | 154.7 | 53.4 | 173.7 | 0 | 0 | 0 | 119.1 | ||||
| 70 | K | 35.6 | Very low | 38.7 | Very low | 190 Ų | 190 | 119.5 Ų | 119.5 | 83% | 0.826 | 81% | 0.813 | S | S | * | * | 61.5 | 105.8 | 72.9 | -65.2 | -169.5 | 179.8 | -177.2 | 0 | 116.9 | |||||
| 71 | S | 36.7 | Very low | 38.7 | Very low | 112 Ų | 112 | 121.4 Ų | 121.4 | 78% | 0.783 | 81% | 0.813 | S | S | * | * | trans | 57.2 | 149.5 | 134.5 | 60 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 72 | S | 38.6 | Very low | 39.6 | Very low | 98 Ų | 98 | 123.4 Ų | 123.4 | 69% | 0.685 | 81% | 0.813 | S | S | * | * | cis | -177.9 | 146.4 | -16.4 | 50.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 73 | T | 38.3 | Very low | 39.2 | Very low | 135 Ų | 135 | 122.8 Ų | 122.8 | 83% | 0.828 | 81% | 0.808 | S | S | * | * | trans | 40.9 | 126 | 140.6 | -39.1 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 74 | G | 34 | Very low | 38.9 | Very low | 79 Ų | 79 | 126.1 Ų | 126.1 | 81% | 0.814 | 81% | 0.809 | S | S | * | * | trans | -165.2 | 104 | 162.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 75 | L | 41 | Very low | 38.4 | Very low | 163 Ų | 163 | 126.8 Ų | 126.8 | 85% | 0.853 | 82% | 0.818 | S | S | * | * | trans | -90.6 | 152.7 | -179.9 | -68.1 | 158 | 0 | 0 | 0 | 111.7 | ||||
| 76 | S | 37.6 | Very low | 38.2 | Very low | 123 Ų | 123 | 126.4 Ų | 126.4 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | trans | -152.9 | 147.2 | 142.3 | 55.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 77 | S | 40 | Very low | 38.4 | Very low | 123 Ų | 123 | 126.6 Ų | 126.6 | 86% | 0.86 | 82% | 0.817 | S | S | * | * | trans | -107.6 | 152.1 | -172.8 | -51.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 78 | G | 32.1 | Very low | 37.8 | Very low | 78 Ų | 78 | 125 Ų | 125 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | -152.8 | 120.4 | 169 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 79 | L | 40.5 | Very low | 38.7 | Very low | 180 Ų | 180 | 127.4 Ų | 127.4 | 94% | 0.942 | 82% | 0.816 | S | S | * | * | trans | -82 | 146.4 | 176.8 | -77.8 | 82.1 | 0 | 0 | 0 | 111.2 | ||||
| 80 | G | 31.9 | Very low | 39.2 | Very low | 81 Ų | 81 | 125.5 Ų | 125.5 | 84% | 0.835 | 81% | 0.814 | S | S | * | * | trans | 173 | 118.9 | 167.8 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 81 | S | 37.4 | Very low | 40.1 | Very low | 121 Ų | 121 | 123.3 Ų | 123.3 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | trans | -102.4 | -177.8 | -177.6 | -141.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 82 | P | 55.1 | Low | 41.2 | Very low | 113 Ų | 113 | 119.6 Ų | 119.6 | 73% | 0.734 | 79% | 0.786 | S | S | * | * | -123.1 | 148.6 | -108.6 | 35.8 | -19 | 0 | 0 | 0 | 115.1 | |||||
| 83 | Q | 34.3 | Very low | 42.1 | Very low | 176 Ų | 176 | 121.3 Ų | 121.3 | 82% | 0.822 | 79% | 0.786 | S | S | * | * | trans | -151.1 | 110.8 | 164.6 | -149.4 | 160.3 | -2.5 | 0 | 0 | 116.1 | ||||
| 84 | Q | 33.6 | Very low | 43.1 | Very low | 158 Ų | 158 | 120.9 Ų | 120.9 | 74% | 0.738 | 78% | 0.778 | S | S | * | * | trans | 43.6 | 98.7 | 148.3 | -57.6 | -173 | 17.6 | 0 | 0 | 120.3 | S86 | Q84-S86 PolarHBondContact O-N 3.33Š| ||
| 85 | C | 28.3 | Very low | 44.5 | Very low | 144 Ų | 144 | 121.6 Ų | 121.6 | 97% | 0.973 | 76% | 0.764 | S | S | * | * | trans | -81.7 | 90.8 | 159.7 | -60.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 86 | S | 34 | Very low | 45.4 | Very low | 103 Ų | 103 | 120.2 Ų | 120.2 | 72% | 0.72 | 76% | 0.756 | S | S | * | * | trans | -81.9 | 129.4 | 170.7 | -72.9 | 0 | 0 | 0 | 0 | 111.6 | Q84 | Q84-S86 PolarHBondContact O-N 3.33Š| ||
| 87 | S | 44.8 | Very low | 46.4 | Very low | 122 Ų | 122 | 120.6 Ų | 120.6 | 85% | 0.853 | 75% | 0.748 | S | S | * | * | trans | -68.5 | 126.7 | 172.2 | 55.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 88 | A | 41.2 | Very low | 46.8 | Very low | 96 Ų | 96 | 121.5 Ų | 121.5 | 79% | 0.793 | 74% | 0.743 | S | S | * | * | trans | -148.4 | 145.8 | 163.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 89 | T | 53.3 | Low | 47.9 | Very low | 118 Ų | 118 | 127.9 Ų | 127.9 | 72% | 0.724 | 74% | 0.742 | S | S | * | * | trans | -61.3 | 148.9 | 178 | 37.4 | 0 | 0 | 0 | 0 | 112.8 | H91 | T89-H91 PolarHBondContact O-N 3.47Š| ||
| 90 | P | 54.6 | Low | 48.2 | Very low | 123 Ų | 123 | 124.7 Ų | 124.7 | 80% | 0.799 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -76.2 | 17.6 | -168.3 | 33.2 | -38.8 | 0 | 0 | 0 | 115.2 | ||
| 91 | H | 55.5 | Low | 49 | Very low | 144 Ų | 144 | 127 Ų | 127 | 67% | 0.667 | 73% | 0.73 | S | S | * | * | trans | -137.1 | 110.8 | 176.4 | -71.7 | 44.4 | 0 | 0 | 0 | 107.4 | T89 | T89-H91 PolarHBondContact O-N 3.47Š| ||
| 92 | G | 59.2 | Low | 49.3 | Very low | 34 Ų | 34 | 127.6 Ų | 127.6 | 35% | 0.351 | 73% | 0.728 | S | S | . | * | trans | -81.7 | 158.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | N94 D95 | G92-N94 PolarHBondContact O-N 3.13Å; G92-D95 PolarHBondContact N-OD2 3.07Å; G92-D95 PolarHBondContact O-N 3.27Å | ||
| 93 | I | 58 | Low | 48.4 | Very low | 133 Ų | 133 | 127.2 Ų | 127.2 | 68% | 0.682 | 73% | 0.728 | S | S | * | * | H | α-helix | trans | -56.8 | -25.8 | 175 | -73 | 165.9 | 0 | 0 | 0 | 111.8 | D95 I96 L97 | I93-D95 PolarHBondContact O-N 3.25Å; I93-I96 PolarHBondContact O-N 3.05Å; I93-L97 HydrophobicContact CG2-CD1 4.37Å |
| 94 | N | 58.9 | Low | 48.5 | Very low | 126 Ų | 126 | 124.5 Ų | 124.5 | 67% | 0.674 | 73% | 0.729 | S | S | * | * | H | α-helix | trans | -66.9 | -30.2 | 177.7 | -56.5 | -34.3 | 0 | 0 | 0 | 113.5 | G92 I96 L97 | G92-N94 PolarHBondContact O-N 3.13Å; N94-I96 VanDerWaalsContact C-N 3.25Å; N94-I96 PolarHBondContact O-N 2.91Å; N94-L97 PolarHBondContact O-N 2.92Å |
| 95 | D | 63.8 | Low | 48.7 | Very low | 94 Ų | 94 | 122 Ų | 122 | 50% | 0.503 | 74% | 0.735 | S | S | . | * | H | α-helix | trans | -70.8 | -22 | 178.1 | -66.7 | -72.9 | 0 | 0 | 0 | 112.9 | G92 I93 | G92-D95 PolarHBondContact N-OD2 3.07Å; G92-D95 PolarHBondContact O-N 3.27Å; I93-D95 PolarHBondContact O-N 3.25Å |
| 96 | I | 59.4 | Low | 48.9 | Very low | 134 Ų | 134 | 118.5 Ų | 118.5 | 69% | 0.687 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -80.2 | -33.7 | -179.4 | -57.1 | 176.3 | 0 | 0 | 0 | 110.7 | I93 N94 | I93-I96 PolarHBondContact O-N 3.05Å; N94-I96 VanDerWaalsContact C-N 3.25Å; N94-I96 PolarHBondContact O-N 2.91Å |
| 97 | L | 58.6 | Low | 49 | Very low | 132 Ų | 132 | 120 Ų | 120 | 69% | 0.691 | 73% | 0.728 | S | S | * | * | H | α-helix | trans | -82.7 | -24.6 | -175.1 | -72 | 162.3 | 0 | 0 | 0 | 113.6 | I93 N94 | I93-L97 HydrophobicContact CG2-CD1 4.37Å; N94-L97 PolarHBondContact O-N 2.92Å |
| 98 | N | 47.6 | Very low | 48.5 | Very low | 141 Ų | 141 | 120.6 Ų | 120.6 | 75% | 0.754 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -104.6 | 9 | -172.2 | -80.4 | 30.3 | 0 | 0 | 0 | 115.2 | P100 | N98-P100 VanDerWaalsContact O-CD 3.24Å; N98-P100 WeakPolarHBondContact O-CD 3.24Å |
| 99 | R | 56.1 | Low | 48 | Very low | 213 Ų | 213 | 119 Ų | 119 | 80% | 0.804 | 72% | 0.72 | S | S | * | * | trans | -82.9 | 113.9 | 176.5 | -91.3 | -178.5 | 171.3 | -112.2 | -0.7 | 111.8 | V101 | R99-V101 PolarHBondContact O-N 2.95Š| ||
| 100 | P | 47.2 | Very low | 47 | Very low | 113 Ų | 113 | 120.3 Ų | 120.3 | 73% | 0.734 | 73% | 0.728 | S | S | * | * | trans | -66 | 129 | 165.7 | 28.4 | -33.3 | 0 | 0 | 0 | 109.5 | N98 V102 | N98-P100 VanDerWaalsContact O-CD 3.24Å; N98-P100 WeakPolarHBondContact O-CD 3.24Å; P100-V102 PolarHBondContact O-N 3.09Å; P100-V102 VanDerWaalsContact O-N 3.15Å | ||
| 101 | V | 47.6 | Very low | 45.8 | Very low | 128 Ų | 128 | 121.1 Ų | 121.1 | 78% | 0.776 | 73% | 0.73 | S | S | * | * | trans | -74.6 | 103.7 | 176.7 | 58 | 0 | 0 | 0 | 0 | 110.1 | R99 S103 | R99-V101 PolarHBondContact O-N 2.95Å; V101-S103 PolarHBondContact O-N 3.19Å | ||
| 102 | V | 43.6 | Very low | 44.6 | Very low | 134 Ų | 134 | 118.8 Ų | 118.8 | 81% | 0.812 | 74% | 0.736 | S | S | * | * | trans | -82.2 | 96.4 | 167.2 | -66.5 | 0 | 0 | 0 | 0 | 109.1 | P100 S104 | P100-V102 PolarHBondContact O-N 3.09Å; P100-V102 VanDerWaalsContact O-N 3.15Å; V102-S104 PolarHBondContact O-N 3.03Å | ||
| 103 | S | 37.9 | Very low | 43.3 | Very low | 105 Ų | 105 | 122.1 Ų | 122.1 | 73% | 0.734 | 76% | 0.76 | S | S | * | * | trans | -72.3 | 96.3 | 174.6 | -65.2 | 0 | 0 | 0 | 0 | 110.3 | V101 A105 | V101-S103 PolarHBondContact O-N 3.19Å; S103-A105 PolarHBondContact O-N 3.36Å | ||
| 104 | S | 35.7 | Very low | 42.1 | Very low | 120 Ų | 120 | 120.4 Ų | 120.4 | 84% | 0.839 | 77% | 0.766 | S | S | * | * | trans | -73.3 | 110.2 | 171.3 | 57.2 | 0 | 0 | 0 | 0 | 110.4 | V102 | V102-S104 PolarHBondContact O-N 3.03Š| ||
| 105 | A | 37.9 | Very low | 40.9 | Very low | 106 Ų | 106 | 118.8 Ų | 118.8 | 88% | 0.876 | 77% | 0.769 | S | S | * | * | trans | -73.1 | 146.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112 | S103 | S103-A105 PolarHBondContact O-N 3.36Š| ||
| 106 | G | 33 | Very low | 39.4 | Very low | 69 Ų | 69 | 119.1 Ų | 119.1 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | trans | -152.1 | 97.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 107 | T | 36 | Very low | 38 | Very low | 135 Ų | 135 | 117.2 Ų | 117.2 | 83% | 0.828 | 79% | 0.79 | S | S | * | * | trans | 4.4 | 129.4 | 151.5 | -17.8 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 108 | T | 33.5 | Very low | 36.8 | Very low | 134 Ų | 134 | 115.1 Ų | 115.1 | 82% | 0.822 | 79% | 0.792 | S | S | * | * | -163.8 | 145.4 | 63.1 | 46.7 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 109 | G | 30.5 | Very low | 36.3 | Very low | 64 Ų | 64 | 113.8 Ų | 113.8 | 66% | 0.66 | 79% | 0.793 | S | S | * | * | 98.5 | 111.5 | 129.5 | 0 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 110 | V | 32 | Very low | 35.4 | Very low | 145 Ų | 145 | 109.1 Ų | 109.1 | 88% | 0.879 | 79% | 0.793 | S | S | * | * | trans | 53.3 | 141.7 | 138.3 | -56.4 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 111 | V | 30.3 | Very low | 34.9 | Very low | 139 Ų | 139 | 109.7 Ų | 109.7 | 84% | 0.842 | 80% | 0.8 | S | S | * | * | cis | -145.8 | 160.3 | -8.8 | -85.2 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 112 | A | 30.8 | Very low | 34.4 | Very low | 96 Ų | 96 | 108.7 Ų | 108.7 | 79% | 0.793 | 81% | 0.805 | S | S | * | * | -178.4 | 172.9 | 57.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 113 | A | 31.6 | Very low | 34.1 | Very low | 103 Ų | 103 | 105.9 Ų | 105.9 | 85% | 0.851 | 80% | 0.803 | S | S | * | * | trans | -78.4 | 173.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 114 | A | 32.6 | Very low | 34.5 | Very low | 98 Ų | 98 | 108.5 Ų | 108.5 | 81% | 0.81 | 81% | 0.808 | S | S | * | * | cis | -151.6 | -167.9 | 8.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 115 | A | 32.4 | Very low | 34.9 | Very low | 91 Ų | 91 | 110.5 Ų | 110.5 | 75% | 0.752 | 81% | 0.808 | S | S | * | * | cis | -157.7 | 179.3 | 5.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 116 | A | 32.7 | Very low | 35 | Very low | 101 Ų | 101 | 111.8 Ų | 111.8 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | trans | 22.2 | 143.6 | 149.5 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 117 | A | 31 | Very low | 35.3 | Very low | 94 Ų | 94 | 111.9 Ų | 111.9 | 78% | 0.777 | 81% | 0.811 | S | S | * | * | cis | -159.5 | 161.8 | 15.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 118 | A | 33.3 | Very low | 35.8 | Very low | 89 Ų | 89 | 113.3 Ų | 113.3 | 74% | 0.736 | 81% | 0.813 | S | S | * | * | trans | 64.2 | 108.7 | 144.8 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 119 | S | 36.8 | Very low | 36.4 | Very low | 112 Ų | 112 | 112.6 Ų | 112.6 | 78% | 0.783 | 81% | 0.811 | S | S | * | * | 69 | 100.6 | 121.8 | -54.4 | 0 | 0 | 0 | 0 | 123.4 | |||||
| 120 | S | 37.1 | Very low | 37 | Very low | 116 Ų | 116 | 120 Ų | 120 | 81% | 0.811 | 82% | 0.819 | S | S | * | * | 34 | 117 | 124.2 | -50.5 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 121 | S | 36.5 | Very low | 37.5 | Very low | 125 Ų | 125 | 122.4 Ų | 122.4 | 87% | 0.874 | 82% | 0.818 | S | S | * | * | 171.4 | 166 | 93.6 | 50 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 122 | A | 37.2 | Very low | 37.9 | Very low | 107 Ų | 107 | 120.3 Ų | 120.3 | 88% | 0.884 | 81% | 0.809 | S | S | * | * | trans | -55.5 | 145.1 | -168.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 123 | G | 37.7 | Very low | 39 | Very low | 75 Ų | 75 | 121.1 Ų | 121.1 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | trans | 161.9 | 105 | 167.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 124 | I | 45.7 | Very low | 39.8 | Very low | 160 Ų | 160 | 124.3 Ų | 124.3 | 82% | 0.821 | 81% | 0.811 | S | S | * | * | trans | -49 | 152.9 | 170.9 | 47.4 | 171.8 | 0 | 0 | 0 | 115.2 | ||||
| 125 | L | 43.8 | Very low | 40.3 | Very low | 162 Ų | 162 | 125 Ų | 125 | 85% | 0.848 | 81% | 0.81 | S | S | * | * | trans | 77.6 | 94.8 | 169.3 | -51.6 | 179.3 | 0 | 0 | 0 | 117.5 | ||||
| 126 | S | 41.2 | Very low | 41.5 | Very low | 132 Ų | 132 | 126 Ų | 126 | 92% | 0.923 | 81% | 0.809 | S | S | * | * | trans | -151.9 | 140.7 | 155.1 | -81.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 127 | G | 38 | Very low | 42.7 | Very low | 71 Ų | 71 | 126.7 Ų | 126.7 | 73% | 0.732 | 81% | 0.805 | S | S | * | * | trans | 100.3 | 59.8 | 164.8 | 0 | 0 | 0 | 0 | 0 | 117.6 | P129 | G127-P129 WeakPolarHBondContact O-CD 3.21Š| ||
| 128 | L | 46.5 | Very low | 43.9 | Very low | 166 Ų | 166 | 127.7 Ų | 127.7 | 87% | 0.869 | 80% | 0.803 | S | S | * | * | trans | -74.1 | 117.1 | 146.7 | -81.3 | 81.6 | 0 | 0 | 0 | 108.2 | R130 | L128-R130 PolarHBondContact O-N 3.39Å; L128-R130 VanDerWaalsContact O-N 3.13Å | ||
| 129 | P | 45.9 | Very low | 45.2 | Very low | 119 Ų | 119 | 129.1 Ų | 129.1 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | trans | -70.4 | 103.5 | 154 | 29.4 | -30.2 | 0 | 0 | 0 | 107.8 | G127 F131 | G127-P129 WeakPolarHBondContact O-CD 3.21Å; P129-F131 PolarHBondContact O-N 3.08Å | ||
| 130 | R | 43.6 | Very low | 45.9 | Very low | 218 Ų | 218 | 130.2 Ų | 130.2 | 82% | 0.823 | 81% | 0.81 | S | S | * | * | trans | -52.8 | 127.2 | 163.8 | -100.9 | -169.7 | 175 | 178.8 | -0.1 | 108.7 | L128 S132 | L128-R130 PolarHBondContact O-N 3.39Å; L128-R130 VanDerWaalsContact O-N 3.13Å; R130-S132 PolarHBondContact O-N 3.18Å | ||
| 131 | F | 43.5 | Very low | 46.9 | Very low | 197 Ų | 197 | 128.1 Ų | 128.1 | 86% | 0.864 | 81% | 0.806 | S | S | * | * | trans | -72.8 | 80.8 | 164.3 | 43.5 | -87.6 | 0 | 0 | 0 | 109.3 | P129 S133 | P129-F131 PolarHBondContact O-N 3.08Å; F131-S133 VanDerWaalsContact C-N 3.31Å; F131-S133 PolarHBondContact O-N 3.24Å | ||
| 132 | S | 38.1 | Very low | 47.6 | Very low | 95 Ų | 95 | 130.7 Ų | 130.7 | 66% | 0.664 | 81% | 0.809 | S | S | * | * | trans | -71.2 | 88.9 | 167.8 | -71.8 | 0 | 0 | 0 | 0 | 109.6 | R130 L134 | R130-S132 PolarHBondContact O-N 3.18Å; S132-L134 PolarHBondContact O-N 3.29Å; S132-L134 VanDerWaalsContact O-N 3.09Å | ||
| 133 | S | 52.9 | Low | 48.1 | Very low | 113 Ų | 113 | 136.4 Ų | 136.4 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | trans | -71.4 | 93 | 168 | 57.5 | 0 | 0 | 0 | 0 | 110.1 | F131 | F131-S133 VanDerWaalsContact C-N 3.31Å; F131-S133 PolarHBondContact O-N 3.24Å | ||
| 134 | L | 48.4 | Very low | 48.5 | Very low | 169 Ų | 169 | 141.8 Ų | 141.8 | 89% | 0.885 | 81% | 0.812 | S | S | * | * | trans | -148.4 | 89.3 | 172 | -96.5 | 161.4 | 0 | 0 | 0 | 109.7 | S132 | S132-L134 PolarHBondContact O-N 3.29Å; S132-L134 VanDerWaalsContact O-N 3.09Å | ||
| 135 | S | 44.2 | Very low | 48.3 | Very low | 114 Ų | 114 | 137.9 Ų | 137.9 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | trans | -144.7 | 134.5 | 157.8 | -169.4 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 136 | P | 57 | Low | 48.8 | Very low | 112 Ų | 112 | 135.3 Ų | 135.3 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 153.8 | -165.4 | -13.3 | 30 | 0 | 0 | 0 | 113.4 | ||
| 137 | P | 58.7 | Low | 49.2 | Very low | 115 Ų | 115 | 133.9 Ų | 133.9 | 75% | 0.747 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -67 | 146.9 | 165 | 30.5 | -34.3 | 0 | 0 | 0 | 110.7 | ||
| 138 | P | 56.8 | Low | 49.7 | Very low | 115 Ų | 115 | 134.1 Ų | 134.1 | 75% | 0.747 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 146.3 | 174.4 | 29.3 | -34.5 | 0 | 0 | 0 | 111.2 | ||
| 139 | P | 58.9 | Low | 49.7 | Very low | 118 Ų | 118 | 130 Ų | 130 | 77% | 0.766 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 147.3 | 177.8 | 29.3 | -34.8 | 0 | 0 | 0 | 111.7 | ||
| 140 | P | 51.4 | Low | 49.8 | Very low | 136 Ų | 136 | 128.3 Ų | 128.3 | 88% | 0.883 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -77.6 | 130.1 | 174.6 | 31.8 | -32.7 | 0 | 0 | 0 | 110.6 | ||
| 141 | G | 58.9 | Low | 50 | Low | 71 Ų | 71 | 124 Ų | 124 | 73% | 0.732 | 76% | 0.76 | S | S | * | * | trans | 124.9 | 71.5 | 167.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 142 | L | 50.1 | Low | 50 | Low | 180 Ų | 180 | 119 Ų | 119 | 94% | 0.942 | 76% | 0.755 | S | S | * | * | trans | -127.8 | 94.9 | 150 | -75.4 | 178.4 | 0 | 0 | 0 | 108.5 | F144 | L142-F144 PolarHBondContact O-N 2.99Š| ||
| 143 | Y | 49.3 | Very low | 50.4 | Low | 227 Ų | 227 | 120.6 Ų | 120.6 | 89% | 0.89 | 76% | 0.761 | S | S | * | * | trans | -67.1 | 125 | 175.6 | -155.2 | -100.3 | 0 | 0 | 0 | 108.8 | S145 | Y143-S145 PolarHBondContact O-N 3.37Š| ||
| 144 | F | 46 | Very low | 50.2 | Low | 188 Ų | 188 | 119.1 Ų | 119.1 | 83% | 0.825 | 76% | 0.755 | S | S | * | * | trans | -70.1 | 93.5 | 178.3 | -179.9 | -96.7 | 0 | 0 | 0 | 109.7 | L142 | L142-F144 PolarHBondContact O-N 2.99Š| ||
| 145 | S | 40.7 | Very low | 50.2 | Low | 78 Ų | 78 | 122.3 Ų | 122.3 | 55% | 0.545 | 76% | 0.755 | S | S | . | * | trans | -96.8 | 119.5 | 172.9 | -176.8 | 0 | 0 | 0 | 0 | 109.8 | Y143 S147 | Y143-S145 PolarHBondContact O-N 3.37Å; S145-S147 PolarHBondContact O-N 2.84Å; S145-S147 VanDerWaalsContact O-N 3.13Å | ||
| 146 | P | 54.2 | Low | 49.6 | Very low | 107 Ų | 107 | 126 Ų | 126 | 70% | 0.695 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -1.4 | -169 | 30.2 | -36 | 0 | 0 | 0 | 114.7 | ||
| 147 | S | 49.7 | Very low | 49.4 | Very low | 102 Ų | 102 | 126.7 Ų | 126.7 | 71% | 0.713 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.1 | -15 | -171.8 | -140.8 | 0 | 0 | 0 | 0 | 115 | S145 | S145-S147 PolarHBondContact O-N 2.84Å; S145-S147 VanDerWaalsContact O-N 3.13Å |
| 148 | A | 48.6 | Very low | 48.7 | Very low | 77 Ų | 77 | 128.9 Ų | 128.9 | 64% | 0.636 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -81.8 | -12.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | A150 | A148-A150 PolarHBondContact O-N 3.4Š|
| 149 | A | 47.6 | Very low | 48.2 | Very low | 78 Ų | 78 | 128.8 Ų | 128.8 | 65% | 0.645 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -70.8 | -14.6 | -174.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 150 | A | 48.2 | Very low | 47.8 | Very low | 84 Ų | 84 | 131.9 Ų | 131.9 | 69% | 0.694 | 76% | 0.764 | S | S | * | * | G | 310 helix | trans | -79.8 | -18.2 | -173.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | A148 | A148-A150 PolarHBondContact O-N 3.4Š|
| 151 | V | 47.4 | Very low | 47.8 | Very low | 128 Ų | 128 | 128.9 Ų | 128.9 | 78% | 0.776 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -102.6 | -17.4 | -168.8 | -173.4 | 0 | 0 | 0 | 0 | 113.4 | V153 | V151-V153 PolarHBondContact O-N 2.85Š|
| 152 | A | 43.7 | Very low | 47.4 | Very low | 91 Ų | 91 | 132.9 Ų | 132.9 | 75% | 0.752 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.5 | 13.4 | -174.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 153 | V | 46.6 | Very low | 47.3 | Very low | 130 Ų | 130 | 130.8 Ų | 130.8 | 79% | 0.788 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | -8.1 | -175.3 | -174.4 | 0 | 0 | 0 | 0 | 112.9 | V151 | V151-V153 PolarHBondContact O-N 2.85Š|
| 154 | A | 47.3 | Very low | 47.3 | Very low | 81 Ų | 81 | 126.5 Ų | 126.5 | 67% | 0.669 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -98 | 115.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 155 | R | 48.2 | Very low | 47.6 | Very low | 236 Ų | 236 | 121.6 Ų | 121.6 | 89% | 0.891 | 75% | 0.746 | S | S | * | * | S | Bend | trans | 80.9 | 79.2 | 171.4 | -48.6 | 179.3 | -175.5 | -173.1 | 1.9 | 117.2 | ||
| 156 | Y | 32.9 | Very low | 48.1 | Very low | 193 Ų | 193 | 127.3 Ų | 127.3 | 76% | 0.757 | 76% | 0.756 | S | S | * | * | -173.4 | 111.3 | 118.6 | -123.2 | -109.4 | 0 | 0 | 0 | 111.2 | K158 | Y156-K158 HydrophobicContact CD1-CB 4.5Å; Y156-K158 HydrophobicContact CD1-CD 4.17Å; Y156-K158 HydrophobicContact CE1-CD 3.81Å | |||
| 157 | P | 51.6 | Low | 48 | Very low | 125 Ų | 125 | 128.2 Ų | 128.2 | 81% | 0.812 | 76% | 0.759 | S | S | * | * | trans | -97.1 | 104 | 166.8 | 33.4 | -25.5 | 0 | 0 | 0 | 109.7 | ||||
| 158 | K | 44.5 | Very low | 48.3 | Very low | 162 Ų | 162 | 128.6 Ų | 128.6 | 70% | 0.704 | 76% | 0.76 | S | S | * | * | trans | -144.7 | 118 | 166.7 | -106.5 | 157.9 | -176.7 | 173.9 | 0 | 109.2 | Y156 | Y156-K158 HydrophobicContact CD1-CB 4.5Å; Y156-K158 HydrophobicContact CD1-CD 4.17Å; Y156-K158 HydrophobicContact CE1-CD 3.81Å | ||
| 159 | P | 47.2 | Very low | 49 | Very low | 113 Ų | 113 | 131 Ų | 131 | 73% | 0.734 | 76% | 0.761 | S | S | * | * | trans | -70.8 | 142.5 | -176.4 | 29 | -34.1 | 0 | 0 | 0 | 111 | A161 | P159-A161 HydrophobicContact CB-CB 4.39Å; P159-A161 PolarHBondContact O-N 3.4Å | ||
| 160 | L | 50.5 | Low | 49.4 | Very low | 183 Ų | 183 | 135 Ų | 135 | 96% | 0.958 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.6 | 58.2 | 174.4 | -170.9 | 71 | 0 | 0 | 0 | 110.8 | ||
| 161 | A | 51.5 | Low | 50.1 | Low | 72 Ų | 72 | 140 Ų | 140 | 60% | 0.595 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.1 | -29.4 | -173.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | P159 L163 | P159-A161 HydrophobicContact CB-CB 4.39Å; P159-A161 PolarHBondContact O-N 3.4Å; A161-L163 PolarHBondContact O-N 3Å |
| 162 | D | 50.7 | Low | 50.1 | Low | 156 Ų | 156 | 139.1 Ų | 139.1 | 83% | 0.834 | 76% | 0.761 | S | S | * | * | trans | -94.1 | 80.9 | -176.1 | -74.1 | -51.8 | 0 | 0 | 0 | 112.9 | ||||
| 163 | L | 46.7 | Very low | 50.6 | Low | 135 Ų | 135 | 136.7 Ų | 136.7 | 71% | 0.707 | 75% | 0.746 | S | S | * | * | trans | -127.1 | 108 | 151.3 | -76 | 177.3 | 0 | 0 | 0 | 108.3 | A161 G165 | A161-L163 PolarHBondContact O-N 3Å; L163-G165 PolarHBondContact O-N 3.33Å | ||
| 164 | P | 50.6 | Low | 51.2 | Low | 137 Ų | 137 | 136.5 Ų | 136.5 | 89% | 0.89 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | 119.7 | -179.6 | 26.8 | -33.2 | 0 | 0 | 0 | 110.2 | ||
| 165 | G | 52.3 | Low | 51.4 | Low | 85 Ų | 85 | 141.8 Ų | 141.8 | 88% | 0.876 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 111.8 | 0.2 | 167.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | L163 | L163-G165 PolarHBondContact O-N 3.33Š|
| 166 | R | 51.2 | Low | 51.7 | Low | 199 Ų | 199 | 138.1 Ų | 138.1 | 75% | 0.751 | 75% | 0.751 | S | S | * | * | trans | -115.5 | 104.6 | 169.4 | -152.1 | 176.5 | -157.9 | -92.5 | 3.6 | 110.5 | P168 | R166-P168 WeakPolarHBondContact O-CD 3.48Š| ||
| 167 | T | 50.1 | Low | 52.7 | Low | 125 Ų | 125 | 133.8 Ų | 133.8 | 77% | 0.767 | 75% | 0.749 | S | S | * | * | trans | -55.4 | 122.8 | 171.3 | 47 | 0 | 0 | 0 | 0 | 108.8 | I169 | T167-I169 PolarHBondContact O-N 3.44Š| ||
| 168 | P | 56.2 | Low | 52.8 | Low | 111 Ų | 111 | 130.1 Ų | 130.1 | 72% | 0.721 | 72% | 0.724 | S | S | * | * | trans | -62.5 | 135.6 | 174.9 | 25.1 | -32.2 | 0 | 0 | 0 | 108 | R166 F170 | R166-P168 WeakPolarHBondContact O-CD 3.48Å; P168-F170 PolarHBondContact O-N 3.21Å | ||
| 169 | I | 65.1 | Low | 53.2 | Low | 128 Ų | 128 | 130.7 Ų | 130.7 | 66% | 0.656 | 73% | 0.729 | S | S | * | * | trans | -73 | 75.8 | 168 | -56.5 | 177.4 | 0 | 0 | 0 | 106.5 | T167 W171 | T167-I169 PolarHBondContact O-N 3.44Å; I169-W171 HydrophobicContact CG2-CZ2 4.41Å; I169-W171 PolarHBondContact O-N 3.04Å; I169-W171 VanDerWaalsContact O-N 3.13Å | ||
| 170 | F | 55.9 | Low | 53.6 | Low | 160 Ų | 160 | 133.7 Ų | 133.7 | 70% | 0.702 | 73% | 0.726 | S | S | * | * | trans | -70.5 | 102.5 | 174.3 | 177 | -109.2 | 0 | 0 | 0 | 107.3 | P168 P172 | P168-F170 PolarHBondContact O-N 3.21Å; F170-P172 HydrophobicContact CD1-CB 4.16Å; F170-P172 HydrophobicContact CD1-CG 3.86Å; F170-P172 HydrophobicContact CE1-CB 3.69Å; F170-P172 HydrophobicContact CE1-CG 3.91Å; F170-P172 HydrophobicContact CZ-CB 4.43Å; F170-P172 WeakPolarHBondContact O-CD 3.46Å | ||
| 171 | W | 62.9 | Low | 53.6 | Low | 191 Ų | 191 | 133 Ų | 133 | 72% | 0.723 | 71% | 0.711 | S | S | * | * | trans | -75.3 | 103.1 | 166.6 | -67 | 96.4 | 0 | 0 | 0 | 108.1 | I169 G173 V174 | I169-W171 HydrophobicContact CG2-CZ2 4.41Å; I169-W171 PolarHBondContact O-N 3.04Å; I169-W171 VanDerWaalsContact O-N 3.13Å; W171-G173 PolarHBondContact O-N 3.29Å; W171-V174 HydrophobicContact CB-CG2 3.95Å | ||
| 172 | P | 45.4 | Very low | 53.3 | Low | 108 Ų | 108 | 132.8 Ų | 132.8 | 70% | 0.701 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | 108.4 | -179.2 | -7.2 | 26.6 | 0 | 0 | 0 | 107.1 | F170 | F170-P172 HydrophobicContact CD1-CB 4.16Å; F170-P172 HydrophobicContact CD1-CG 3.86Å; F170-P172 HydrophobicContact CE1-CB 3.69Å; F170-P172 HydrophobicContact CE1-CG 3.91Å; F170-P172 HydrophobicContact CZ-CB 4.43Å; F170-P172 WeakPolarHBondContact O-CD 3.46Å |
| 173 | G | 55.3 | Low | 53.5 | Low | 41 Ų | 41 | 130 Ų | 130 | 42% | 0.423 | 70% | 0.698 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 132.3 | -1.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 117.2 | W171 M175 Q176 | W171-G173 PolarHBondContact O-N 3.29Å; G173-M175 PolarHBondContact O-N 3.48Å; G173-Q176 PolarHBondContact O-N 2.89Å |
| 174 | V | 58.7 | Low | 53.8 | Low | 126 Ų | 126 | 133.1 Ų | 133.1 | 76% | 0.764 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.9 | -20.2 | 178.5 | 170.9 | 0 | 0 | 0 | 0 | 113.5 | W171 | W171-V174 HydrophobicContact CB-CG2 3.95Š|
| 175 | M | 52 | Low | 53.7 | Low | 191 Ų | 191 | 135.9 Ų | 135.9 | 94% | 0.941 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.1 | 0.3 | 174 | -69 | -174.4 | 74.1 | 0 | 0 | 114.9 | G173 | G173-M175 PolarHBondContact O-N 3.48Š|
| 176 | Q | 55.3 | Low | 53.5 | Low | 160 Ų | 160 | 135.8 Ų | 135.8 | 75% | 0.748 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -113.5 | 105.6 | 168.8 | -78.8 | -176.3 | -2.9 | 0 | 0 | 108.1 | G173 P178 | G173-Q176 PolarHBondContact O-N 2.89Å; Q176-P178 WeakPolarHBondContact O-CD 3.48Å |
| 177 | S | 52.2 | Low | 53.1 | Low | 102 Ų | 102 | 132.5 Ų | 132.5 | 71% | 0.713 | 70% | 0.696 | S | S | * | * | trans | -46.8 | 114 | 179 | -168 | 0 | 0 | 0 | 0 | 109.1 | H179 | S177-H179 PolarHBondContact O-N 3.14Š| ||
| 178 | P | 54.6 | Low | 52.6 | Low | 47 Ų | 47 | 132.1 Ų | 132.1 | 31% | 0.305 | 70% | 0.698 | S | S | . | * | trans | -71.2 | 131.6 | -165.1 | 27.9 | -36.1 | 0 | 0 | 0 | 109 | Q176 W180 R181 | Q176-P178 WeakPolarHBondContact O-CD 3.48Å; P178-W180 HydrophobicContact CB-CG 4.4Å; P178-W180 HydrophobicContact CG-CD2 4.33Å; P178-W180 HydrophobicContact CG-CZ2 3.84Å; P178-W180 VanDerWaalsContact CG-NE1 3.27Å; P178-W180 PolarHBondContact O-N 2.79Å; P178-R181 PolarHBondContact O-N 3.11Å | ||
| 179 | H | 52 | Low | 52.5 | Low | 175 Ų | 175 | 132.6 Ų | 132.6 | 81% | 0.81 | 70% | 0.701 | S | S | * | * | G | 310 helix | trans | -48.5 | -18.1 | -175.6 | 62 | 105.4 | 0 | 0 | 0 | 115.9 | S177 R181 D182 | S177-H179 PolarHBondContact O-N 3.14Å; H179-R181 VanDerWaalsContact C-N 3.25Å; H179-R181 PolarHBondContact O-N 2.93Å; H179-D182 PolarHBondContact O-N 3.35Å |
| 180 | W | 56.1 | Low | 51.5 | Low | 175 Ų | 175 | 134.4 Ų | 134.4 | 66% | 0.663 | 71% | 0.707 | S | S | * | * | G | 310 helix | trans | -69.3 | -15.8 | 170.5 | 65.2 | -106 | 0 | 0 | 0 | 114.6 | P178 | P178-W180 HydrophobicContact CB-CG 4.4Å; P178-W180 HydrophobicContact CG-CD2 4.33Å; P178-W180 HydrophobicContact CG-CZ2 3.84Å; P178-W180 VanDerWaalsContact CG-NE1 3.27Å; P178-W180 PolarHBondContact O-N 2.79Å |
| 181 | R | 51.2 | Low | 50.9 | Low | 168 Ų | 168 | 134.6 Ų | 134.6 | 63% | 0.634 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -81.6 | -10.5 | 174.8 | -81.3 | -163.2 | 178.7 | -92.2 | 5.6 | 114.1 | P178 H179 A183 | P178-R181 PolarHBondContact O-N 3.11Å; H179-R181 VanDerWaalsContact C-N 3.25Å; H179-R181 PolarHBondContact O-N 2.93Å; R181-A183 VanDerWaalsContact C-N 3.34Å; R181-A183 PolarHBondContact O-N 3.43Å |
| 182 | D | 45.2 | Very low | 50.3 | Low | 69 Ų | 69 | 132.2 Ų | 132.2 | 37% | 0.369 | 71% | 0.711 | S | S | . | * | trans | -81.7 | 82.3 | 179.2 | -150 | -30.3 | 0 | 0 | 0 | 111.4 | H179 R184 | H179-D182 PolarHBondContact O-N 3.35Å; D182-R184 PolarHBondContact O-N 2.99Å; D182-R184 WeakPolarHBondContact OD1-CB 3.49Å; D182-R184 WeakPolarHBondContact OD1-CG 3.3Å; D182-R184 IonicContact OD1-CZ 3.47Å; D182-R184 PolarHBondContact OD1-N 3.29Å; D182-R184 IonicContact OD1-NE 2.74Å; D182-R184 PolarHBondContact OD1-NE 2.84Å; D182-R184 IonicContact OD1-NH2 3.38Å; D182-R184 PolarHBondContact OD1-NH2 3.13Å; D182-R184 IonicContact OD2-CZ 3.59Å; D182-R184 IonicContact OD2-NE 3.57Å; D182-R184 IonicContact OD2-NH2 2.75Å; D182-R184 PolarHBondContact OD2-NH2 2.75Å | ||
| 183 | A | 54.3 | Low | 50.2 | Low | 96 Ų | 96 | 131.7 Ų | 131.7 | 79% | 0.793 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.4 | 18 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | R181 | R181-A183 VanDerWaalsContact C-N 3.34Å; R181-A183 PolarHBondContact O-N 3.43Å |
| 184 | R | 53.1 | Low | 50 | Low | 202 Ų | 202 | 135.8 Ų | 135.8 | 76% | 0.762 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.8 | -7.6 | -178.3 | -67.8 | 179.7 | -74.8 | -155 | 0.7 | 114.5 | D182 A186 | D182-R184 PolarHBondContact O-N 2.99Å; D182-R184 WeakPolarHBondContact OD1-CB 3.49Å; D182-R184 WeakPolarHBondContact OD1-CG 3.3Å; D182-R184 IonicContact OD1-CZ 3.47Å; D182-R184 PolarHBondContact OD1-N 3.29Å; D182-R184 IonicContact OD1-NE 2.74Å; D182-R184 PolarHBondContact OD1-NE 2.84Å; D182-R184 IonicContact OD1-NH2 3.38Å; D182-R184 PolarHBondContact OD1-NH2 3.13Å; D182-R184 IonicContact OD2-CZ 3.59Å; D182-R184 IonicContact OD2-NE 3.57Å; D182-R184 IonicContact OD2-NH2 2.75Å; D182-R184 PolarHBondContact OD2-NH2 2.75Å; R184-A186 PolarHBondContact O-N 3.28Å |
| 185 | F | 49.2 | Very low | 49.8 | Very low | 195 Ų | 195 | 135.6 Ų | 135.6 | 86% | 0.855 | 72% | 0.721 | S | S | * | * | trans | -90.7 | 75.1 | 169.6 | -64.6 | -70.6 | 0 | 0 | 0 | 111.3 | ||||
| 186 | A | 47.3 | Very low | 49.8 | Very low | 83 Ų | 83 | 132.2 Ų | 132.2 | 69% | 0.686 | 71% | 0.706 | S | S | * | * | trans | -75.7 | 143.7 | 168.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | R184 | R184-A186 PolarHBondContact O-N 3.28Š| ||
| 187 | C | 42.3 | Very low | 49.8 | Very low | 130 Ų | 130 | 126.7 Ų | 126.7 | 88% | 0.878 | 68% | 0.682 | S | S | * | * | trans | 43.3 | 104.1 | 158.7 | -65.8 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 188 | S | 39.9 | Very low | 50.1 | Low | 117 Ų | 117 | 132 Ų | 132 | 82% | 0.818 | 69% | 0.692 | S | S | * | * | trans | -144.7 | 120.5 | 139.6 | -169.8 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 189 | P | 54.3 | Low | 50.3 | Low | 121 Ų | 121 | 135.3 Ų | 135.3 | 79% | 0.786 | 71% | 0.707 | S | S | * | * | trans | -106.8 | 66 | -171.8 | 39.8 | -34 | 0 | 0 | 0 | 113.6 | ||||
| 190 | H | 44.2 | Very low | 50.7 | Low | 165 Ų | 165 | 129.6 Ų | 129.6 | 76% | 0.764 | 70% | 0.695 | S | S | * | * | trans | -152.9 | 146.9 | 162.6 | -140.5 | 59.1 | 0 | 0 | 0 | 116.7 | ||||
| 191 | Q | 42.9 | Very low | 50.9 | Low | 165 Ų | 165 | 128.3 Ų | 128.3 | 77% | 0.771 | 69% | 0.694 | S | S | * | * | trans | 61.1 | 144.5 | 171.6 | -87.1 | -171.5 | 36 | 0 | 0 | 120.9 | S193 | Q191-S193 VanDerWaalsContact C-N 3.28Å; Q191-S193 PolarHBondContact O-N 2.84Å | ||
| 192 | N | 50.1 | Low | 51.5 | Low | 141 Ų | 141 | 131.1 Ų | 131.1 | 75% | 0.754 | 71% | 0.705 | S | S | * | * | trans | -68.9 | 76.8 | 169.7 | -70.7 | -15.8 | 0 | 0 | 0 | 110.8 | V194 | N192-V194 PolarHBondContact O-N 3.05Š| ||
| 193 | S | 44.8 | Very low | 52.8 | Low | 97 Ų | 97 | 134 Ų | 134 | 68% | 0.678 | 71% | 0.714 | S | S | * | * | trans | -76.6 | 109.4 | 170.4 | -170.8 | 0 | 0 | 0 | 0 | 110.4 | Q191 L195 | Q191-S193 VanDerWaalsContact C-N 3.28Å; Q191-S193 PolarHBondContact O-N 2.84Å; S193-L195 VanDerWaalsContact C-N 3.26Å; S193-L195 PolarHBondContact O-N 3.01Å | ||
| 194 | V | 50.6 | Low | 53.7 | Low | 127 Ų | 127 | 138 Ų | 138 | 77% | 0.77 | 72% | 0.716 | S | S | * | * | trans | -68.4 | 89 | 161.3 | -85.4 | 0 | 0 | 0 | 0 | 108.3 | N192 L196 | N192-V194 PolarHBondContact O-N 3.05Å; V194-L196 VanDerWaalsContact C-N 3.33Å; V194-L196 PolarHBondContact O-N 2.99Å | ||
| 195 | L | 54.3 | Low | 55.2 | Low | 121 Ų | 121 | 133 Ų | 133 | 63% | 0.634 | 71% | 0.708 | S | S | * | * | trans | -61.5 | 94.2 | 174 | -170.6 | 81.5 | 0 | 0 | 0 | 109.5 | S193 D197 | S193-L195 VanDerWaalsContact C-N 3.26Å; S193-L195 PolarHBondContact O-N 3.01Å; L195-D197 PolarHBondContact O-N 3Å | ||
| 196 | L | 52.6 | Low | 57 | Low | 120 Ų | 120 | 133.6 Ų | 133.6 | 63% | 0.628 | 71% | 0.705 | S | S | * | * | trans | -75.7 | 104.2 | 168.3 | -82.9 | 154.2 | 0 | 0 | 0 | 108 | V194 | V194-L196 VanDerWaalsContact C-N 3.33Å; V194-L196 PolarHBondContact O-N 2.99Å | ||
| 197 | D | 54.2 | Low | 58.9 | Low | 45 Ų | 45 | 134.3 Ų | 134.3 | 24% | 0.241 | 70% | 0.702 | C | S | . | * | trans | -59.3 | 150.5 | 165 | -79.3 | -100.1 | 0 | 0 | 0 | 111 | L195 D199 G200 K203 | L195-D197 PolarHBondContact O-N 3Å; D197-D199 PolarHBondContact O-N 3.4Å; D197-G200 PolarHBondContact O-N 2.95Å; D197-K203 VanDerWaalsContact CG-CE 3.44Å; D197-K203 IonicContact OD1-NZ 2.68Å; D197-K203 PolarHBondContact OD1-NZ 3.46Å; D197-K203 WeakPolarHBondContact OD2-CD 3.38Å; D197-K203 WeakPolarHBondContact OD2-CE 3.13Å; D197-K203 IonicContact OD2-NZ 2.76Å; D197-K203 PolarHBondContact OD2-NZ 3.17Å | ||
| 198 | K | 59.2 | Low | 61.3 | Low | 214 Ų | 214 | 133.1 Ų | 133.1 | 93% | 0.93 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.5 | -8.8 | -174 | -156.9 | 169.2 | 175.1 | -176.3 | 0 | 114.6 | ||
| 199 | D | 59.2 | Low | 64 | Low | 115 Ų | 115 | 130.6 Ų | 130.6 | 62% | 0.615 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.6 | 11.9 | 177.9 | -51.4 | -77.1 | 0 | 0 | 0 | 114.4 | D197 K201 | D197-D199 PolarHBondContact O-N 3.4Å; D199-K201 HydrophobicContact CB-CD 4.33Å; D199-K201 VanDerWaalsContact CB-CE 3.42Å; D199-K201 HydrophobicContact CB-CG 4.21Å; D199-K201 PolarHBondContact O-N 2.97Å |
| 200 | G | 61 | Low | 66 | Low | 55 Ų | 55 | 127.8 Ų | 127.8 | 57% | 0.567 | 65% | 0.648 | S | S | * | * | trans | 69.9 | -13.9 | 171.2 | 0 | 0 | 0 | 0 | 0 | 117 | D197 R202 | D197-G200 PolarHBondContact O-N 2.95Å; G200-R202 PolarHBondContact O-N 3.36Å | ||
| 201 | K | 59.9 | Low | 68.6 | Low | 149 Ų | 149 | 122.5 Ų | 122.5 | 65% | 0.648 | 64% | 0.639 | S | S | * | * | trans | -79.3 | 105.2 | 177.5 | 45 | -149.3 | 164.6 | -159.2 | 0 | 111.3 | D199 K203 | D199-K201 HydrophobicContact CB-CD 4.33Å; D199-K201 VanDerWaalsContact CB-CE 3.42Å; D199-K201 HydrophobicContact CB-CG 4.21Å; D199-K201 PolarHBondContact O-N 2.97Å; K201-K203 PolarHBondContact O-N 3.31Å | ||
| 202 | R | 62.9 | Low | 71.2 | Confident | 226 Ų | 226 | 122.1 Ų | 122.1 | 85% | 0.853 | 64% | 0.637 | S | S | * | * | trans | -55.3 | 102.3 | -179.4 | -43.3 | -171.6 | -54.9 | -150.3 | 5.3 | 110.6 | G200 H204 | G200-R202 PolarHBondContact O-N 3.36Å; R202-H204 PolarHBondContact O-N 2.96Å | ||
| 203 | K | 72.6 | Confident | 73.4 | Confident | 130 Ų | 130 | 117.5 Ų | 117.5 | 57% | 0.565 | 61% | 0.611 | S | S | * | * | trans | -63.4 | 129.3 | 169.9 | -67.3 | -174 | -173.8 | 152.8 | 0 | 108.2 | D197 K201 T205 | D197-K203 VanDerWaalsContact CG-CE 3.44Å; D197-K203 IonicContact OD1-NZ 2.68Å; D197-K203 PolarHBondContact OD1-NZ 3.46Å; D197-K203 WeakPolarHBondContact OD2-CD 3.38Å; D197-K203 WeakPolarHBondContact OD2-CE 3.13Å; D197-K203 IonicContact OD2-NZ 2.76Å; D197-K203 PolarHBondContact OD2-NZ 3.17Å; K201-K203 PolarHBondContact O-N 3.31Å; K203-T205 PolarHBondContact O-N 3.46Å | ||
| 204 | H | 73.2 | Confident | 76 | Confident | 179 Ų | 179 | 116.4 Ų | 116.4 | 83% | 0.829 | 60% | 0.596 | S | S | * | * | trans | -77.1 | 77.2 | -179.4 | -166.3 | 79.5 | 0 | 0 | 0 | 109.9 | R202 R206 | R202-H204 PolarHBondContact O-N 2.96Å; H204-R206 PolarHBondContact O-N 3.2Å | ||
| 205 | T | 84.6 | Confident | 78.2 | Confident | 97 Ų | 97 | 117.1 Ų | 117.1 | 60% | 0.595 | 59% | 0.59 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 128.4 | 176.7 | -60.1 | 0 | 0 | 0 | 0 | 109.5 | K203 | K203-T205 PolarHBondContact O-N 3.46Š|
| 206 | R | 86.4 | Confident | 80.3 | Confident | 209 Ų | 209 | 112.5 Ų | 112.5 | 79% | 0.789 | 57% | 0.569 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 127.3 | -178 | -163.3 | -178.3 | -161.9 | -69.3 | -3 | 109.7 | H204 T208 | H204-R206 PolarHBondContact O-N 3.2Å; R206-T208 PolarHBondContact O-N 2.92Å |
| 207 | P | 87.4 | Confident | 82.5 | Confident | 98 Ų | 98 | 106.8 Ų | 106.8 | 64% | 0.636 | 54% | 0.539 | S | S | * | . | P | Polyproline II helix | trans | -55.6 | 128.5 | 178.4 | -27.7 | 35.2 | 0 | 0 | 0 | 112 | ||
| 208 | T | 93.4 | Very high | 84.6 | Confident | 105 Ų | 105 | 106.3 Ų | 106.3 | 64% | 0.644 | 54% | 0.535 | S | S | * | . | P | Polyproline II helix | trans | -102.1 | 151.9 | 173.9 | 49.7 | 0 | 0 | 0 | 0 | 109.9 | R206 | R206-T208 PolarHBondContact O-N 2.92Š|
| 209 | F | 95.6 | Very high | 86.5 | Confident | 64 Ų | 64 | 101.6 Ų | 101.6 | 28% | 0.281 | 52% | 0.515 | S | S | . | . | P | Polyproline II helix | trans | -87.2 | 146.3 | 172.7 | -57.5 | -52.3 | 0 | 0 | 0 | 109.8 | Q213 I214 M241 Q245 W249 | F209-Q213 HydrophobicContact CB-CB 4.33Å; F209-I214 HydrophobicContact CB-CD1 4.34Å; F209-I214 HydrophobicContact CB-CG1 3.93Å; F209-I214 WeakPolarHBondContact O-CD1 3.33Å; F209-M241 HydrophobicContact CD1-CE 3.66Å; F209-M241 HydrophobicContact CD1-SD 4.42Å; F209-M241 HydrophobicContact CD2-CE 4.42Å; F209-M241 HydrophobicContact CE1-CE 3.42Å; F209-M241 VanDerWaalsContact CE1-CE 3.42Å; F209-M241 HydrophobicContact CE2-CE 4.21Å; F209-M241 HydrophobicContact CG-CE 4.17Å; F209-M241 HydrophobicContact CZ-CE 3.71Å; F209-Q245 HydrophobicContact CE1-CB 4.44Å; F209-Q245 HydrophobicContact CE1-CG 4.47Å; F209-Q245 HydrophobicContact CZ-CB 4.27Å; F209-Q245 HydrophobicContact CZ-CG 4.46Å; F209-W249 AromaticContact CD2-CD1 3.8Å; F209-W249 AromaticContact CE2-CD1 3.79Å |
| 210 | S | 97.3 | Very high | 88.3 | Confident | 61 Ų | 61 | 97.5 Ų | 97.5 | 43% | 0.427 | 49% | 0.494 | S | S | . | . | P | Polyproline II helix | trans | -62.3 | 150.9 | 175.3 | 173.8 | 0 | 0 | 0 | 0 | 111.2 | Q212 Q213 I214 | S210-Q212 PolarHBondContact O-N 3.28Å; S210-Q213 WeakPolarHBondContact O-CB 3.32Å; S210-Q213 PolarHBondContact O-N 2.88Å; S210-I214 WeakPolarHBondContact O-CG1 3.46Å; S210-I214 PolarHBondContact O-N 3.42Å |
| 211 | G | 97.4 | Very high | 90.1 | Very high | 54 Ų | 54 | 95 Ų | 95 | 56% | 0.557 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -54.3 | -37.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | I214 F215 | G211-I214 PolarHBondContact O-N 3.22Å; G211-F215 WeakPolarHBondContact O-CB 3.48Å; G211-F215 PolarHBondContact O-N 3.17Å |
| 212 | Q | 97.8 | Very high | 91.9 | Very high | 158 Ų | 158 | 94.1 Ų | 94.1 | 74% | 0.738 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -65.5 | -39.9 | 175.7 | -174.4 | 179.7 | 1.5 | 0 | 0 | 112.5 | S210 A216 | S210-Q212 PolarHBondContact O-N 3.28Å; Q212-A216 PolarHBondContact O-N 3.14Å; Q212-A216 VanDerWaalsContact O-N 3.1Å |
| 213 | Q | 97.9 | Very high | 93.5 | Very high | 44 Ų | 44 | 90.3 Ų | 90.3 | 21% | 0.206 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -65.4 | -45.6 | 175.4 | -67.5 | 172.7 | -40.5 | 0 | 0 | 110.4 | F209 S210 F215 A216 L217 L239 M241 | F209-Q213 HydrophobicContact CB-CB 4.33Å; S210-Q213 WeakPolarHBondContact O-CB 3.32Å; S210-Q213 PolarHBondContact O-N 2.88Å; Q213-F215 PolarHBondContact O-N 3.33Å; Q213-A216 PolarHBondContact O-N 2.95Å; Q213-L217 WeakPolarHBondContact O-CB 3.28Å; Q213-L217 WeakPolarHBondContact O-CD1 3.5Å; Q213-L217 WeakPolarHBondContact O-CG 3.36Å; Q213-L217 PolarHBondContact O-N 2.88Å; Q213-L239 HydrophobicContact CG-CB 4.41Å; Q213-L239 PolarHBondContact NE2-O 3.46Å; Q213-M241 HydrophobicContact CB-SD 4.15Å; Q213-M241 HydrophobicContact CG-SD 4.28Å |
| 214 | I | 97.9 | Very high | 94.7 | Very high | 73 Ų | 73 | 86.2 Ų | 86.2 | 37% | 0.374 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -61.2 | -44.7 | 177.8 | -64.5 | 168.2 | 0 | 0 | 0 | 110.9 | F209 S210 G211 L217 E218 | F209-I214 HydrophobicContact CB-CD1 4.34Å; F209-I214 HydrophobicContact CB-CG1 3.93Å; F209-I214 WeakPolarHBondContact O-CD1 3.33Å; S210-I214 WeakPolarHBondContact O-CG1 3.46Å; S210-I214 PolarHBondContact O-N 3.42Å; G211-I214 PolarHBondContact O-N 3.22Å; I214-L217 PolarHBondContact O-N 3.27Å; I214-E218 WeakPolarHBondContact O-CB 3.42Å; I214-E218 PolarHBondContact O-N 3.27Å |
| 215 | F | 98.2 | Very high | 95.8 | Very high | 143 Ų | 143 | 80.5 Ų | 80.5 | 63% | 0.627 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -59.6 | -47.7 | 178.2 | 174.6 | -100.1 | 0 | 0 | 0 | 112.3 | G211 Q213 E218 K219 | G211-F215 WeakPolarHBondContact O-CB 3.48Å; G211-F215 PolarHBondContact O-N 3.17Å; Q213-F215 PolarHBondContact O-N 3.33Å; F215-E218 PolarHBondContact O-N 3.03Å; F215-K219 WeakPolarHBondContact O-CB 3.32Å; F215-K219 PolarHBondContact O-N 2.83Å |
| 216 | A | 97.9 | Very high | 96.5 | Very high | 24 Ų | 24 | 83 Ų | 83 | 20% | 0.198 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -65.7 | -42 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q212 Q213 E218 K219 T220 L239 | Q212-A216 PolarHBondContact O-N 3.14Å; Q212-A216 VanDerWaalsContact O-N 3.1Å; Q213-A216 PolarHBondContact O-N 2.95Å; A216-E218 VanDerWaalsContact C-N 3.31Å; A216-E218 PolarHBondContact O-N 3.32Å; A216-K219 PolarHBondContact O-N 2.89Å; A216-T220 PolarHBondContact O-N 2.84Å; A216-T220 PolarHBondContact O-OG1 3.12Å; A216-T220 VanDerWaalsContact O-OG1 3.1Å; A216-L239 HydrophobicContact CB-CD1 4.05Å; A216-L239 HydrophobicContact CB-CD2 3.58Å; A216-L239 HydrophobicContact CB-CG 4.41Å |
| 217 | L | 98.4 | Very high | 97 | Very high | 0 Ų | 0 | 74.1 Ų | 74.1 | 0% | 0 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -59.7 | -41.1 | 174.3 | -71.8 | 164.7 | 0 | 0 | 0 | 111.9 | Q213 I214 F221 L235 L239 M241 V246 W249 F250 | Q213-L217 WeakPolarHBondContact O-CB 3.28Å; Q213-L217 WeakPolarHBondContact O-CD1 3.5Å; Q213-L217 WeakPolarHBondContact O-CG 3.36Å; Q213-L217 PolarHBondContact O-N 2.88Å; I214-L217 PolarHBondContact O-N 3.27Å; L217-F221 WeakPolarHBondContact O-CB 3.11Å; L217-F221 PolarHBondContact O-N 3.36Å; L217-L235 HydrophobicContact CD2-CD2 3.95Å; L217-L235 HydrophobicContact CD2-CG 4.48Å; L217-L239 HydrophobicContact CD2-CD1 3.98Å; L217-L239 HydrophobicContact CG-CD1 3.78Å; L217-M241 HydrophobicContact CD1-CE 4.14Å; L217-M241 HydrophobicContact CD1-SD 4.05Å; L217-V246 HydrophobicContact CD2-CG1 4.14Å; L217-V246 HydrophobicContact CD2-CG2 4.41Å; L217-W249 HydrophobicContact CB-CD2 3.94Å; L217-W249 HydrophobicContact CB-CE3 3.91Å; L217-W249 HydrophobicContact CB-CH2 3.72Å; L217-W249 HydrophobicContact CB-CZ2 3.72Å; L217-W249 HydrophobicContact CB-CZ3 3.8Å; L217-W249 HydrophobicContact CD1-CD2 3.89Å; L217-W249 HydrophobicContact CD1-CG 3.85Å; L217-W249 HydrophobicContact CD2-CD2 4.41Å; L217-W249 HydrophobicContact CD2-CE3 4.34Å; L217-W249 HydrophobicContact CG-CD2 4.31Å; L217-W249 HydrophobicContact CG-CE3 4.5Å; L217-F250 HydrophobicContact CD2-CD2 4.45Å; L217-F250 HydrophobicContact CD2-CE2 3.93Å |
| 218 | E | 98.4 | Very high | 97.5 | Very high | 34 Ų | 34 | 72 Ų | 72 | 16% | 0.159 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -69.6 | -46.9 | 178.2 | -163.4 | 65.6 | -123.6 | 0 | 0 | 112.1 | I214 F215 A216 T220 F221 E222 W249 R253 | I214-E218 WeakPolarHBondContact O-CB 3.42Å; I214-E218 PolarHBondContact O-N 3.27Å; F215-E218 PolarHBondContact O-N 3.03Å; A216-E218 VanDerWaalsContact C-N 3.31Å; A216-E218 PolarHBondContact O-N 3.32Å; E218-T220 VanDerWaalsContact C-N 3.27Å; E218-T220 PolarHBondContact O-N 2.76Å; E218-F221 CarbonylContact O-C 3.55Å; E218-F221 WeakPolarHBondContact O-CA 3.45Å; E218-F221 WeakPolarHBondContact O-CB 3.47Å; E218-F221 PolarHBondContact O-N 3.15Å; E218-F221 WeakPolarHBondContact OE1-CD1 3.37Å; E218-E222 PolarHBondContact O-N 2.84Å; E218-W249 HydrophobicContact CB-CH2 4.35Å; E218-R253 IonicContact OE1-CZ 2.93Å; E218-R253 IonicContact OE1-NE 2.75Å; E218-R253 PolarHBondContact OE1-NE 3.33Å; E218-R253 IonicContact OE1-NH1 3.96Å; E218-R253 IonicContact OE1-NH2 2.69Å; E218-R253 PolarHBondContact OE1-NH2 2.68Å; E218-R253 WeakPolarHBondContact OE2-CD 3.43Å; E218-R253 IonicContact OE2-CZ 2.84Å; E218-R253 IonicContact OE2-NE 2.9Å; E218-R253 PolarHBondContact OE2-NE 2.91Å; E218-R253 IonicContact OE2-NH1 3.16Å; E218-R253 PolarHBondContact OE2-NH1 3.1Å; E218-R253 VanDerWaalsContact OE2-NH1 3.16Å; E218-R253 IonicContact OE2-NH2 3.22Å; E218-R253 PolarHBondContact OE2-NH2 3.29Å |
| 219 | K | 98.3 | Very high | 97.7 | Very high | 116 Ų | 116 | 68.6 Ų | 68.6 | 50% | 0.504 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -55.8 | -42.3 | 174.9 | -176.7 | 177.8 | -178.3 | 178.1 | 0 | 111.9 | F215 A216 Q223 | F215-K219 WeakPolarHBondContact O-CB 3.32Å; F215-K219 PolarHBondContact O-N 2.83Å; A216-K219 PolarHBondContact O-N 2.89Å; K219-Q223 WeakPolarHBondContact O-CG 2.99Å; K219-Q223 PolarHBondContact O-N 3.18Å |
| 220 | T | 97.6 | Very high | 97.8 | Very high | 28 Ų | 28 | 70 Ų | 70 | 17% | 0.172 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -70.2 | -35.2 | 174.7 | -55.5 | 0 | 0 | 0 | 0 | 112 | A216 E218 E222 Q223 T224 L227 L235 F250 | A216-T220 PolarHBondContact O-N 2.84Å; A216-T220 PolarHBondContact O-OG1 3.12Å; A216-T220 VanDerWaalsContact O-OG1 3.1Å; E218-T220 VanDerWaalsContact C-N 3.27Å; E218-T220 PolarHBondContact O-N 2.76Å; T220-E222 VanDerWaalsContact C-N 3.33Å; T220-E222 PolarHBondContact O-N 2.84Å; T220-Q223 PolarHBondContact O-N 3.29Å; T220-T224 HydrophobicContact CG2-CG2 4.42Å; T220-T224 PolarHBondContact O-N 3.43Å; T220-L227 HydrophobicContact CG2-CD2 3.85Å; T220-L235 HydrophobicContact CG2-CD2 4.01Å; T220-F250 HydrophobicContact CG2-CZ 4.2Å |
| 221 | F | 98.3 | Very high | 97.8 | Very high | 4 Ų | 4 | 70.5 Ų | 70.5 | 2% | 0.018 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -65.6 | -34.3 | 175.8 | -177.2 | -101.9 | 0 | 0 | 0 | 113 | L217 E218 T224 K225 W249 F250 R253 R254 W257 | L217-F221 WeakPolarHBondContact O-CB 3.11Å; L217-F221 PolarHBondContact O-N 3.36Å; E218-F221 CarbonylContact O-C 3.55Å; E218-F221 WeakPolarHBondContact O-CA 3.45Å; E218-F221 WeakPolarHBondContact O-CB 3.47Å; E218-F221 PolarHBondContact O-N 3.15Å; E218-F221 WeakPolarHBondContact OE1-CD1 3.37Å; F221-T224 CarbonylContact C-O 3.59Å; F221-T224 WeakPolarHBondContact CA-O 3.11Å; F221-T224 CarbonylContact O-C 3.56Å; F221-K225 HydrophobicContact CD1-CD 4.13Å; F221-K225 HydrophobicContact CD2-CD 4.28Å; F221-K225 HydrophobicContact CE1-CD 3.61Å; F221-K225 HydrophobicContact CE2-CB 4.1Å; F221-K225 HydrophobicContact CE2-CD 3.77Å; F221-K225 HydrophobicContact CG-CD 4.45Å; F221-K225 HydrophobicContact CZ-CB 4.44Å; F221-K225 HydrophobicContact CZ-CD 3.41Å; F221-K225 VanDerWaalsContact CZ-CD 3.41Å; F221-K225 HydrophobicContact CZ-CG 4.48Å; F221-K225 WeakPolarHBondContact O-CD 3.34Å; F221-K225 WeakPolarHBondContact O-CE 3.39Å; F221-K225 PolarHBondContact O-NZ 2.84Å; F221-W249 HydrophobicContact CB-CH2 4.43Å; F221-W249 HydrophobicContact CB-CZ3 4.08Å; F221-W249 HydrophobicContact CG-CZ3 4.46Å; F221-F250 HydrophobicContact CB-CE1 4.09Å; F221-F250 HydrophobicContact CB-CZ 4.16Å; F221-F250 AromaticContact CD2-CD1 3.88Å; F221-F250 HydrophobicContact CD2-CD1 3.88Å; F221-F250 AromaticContact CD2-CE1 3.8Å; F221-F250 HydrophobicContact CD2-CE1 3.8Å; F221-F250 HydrophobicContact CG-CE1 4.46Å; F221-R253 HydrophobicContact CB-CG 4.48Å; F221-R253 HydrophobicContact CD1-CG 3.55Å; F221-R253 HydrophobicContact CD2-CB 4.29Å; F221-R253 HydrophobicContact CD2-CG 3.75Å; F221-R253 HydrophobicContact CE1-CG 3.57Å; F221-R253 HydrophobicContact CE2-CB 4.2Å; F221-R253 HydrophobicContact CE2-CG 3.78Å; F221-R253 HydrophobicContact CG-CG 3.64Å; F221-R253 HydrophobicContact CZ-CB 4.42Å; F221-R253 HydrophobicContact CZ-CG 3.68Å; F221-R254 HydrophobicContact CE2-CG 3.8Å; F221-R254 HydrophobicContact CZ-CG 4.3Å; F221-W257 HydrophobicContact CE1-CB 4.41Å; F221-W257 HydrophobicContact CE1-CG 4.38Å; F221-W257 HydrophobicContact CZ-CB 4.13Å; F221-W257 HydrophobicContact CZ-CG 4.23Å |
| 222 | E | 97.9 | Very high | 97.9 | Very high | 129 Ų | 129 | 70.6 Ų | 70.6 | 60% | 0.603 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -61.5 | -44 | 172.9 | -73.6 | 172.7 | 175.4 | 0 | 0 | 111.3 | E218 T220 K225 | E218-E222 PolarHBondContact O-N 2.84Å; T220-E222 VanDerWaalsContact C-N 3.33Å; T220-E222 PolarHBondContact O-N 2.84Å; E222-K225 PolarHBondContact O-NZ 3.26Å |
| 223 | Q | 97.4 | Very high | 97.9 | Very high | 147 Ų | 147 | 64.9 Ų | 64.9 | 69% | 0.687 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -67.5 | -51.2 | 175.7 | -65.2 | 173.1 | -16 | 0 | 0 | 112.5 | K219 T220 | K219-Q223 WeakPolarHBondContact O-CG 2.99Å; K219-Q223 PolarHBondContact O-N 3.18Å; T220-Q223 PolarHBondContact O-N 3.29Å |
| 224 | T | 97.1 | Very high | 97.9 | Very high | 43 Ų | 43 | 70.4 Ų | 70.4 | 26% | 0.264 | 35% | 0.354 | S | S | . | . | trans | -136.4 | 129.8 | 177.3 | 178.6 | 0 | 0 | 0 | 0 | 112.3 | T220 F221 Y226 L227 | T220-T224 HydrophobicContact CG2-CG2 4.42Å; T220-T224 PolarHBondContact O-N 3.43Å; F221-T224 CarbonylContact C-O 3.59Å; F221-T224 WeakPolarHBondContact CA-O 3.11Å; F221-T224 CarbonylContact O-C 3.56Å; T224-Y226 VanDerWaalsContact C-N 3.26Å; T224-Y226 PolarHBondContact O-N 3.22Å; T224-Y226 PolarHBondContact OG1-N 3.12Å; T224-Y226 PolarHBondContact OG1-O 3.01Å; T224-L227 HydrophobicContact CG2-CD2 3.67Å; T224-L227 HydrophobicContact CG2-CG 4.45Å | ||
| 225 | K | 97.3 | Very high | 97.9 | Very high | 60 Ų | 60 | 68 Ų | 68 | 26% | 0.261 | 34% | 0.341 | S | S | . | . | S | Bend | trans | -76.8 | -15 | 178.8 | -52.1 | -66.1 | 164.4 | -68.6 | 0 | 112.3 | F221 E222 R254 | F221-K225 HydrophobicContact CD1-CD 4.13Å; F221-K225 HydrophobicContact CD2-CD 4.28Å; F221-K225 HydrophobicContact CE1-CD 3.61Å; F221-K225 HydrophobicContact CE2-CB 4.1Å; F221-K225 HydrophobicContact CE2-CD 3.77Å; F221-K225 HydrophobicContact CG-CD 4.45Å; F221-K225 HydrophobicContact CZ-CB 4.44Å; F221-K225 HydrophobicContact CZ-CD 3.41Å; F221-K225 VanDerWaalsContact CZ-CD 3.41Å; F221-K225 HydrophobicContact CZ-CG 4.48Å; F221-K225 WeakPolarHBondContact O-CD 3.34Å; F221-K225 WeakPolarHBondContact O-CE 3.39Å; F221-K225 PolarHBondContact O-NZ 2.84Å; E222-K225 PolarHBondContact O-NZ 3.26Å; K225-R254 WeakPolarHBondContact O-CD 3.46Å; K225-R254 WeakPolarHBondContact O-CG 3.21Å |
| 226 | Y | 97.8 | Very high | 97.9 | Very high | 148 Ų | 148 | 61.4 Ų | 61.4 | 58% | 0.58 | 31% | 0.313 | S | S | * | . | S | Bend | trans | -139.5 | 119.5 | -175.6 | -63.9 | -102 | 0 | 0 | 0 | 110.1 | T224 R254 | T224-Y226 VanDerWaalsContact C-N 3.26Å; T224-Y226 PolarHBondContact O-N 3.22Å; T224-Y226 PolarHBondContact OG1-N 3.12Å; T224-Y226 PolarHBondContact OG1-O 3.01Å; Y226-R254 VanDerWaalsContact CE1-CD 3.48Å |
| 227 | L | 97.4 | Very high | 97.9 | Very high | 24 Ų | 24 | 70 Ų | 70 | 13% | 0.126 | 34% | 0.342 | C | S | . | . | trans | -91.1 | 128.8 | 178.4 | -71.8 | 171.8 | 0 | 0 | 0 | 112.6 | T220 T224 E231 R232 L235 V246 F250 | T220-L227 HydrophobicContact CG2-CD2 3.85Å; T224-L227 HydrophobicContact CG2-CD2 3.67Å; T224-L227 HydrophobicContact CG2-CG 4.45Å; L227-E231 HydrophobicContact CD2-CB 3.82Å; L227-R232 HydrophobicContact CB-CB 4.25Å; L227-R232 PolarHBondContact O-NH2 2.94Å; L227-L235 HydrophobicContact CD1-CD2 3.71Å; L227-V246 HydrophobicContact CD1-CG1 3.89Å; L227-F250 HydrophobicContact CD1-CD1 4.12Å; L227-F250 HydrophobicContact CD1-CD2 3.84Å; L227-F250 HydrophobicContact CD1-CE1 3.74Å; L227-F250 HydrophobicContact CD1-CE2 3.45Å; L227-F250 VanDerWaalsContact CD1-CE2 3.45Å; L227-F250 HydrophobicContact CD1-CG 4.19Å; L227-F250 HydrophobicContact CD1-CZ 3.41Å; L227-F250 VanDerWaalsContact CD1-CZ 3.41Å; L227-F250 HydrophobicContact CG-CD1 4.1Å; L227-F250 HydrophobicContact CG-CE1 3.69Å; L227-F250 HydrophobicContact CG-CE2 4.34Å; L227-F250 HydrophobicContact CG-CZ 3.85Å | ||
| 228 | A | 97.6 | Very high | 97.9 | Very high | 53 Ų | 53 | 74.5 Ų | 74.5 | 44% | 0.438 | 37% | 0.374 | S | S | . | . | trans | -64.6 | 164.8 | 166.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | E231 R232 | A228-E231 HydrophobicContact CB-CG 4.18Å; A228-E231 PolarHBondContact N-OE2 2.97Å; A228-E231 PolarHBondContact O-N 3Å; A228-R232 WeakPolarHBondContact O-CB 3.45Å; A228-R232 PolarHBondContact O-N 3.25Å | ||
| 229 | G | 97.8 | Very high | 97.9 | Very high | 33 Ų | 33 | 74.1 Ų | 74.1 | 34% | 0.34 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -53.5 | -57.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | E231 R232 A233 | G229-E231 VanDerWaalsContact C-N 3.3Å; G229-E231 PolarHBondContact O-N 2.94Å; G229-R232 WeakPolarHBondContact O-CB 3.41Å; G229-R232 PolarHBondContact O-N 3.1Å; G229-A233 PolarHBondContact O-N 2.82Å |
| 230 | P | 97.9 | Very high | 97.8 | Very high | 94 Ų | 94 | 72 Ų | 72 | 61% | 0.61 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -63.4 | -30.2 | -178.3 | -25.1 | 35.4 | 0 | 0 | 0 | 114.6 | R234 | P230-R234 WeakPolarHBondContact O-CG 3.42Å; P230-R234 PolarHBondContact O-N 3Å; P230-R234 PolarHBondContact O-NE 3.19Å |
| 231 | E | 97.8 | Very high | 97.8 | Very high | 72 Ų | 72 | 71.5 Ų | 71.5 | 34% | 0.336 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -72.7 | -41.8 | 175.8 | -58 | 178.9 | 135.8 | 0 | 0 | 111.4 | L227 A228 G229 R234 L235 | L227-E231 HydrophobicContact CD2-CB 3.82Å; A228-E231 HydrophobicContact CB-CG 4.18Å; A228-E231 PolarHBondContact N-OE2 2.97Å; A228-E231 PolarHBondContact O-N 3Å; G229-E231 VanDerWaalsContact C-N 3.3Å; G229-E231 PolarHBondContact O-N 2.94Å; E231-R234 PolarHBondContact O-N 3.01Å; E231-L235 WeakPolarHBondContact O-CB 3.33Å; E231-L235 PolarHBondContact O-N 2.82Å |
| 232 | R | 98.5 | Very high | 97.8 | Very high | 55 Ų | 55 | 75 Ų | 75 | 21% | 0.208 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.1 | -43.3 | 176.4 | -166.2 | -169.8 | -45.3 | 110.8 | 9.8 | 111.6 | L227 A228 G229 L235 A236 E243 V246 | L227-R232 HydrophobicContact CB-CB 4.25Å; L227-R232 PolarHBondContact O-NH2 2.94Å; A228-R232 WeakPolarHBondContact O-CB 3.45Å; A228-R232 PolarHBondContact O-N 3.25Å; G229-R232 WeakPolarHBondContact O-CB 3.41Å; G229-R232 PolarHBondContact O-N 3.1Å; R232-L235 PolarHBondContact O-N 3.39Å; R232-A236 WeakPolarHBondContact O-CB 3.37Å; R232-A236 PolarHBondContact O-N 3.41Å; R232-E243 WeakPolarHBondContact CD-O 3.43Å; R232-E243 HydrophobicContact CG-CB 4.42Å; R232-E243 HydrophobicContact CG-CG 4.24Å; R232-E243 IonicContact NH1-OE2 3.08Å; R232-E243 PolarHBondContact NH1-OE2 3.48Å; R232-E243 VanDerWaalsContact NH1-OE2 3.08Å; R232-V246 HydrophobicContact CG-CB 4.04Å; R232-V246 HydrophobicContact CG-CG1 3.82Å |
| 233 | A | 98.3 | Very high | 97.8 | Very high | 39 Ų | 39 | 72.9 Ų | 72.9 | 32% | 0.322 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -59.8 | -46.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | G229 A236 Y237 E243 | G229-A233 PolarHBondContact O-N 2.82Å; A233-A236 PolarHBondContact O-N 3.38Å; A233-Y237 WeakPolarHBondContact O-CB 3.16Å; A233-Y237 PolarHBondContact O-N 2.96Å; A233-E243 HydrophobicContact CB-CG 4.42Å |
| 234 | R | 98.2 | Very high | 97.9 | Very high | 160 Ų | 160 | 69.6 Ų | 69.6 | 60% | 0.604 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -59.8 | -49.6 | 174.7 | -77.2 | -175.6 | -72.3 | 142 | -7.9 | 112.4 | P230 E231 A236 Y237 S238 | P230-R234 WeakPolarHBondContact O-CG 3.42Å; P230-R234 PolarHBondContact O-N 3Å; P230-R234 PolarHBondContact O-NE 3.19Å; E231-R234 PolarHBondContact O-N 3.01Å; R234-A236 VanDerWaalsContact C-N 3.35Å; R234-A236 PolarHBondContact O-N 2.91Å; R234-Y237 PolarHBondContact O-N 3.3Å; R234-S238 PolarHBondContact O-N 3.27Å; R234-S238 PolarHBondContact O-OG 2.98Å |
| 235 | L | 98.1 | Very high | 97.9 | Very high | 21 Ų | 21 | 71.3 Ų | 71.3 | 11% | 0.11 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -65.2 | -38.1 | -179.4 | -172.8 | 63 | 0 | 0 | 0 | 112.4 | L217 T220 L227 E231 R232 L239 V246 F250 | L217-L235 HydrophobicContact CD2-CD2 3.95Å; L217-L235 HydrophobicContact CD2-CG 4.48Å; T220-L235 HydrophobicContact CG2-CD2 4.01Å; L227-L235 HydrophobicContact CD1-CD2 3.71Å; E231-L235 WeakPolarHBondContact O-CB 3.33Å; E231-L235 PolarHBondContact O-N 2.82Å; R232-L235 PolarHBondContact O-N 3.39Å; L235-L239 HydrophobicContact CD1-CD1 3.83Å; L235-L239 HydrophobicContact CD1-CG 4.2Å; L235-L239 HydrophobicContact CG-CD1 4.04Å; L235-L239 WeakPolarHBondContact O-CB 3.5Å; L235-L239 VanDerWaalsContact O-CG 3.32Å; L235-L239 WeakPolarHBondContact O-CG 3.38Å; L235-L239 PolarHBondContact O-N 3.22Å; L235-V246 HydrophobicContact CD2-CG1 4.06Å; L235-F250 HydrophobicContact CD2-CE2 4Å; L235-F250 HydrophobicContact CD2-CZ 4.33Å |
| 236 | A | 98.4 | Very high | 97.9 | Very high | 5 Ų | 5 | 68.5 Ų | 68.5 | 4% | 0.041 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -60 | -50.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111 | R232 A233 R234 L239 G240 M241 E243 V246 | R232-A236 WeakPolarHBondContact O-CB 3.37Å; R232-A236 PolarHBondContact O-N 3.41Å; A233-A236 PolarHBondContact O-N 3.38Å; R234-A236 VanDerWaalsContact C-N 3.35Å; R234-A236 PolarHBondContact O-N 2.91Å; A236-L239 PolarHBondContact O-N 3.38Å; A236-G240 PolarHBondContact O-N 2.76Å; A236-M241 CarbonylContact C-O 3.33Å; A236-M241 WeakPolarHBondContact CB-O 3.38Å; A236-M241 PolarHBondContact O-N 3.29Å; A236-M241 VanDerWaalsContact O-O 3.06Å; A236-E243 HydrophobicContact CB-CG 4.05Å; A236-V246 HydrophobicContact CB-CG2 3.96Å |
| 237 | Y | 98.2 | Very high | 97.9 | Very high | 204 Ų | 204 | 67.8 Ų | 67.8 | 80% | 0.8 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -58.8 | -51.1 | 176.5 | -175.1 | -97.4 | 0 | 0 | 0 | 112.2 | A233 R234 L239 G240 | A233-Y237 WeakPolarHBondContact O-CB 3.16Å; A233-Y237 PolarHBondContact O-N 2.96Å; R234-Y237 PolarHBondContact O-N 3.3Å; Y237-L239 PolarHBondContact O-N 2.71Å; Y237-L239 VanDerWaalsContact O-N 3.14Å; Y237-G240 PolarHBondContact O-N 2.88Å |
| 238 | S | 97.7 | Very high | 98 | Very high | 95 Ų | 95 | 70.2 Ų | 70.2 | 66% | 0.664 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -62.2 | -22.1 | -179.1 | -62.5 | 0 | 0 | 0 | 0 | 114.7 | R234 | R234-S238 PolarHBondContact O-N 3.27Å; R234-S238 PolarHBondContact O-OG 2.98Å |
| 239 | L | 97.3 | Very high | 98 | Very high | 27 Ų | 27 | 69.3 Ų | 69.3 | 14% | 0.141 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -105.5 | 0.6 | -178.8 | -61.5 | -176.6 | 0 | 0 | 0 | 114.1 | Q213 A216 L217 L235 A236 Y237 M241 | Q213-L239 HydrophobicContact CG-CB 4.41Å; Q213-L239 PolarHBondContact NE2-O 3.46Å; A216-L239 HydrophobicContact CB-CD1 4.05Å; A216-L239 HydrophobicContact CB-CD2 3.58Å; A216-L239 HydrophobicContact CB-CG 4.41Å; L217-L239 HydrophobicContact CD2-CD1 3.98Å; L217-L239 HydrophobicContact CG-CD1 3.78Å; L235-L239 HydrophobicContact CD1-CD1 3.83Å; L235-L239 HydrophobicContact CD1-CG 4.2Å; L235-L239 HydrophobicContact CG-CD1 4.04Å; L235-L239 WeakPolarHBondContact O-CB 3.5Å; L235-L239 VanDerWaalsContact O-CG 3.32Å; L235-L239 WeakPolarHBondContact O-CG 3.38Å; L235-L239 PolarHBondContact O-N 3.22Å; A236-L239 PolarHBondContact O-N 3.38Å; Y237-L239 PolarHBondContact O-N 2.71Å; Y237-L239 VanDerWaalsContact O-N 3.14Å; L239-M241 VanDerWaalsContact C-N 3.25Å; L239-M241 HydrophobicContact CB-CB 4.48Å; L239-M241 HydrophobicContact CB-CG 3.99Å; L239-M241 HydrophobicContact CB-SD 4Å; L239-M241 HydrophobicContact CD1-SD 4.26Å; L239-M241 PolarHBondContact O-N 3.41Å |
| 240 | G | 97.6 | Very high | 98 | Very high | 72 Ų | 72 | 68 Ų | 68 | 74% | 0.742 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.4 | 33.5 | -173.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | A236 Y237 | A236-G240 PolarHBondContact O-N 2.76Å; Y237-G240 PolarHBondContact O-N 2.88Å |
| 241 | M | 97.5 | Very high | 98 | Very high | 16 Ų | 16 | 67.6 Ų | 67.6 | 8% | 0.079 | 35% | 0.354 | C | S | . | . | trans | -115.7 | 157.9 | -177.8 | -64.6 | -180 | 64.3 | 0 | 0 | 110.4 | F209 Q213 L217 A236 L239 Q245 V246 | F209-M241 HydrophobicContact CD1-CE 3.66Å; F209-M241 HydrophobicContact CD1-SD 4.42Å; F209-M241 HydrophobicContact CD2-CE 4.42Å; F209-M241 HydrophobicContact CE1-CE 3.42Å; F209-M241 VanDerWaalsContact CE1-CE 3.42Å; F209-M241 HydrophobicContact CE2-CE 4.21Å; F209-M241 HydrophobicContact CG-CE 4.17Å; F209-M241 HydrophobicContact CZ-CE 3.71Å; Q213-M241 HydrophobicContact CB-SD 4.15Å; Q213-M241 HydrophobicContact CG-SD 4.28Å; L217-M241 HydrophobicContact CD1-CE 4.14Å; L217-M241 HydrophobicContact CD1-SD 4.05Å; A236-M241 CarbonylContact C-O 3.33Å; A236-M241 WeakPolarHBondContact CB-O 3.38Å; A236-M241 PolarHBondContact O-N 3.29Å; A236-M241 VanDerWaalsContact O-O 3.06Å; L239-M241 VanDerWaalsContact C-N 3.25Å; L239-M241 HydrophobicContact CB-CB 4.48Å; L239-M241 HydrophobicContact CB-CG 3.99Å; L239-M241 HydrophobicContact CB-SD 4Å; L239-M241 HydrophobicContact CD1-SD 4.26Å; L239-M241 PolarHBondContact O-N 3.41Å; M241-Q245 HydrophobicContact CE-CB 3.83Å; M241-V246 HydrophobicContact CB-CG2 4.19Å | ||
| 242 | T | 98.2 | Very high | 98 | Very high | 78 Ų | 78 | 68.7 Ų | 68.7 | 48% | 0.479 | 36% | 0.362 | S | S | . | . | trans | -78.8 | 149.5 | 169.2 | 62.6 | 0 | 0 | 0 | 0 | 111 | S244 Q245 V246 | T242-S244 PolarHBondContact O-N 2.99Å; T242-S244 VanDerWaalsContact O-N 3.14Å; T242-Q245 PolarHBondContact O-N 3.18Å; T242-Q245 VanDerWaalsContact OG1-CD 3.3Å; T242-Q245 VanDerWaalsContact OG1-CG 3.28Å; T242-Q245 WeakPolarHBondContact OG1-CG 3.44Å; T242-Q245 PolarHBondContact OG1-N 2.87Å; T242-Q245 PolarHBondContact OG1-OE1 3.13Å; T242-V246 PolarHBondContact O-N 3.48Å; T242-V246 VanDerWaalsContact O-N 3.11Å | ||
| 243 | E | 98.2 | Very high | 98 | Very high | 85 Ų | 85 | 70.1 Ų | 70.1 | 40% | 0.397 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -52.7 | -35 | 171.8 | -83.6 | -161.9 | -113.9 | 0 | 0 | 113 | R232 A233 A236 V246 K247 | R232-E243 WeakPolarHBondContact CD-O 3.43Å; R232-E243 HydrophobicContact CG-CB 4.42Å; R232-E243 HydrophobicContact CG-CG 4.24Å; R232-E243 IonicContact NH1-OE2 3.08Å; R232-E243 PolarHBondContact NH1-OE2 3.48Å; R232-E243 VanDerWaalsContact NH1-OE2 3.08Å; A233-E243 HydrophobicContact CB-CG 4.42Å; A236-E243 HydrophobicContact CB-CG 4.05Å; E243-V246 PolarHBondContact O-N 3.27Å; E243-K247 VanDerWaalsContact O-CB 3.3Å; E243-K247 WeakPolarHBondContact O-CB 3.37Å; E243-K247 PolarHBondContact O-N 3.36Å |
| 244 | S | 98.3 | Very high | 98 | Very high | 78 Ų | 78 | 70.3 Ų | 70.3 | 55% | 0.545 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -64.5 | -44.5 | 177.1 | -170.3 | 0 | 0 | 0 | 0 | 111.8 | T242 V246 K247 V248 | T242-S244 PolarHBondContact O-N 2.99Å; T242-S244 VanDerWaalsContact O-N 3.14Å; S244-V246 PolarHBondContact O-N 3.44Å; S244-K247 WeakPolarHBondContact O-CB 3.37Å; S244-K247 PolarHBondContact O-N 3.25Å; S244-V248 WeakPolarHBondContact O-CB 3.38Å; S244-V248 WeakPolarHBondContact O-CG2 3.41Å; S244-V248 PolarHBondContact O-N 3.15Å |
| 245 | Q | 97.8 | Very high | 97.9 | Very high | 79 Ų | 79 | 64.8 Ų | 64.8 | 37% | 0.369 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -61.7 | -43.2 | 174.8 | -73.7 | 161 | -47.8 | 0 | 0 | 111.6 | F209 M241 T242 V248 W249 | F209-Q245 HydrophobicContact CE1-CB 4.44Å; F209-Q245 HydrophobicContact CE1-CG 4.47Å; F209-Q245 HydrophobicContact CZ-CB 4.27Å; F209-Q245 HydrophobicContact CZ-CG 4.46Å; M241-Q245 HydrophobicContact CE-CB 3.83Å; T242-Q245 PolarHBondContact O-N 3.18Å; T242-Q245 VanDerWaalsContact OG1-CD 3.3Å; T242-Q245 VanDerWaalsContact OG1-CG 3.28Å; T242-Q245 WeakPolarHBondContact OG1-CG 3.44Å; T242-Q245 PolarHBondContact OG1-N 2.87Å; T242-Q245 PolarHBondContact OG1-OE1 3.13Å; Q245-V248 PolarHBondContact O-N 3.3Å; Q245-W249 WeakPolarHBondContact O-CB 3.49Å; Q245-W249 PolarHBondContact O-N 3.44Å |
| 246 | V | 98.2 | Very high | 97.8 | Very high | 0 Ų | 0 | 70.8 Ų | 70.8 | 0% | 0 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -62.4 | -45.4 | 175.2 | -179.4 | 0 | 0 | 0 | 0 | 110.8 | L217 L227 R232 L235 A236 M241 T242 E243 S244 V248 W249 F250 | L217-V246 HydrophobicContact CD2-CG1 4.14Å; L217-V246 HydrophobicContact CD2-CG2 4.41Å; L227-V246 HydrophobicContact CD1-CG1 3.89Å; R232-V246 HydrophobicContact CG-CB 4.04Å; R232-V246 HydrophobicContact CG-CG1 3.82Å; L235-V246 HydrophobicContact CD2-CG1 4.06Å; A236-V246 HydrophobicContact CB-CG2 3.96Å; M241-V246 HydrophobicContact CB-CG2 4.19Å; T242-V246 PolarHBondContact O-N 3.48Å; T242-V246 VanDerWaalsContact O-N 3.11Å; E243-V246 PolarHBondContact O-N 3.27Å; S244-V246 PolarHBondContact O-N 3.44Å; V246-V248 PolarHBondContact O-N 3Å; V246-W249 PolarHBondContact O-N 2.9Å; V246-F250 HydrophobicContact CG1-CD2 3.93Å; V246-F250 HydrophobicContact CG1-CE2 4.11Å; V246-F250 WeakPolarHBondContact O-CD2 3.38Å; V246-F250 PolarHBondContact O-N 3.02Å |
| 247 | K | 98 | Very high | 97.7 | Very high | 133 Ų | 133 | 75.8 Ų | 75.8 | 58% | 0.578 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -57.4 | -48 | 176.1 | -177.8 | -179.3 | 178.6 | -179 | 0 | 111.9 | E243 S244 F250 Q251 | E243-K247 VanDerWaalsContact O-CB 3.3Å; E243-K247 WeakPolarHBondContact O-CB 3.37Å; E243-K247 PolarHBondContact O-N 3.36Å; S244-K247 WeakPolarHBondContact O-CB 3.37Å; S244-K247 PolarHBondContact O-N 3.25Å; K247-F250 PolarHBondContact O-N 2.96Å; K247-Q251 WeakPolarHBondContact O-CB 3.5Å; K247-Q251 PolarHBondContact O-N 3.2Å |
| 248 | V | 98.1 | Very high | 97.5 | Very high | 76 Ų | 76 | 72.7 Ų | 72.7 | 46% | 0.461 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -65.1 | -41.8 | 178.3 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | S244 Q245 V246 Q251 N252 | S244-V248 WeakPolarHBondContact O-CB 3.38Å; S244-V248 WeakPolarHBondContact O-CG2 3.41Å; S244-V248 PolarHBondContact O-N 3.15Å; Q245-V248 PolarHBondContact O-N 3.3Å; V246-V248 PolarHBondContact O-N 3Å; V248-Q251 PolarHBondContact O-N 3.16Å; V248-N252 WeakPolarHBondContact O-CB 3.44Å; V248-N252 VanDerWaalsContact O-CG 3.29Å; V248-N252 PolarHBondContact O-N 3.45Å; V248-N252 PolarHBondContact O-ND2 2.91Å |
| 249 | W | 98 | Very high | 97.3 | Very high | 33 Ų | 33 | 75.5 Ų | 75.5 | 13% | 0.125 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -60.9 | -48.9 | 176 | -169.1 | 102.6 | 0 | 0 | 0 | 111.4 | F209 L217 E218 F221 Q245 V246 Q251 N252 R253 | F209-W249 AromaticContact CD2-CD1 3.8Å; F209-W249 AromaticContact CE2-CD1 3.79Å; L217-W249 HydrophobicContact CB-CD2 3.94Å; L217-W249 HydrophobicContact CB-CE3 3.91Å; L217-W249 HydrophobicContact CB-CH2 3.72Å; L217-W249 HydrophobicContact CB-CZ2 3.72Å; L217-W249 HydrophobicContact CB-CZ3 3.8Å; L217-W249 HydrophobicContact CD1-CD2 3.89Å; L217-W249 HydrophobicContact CD1-CG 3.85Å; L217-W249 HydrophobicContact CD2-CD2 4.41Å; L217-W249 HydrophobicContact CD2-CE3 4.34Å; L217-W249 HydrophobicContact CG-CD2 4.31Å; L217-W249 HydrophobicContact CG-CE3 4.5Å; E218-W249 HydrophobicContact CB-CH2 4.35Å; F221-W249 HydrophobicContact CB-CH2 4.43Å; F221-W249 HydrophobicContact CB-CZ3 4.08Å; F221-W249 HydrophobicContact CG-CZ3 4.46Å; Q245-W249 WeakPolarHBondContact O-CB 3.49Å; Q245-W249 PolarHBondContact O-N 3.44Å; V246-W249 PolarHBondContact O-N 2.9Å; W249-Q251 VanDerWaalsContact C-N 3.31Å; W249-Q251 PolarHBondContact O-N 2.9Å; W249-N252 PolarHBondContact O-N 2.75Å; W249-R253 HydrophobicContact CE3-CB 3.94Å; W249-R253 HydrophobicContact CE3-CG 4.44Å; W249-R253 HydrophobicContact CH2-CB 4.12Å; W249-R253 HydrophobicContact CH2-CG 3.78Å; W249-R253 HydrophobicContact CZ3-CB 3.69Å; W249-R253 HydrophobicContact CZ3-CG 3.69Å; W249-R253 WeakPolarHBondContact O-CB 3.42Å; W249-R253 PolarHBondContact O-N 2.69Å |
| 250 | F | 98.5 | Very high | 96.9 | Very high | 7 Ų | 7 | 81.1 Ų | 81.1 | 3% | 0.031 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -63.6 | -33.1 | 177.3 | -91.1 | -105.4 | 0 | 0 | 0 | 113 | L217 T220 F221 L227 L235 V246 K247 R254 | L217-F250 HydrophobicContact CD2-CD2 4.45Å; L217-F250 HydrophobicContact CD2-CE2 3.93Å; T220-F250 HydrophobicContact CG2-CZ 4.2Å; F221-F250 HydrophobicContact CB-CE1 4.09Å; F221-F250 HydrophobicContact CB-CZ 4.16Å; F221-F250 AromaticContact CD2-CD1 3.88Å; F221-F250 HydrophobicContact CD2-CD1 3.88Å; F221-F250 AromaticContact CD2-CE1 3.8Å; F221-F250 HydrophobicContact CD2-CE1 3.8Å; F221-F250 HydrophobicContact CG-CE1 4.46Å; L227-F250 HydrophobicContact CD1-CD1 4.12Å; L227-F250 HydrophobicContact CD1-CD2 3.84Å; L227-F250 HydrophobicContact CD1-CE1 3.74Å; L227-F250 HydrophobicContact CD1-CE2 3.45Å; L227-F250 VanDerWaalsContact CD1-CE2 3.45Å; L227-F250 HydrophobicContact CD1-CG 4.19Å; L227-F250 HydrophobicContact CD1-CZ 3.41Å; L227-F250 VanDerWaalsContact CD1-CZ 3.41Å; L227-F250 HydrophobicContact CG-CD1 4.1Å; L227-F250 HydrophobicContact CG-CE1 3.69Å; L227-F250 HydrophobicContact CG-CE2 4.34Å; L227-F250 HydrophobicContact CG-CZ 3.85Å; L235-F250 HydrophobicContact CD2-CE2 4Å; L235-F250 HydrophobicContact CD2-CZ 4.33Å; V246-F250 HydrophobicContact CG1-CD2 3.93Å; V246-F250 HydrophobicContact CG1-CE2 4.11Å; V246-F250 WeakPolarHBondContact O-CD2 3.38Å; V246-F250 PolarHBondContact O-N 3.02Å; K247-F250 PolarHBondContact O-N 2.96Å; F250-R254 WeakPolarHBondContact O-CB 3.45Å; F250-R254 WeakPolarHBondContact O-CG 3.39Å; F250-R254 PolarHBondContact O-N 2.88Å; F250-R254 PolarHBondContact O-NE 2.82Å |
| 251 | Q | 98.2 | Very high | 96.2 | Very high | 85 Ų | 85 | 81.2 Ų | 81.2 | 40% | 0.397 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -67.5 | -43.5 | 173.7 | -172.8 | 62.4 | 47 | 0 | 0 | 111.9 | K247 V248 W249 T255 | K247-Q251 WeakPolarHBondContact O-CB 3.5Å; K247-Q251 PolarHBondContact O-N 3.2Å; V248-Q251 PolarHBondContact O-N 3.16Å; W249-Q251 VanDerWaalsContact C-N 3.31Å; W249-Q251 PolarHBondContact O-N 2.9Å; Q251-T255 WeakPolarHBondContact O-CB 3.36Å; Q251-T255 PolarHBondContact O-N 3.41Å; Q251-T255 VanDerWaalsContact O-N 3.12Å; Q251-T255 PolarHBondContact O-OG1 3.21Å |
| 252 | N | 97.8 | Very high | 95.6 | Very high | 94 Ų | 94 | 83.6 Ų | 83.6 | 50% | 0.503 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -65.9 | -41.8 | 175.7 | -71.2 | -23.9 | 0 | 0 | 0 | 111.4 | V248 W249 T255 K256 | V248-N252 WeakPolarHBondContact O-CB 3.44Å; V248-N252 VanDerWaalsContact O-CG 3.29Å; V248-N252 PolarHBondContact O-N 3.45Å; V248-N252 PolarHBondContact O-ND2 2.91Å; W249-N252 PolarHBondContact O-N 2.75Å; N252-T255 PolarHBondContact O-N 2.82Å; N252-K256 PolarHBondContact O-N 3.22Å |
| 253 | R | 97.8 | Very high | 94.8 | Very high | 85 Ų | 85 | 82.8 Ų | 82.8 | 32% | 0.321 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63.5 | -48.8 | 178 | -169.8 | 69.3 | -167.7 | 168.4 | 2.5 | 111.9 | E218 F221 W249 T255 K256 W257 | E218-R253 IonicContact OE1-CZ 2.93Å; E218-R253 IonicContact OE1-NE 2.75Å; E218-R253 PolarHBondContact OE1-NE 3.33Å; E218-R253 IonicContact OE1-NH1 3.96Å; E218-R253 IonicContact OE1-NH2 2.69Å; E218-R253 PolarHBondContact OE1-NH2 2.68Å; E218-R253 WeakPolarHBondContact OE2-CD 3.43Å; E218-R253 IonicContact OE2-CZ 2.84Å; E218-R253 IonicContact OE2-NE 2.9Å; E218-R253 PolarHBondContact OE2-NE 2.91Å; E218-R253 IonicContact OE2-NH1 3.16Å; E218-R253 PolarHBondContact OE2-NH1 3.1Å; E218-R253 VanDerWaalsContact OE2-NH1 3.16Å; E218-R253 IonicContact OE2-NH2 3.22Å; E218-R253 PolarHBondContact OE2-NH2 3.29Å; F221-R253 HydrophobicContact CB-CG 4.48Å; F221-R253 HydrophobicContact CD1-CG 3.55Å; F221-R253 HydrophobicContact CD2-CB 4.29Å; F221-R253 HydrophobicContact CD2-CG 3.75Å; F221-R253 HydrophobicContact CE1-CG 3.57Å; F221-R253 HydrophobicContact CE2-CB 4.2Å; F221-R253 HydrophobicContact CE2-CG 3.78Å; F221-R253 HydrophobicContact CG-CG 3.64Å; F221-R253 HydrophobicContact CZ-CB 4.42Å; F221-R253 HydrophobicContact CZ-CG 3.68Å; W249-R253 HydrophobicContact CE3-CB 3.94Å; W249-R253 HydrophobicContact CE3-CG 4.44Å; W249-R253 HydrophobicContact CH2-CB 4.12Å; W249-R253 HydrophobicContact CH2-CG 3.78Å; W249-R253 HydrophobicContact CZ3-CB 3.69Å; W249-R253 HydrophobicContact CZ3-CG 3.69Å; W249-R253 WeakPolarHBondContact O-CB 3.42Å; W249-R253 PolarHBondContact O-N 2.69Å; R253-T255 PolarHBondContact O-N 3.31Å; R253-K256 PolarHBondContact O-N 3.1Å; R253-W257 WeakPolarHBondContact O-CB 3.45Å; R253-W257 PolarHBondContact O-N 3.19Å |
| 254 | R | 97.7 | Very high | 93.8 | Very high | 44 Ų | 44 | 83.2 Ų | 83.2 | 17% | 0.166 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -56.6 | -35.7 | 172.3 | -78.6 | -177.9 | -77.2 | 139.8 | 3.9 | 113 | F221 K225 Y226 F250 R258 | F221-R254 HydrophobicContact CE2-CG 3.8Å; F221-R254 HydrophobicContact CZ-CG 4.3Å; K225-R254 WeakPolarHBondContact O-CD 3.46Å; K225-R254 WeakPolarHBondContact O-CG 3.21Å; Y226-R254 VanDerWaalsContact CE1-CD 3.48Å; F250-R254 WeakPolarHBondContact O-CB 3.45Å; F250-R254 WeakPolarHBondContact O-CG 3.39Å; F250-R254 PolarHBondContact O-N 2.88Å; F250-R254 PolarHBondContact O-NE 2.82Å; R254-R258 WeakPolarHBondContact O-CG 3.42Å; R254-R258 PolarHBondContact O-N 3.46Å |
| 255 | T | 97.4 | Very high | 92.7 | Very high | 43 Ų | 43 | 85.6 Ų | 85.6 | 26% | 0.264 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -70.4 | -42.8 | 178.4 | -57.7 | 0 | 0 | 0 | 0 | 111.9 | Q251 N252 R253 K259 | Q251-T255 WeakPolarHBondContact O-CB 3.36Å; Q251-T255 PolarHBondContact O-N 3.41Å; Q251-T255 VanDerWaalsContact O-N 3.12Å; Q251-T255 PolarHBondContact O-OG1 3.21Å; N252-T255 PolarHBondContact O-N 2.82Å; R253-T255 PolarHBondContact O-N 3.31Å; T255-K259 WeakPolarHBondContact O-CG 3.41Å; T255-K259 PolarHBondContact O-N 2.91Å; T255-K259 VanDerWaalsContact O-N 3.13Å |
| 256 | K | 95.4 | Very high | 91.6 | Very high | 148 Ų | 148 | 85.1 Ų | 85.1 | 64% | 0.643 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -62.5 | -43.5 | 171.9 | -72.9 | -173.1 | 175.3 | -173.6 | 0 | 111.9 | N252 R253 K259 K260 | N252-K256 PolarHBondContact O-N 3.22Å; R253-K256 PolarHBondContact O-N 3.1Å; K256-K259 PolarHBondContact O-N 3.43Å; K256-K260 PolarHBondContact O-N 3.49Å |
| 257 | W | 95.2 | Very high | 90.2 | Very high | 110 Ų | 110 | 88.5 Ų | 88.5 | 42% | 0.417 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -58 | -51.8 | 177.6 | -179.1 | 88.5 | 0 | 0 | 0 | 111.7 | F221 R253 K259 K260 H261 | F221-W257 HydrophobicContact CE1-CB 4.41Å; F221-W257 HydrophobicContact CE1-CG 4.38Å; F221-W257 HydrophobicContact CZ-CB 4.13Å; F221-W257 HydrophobicContact CZ-CG 4.23Å; R253-W257 WeakPolarHBondContact O-CB 3.45Å; R253-W257 PolarHBondContact O-N 3.19Å; W257-K259 VanDerWaalsContact C-N 3.33Å; W257-K259 PolarHBondContact O-N 2.98Å; W257-K260 PolarHBondContact O-N 3.14Å; W257-H261 AromaticContact CD1-NE2 3.87Å; W257-H261 AromaticContact CD2-CD2 3.58Å; W257-H261 AromaticContact CD2-NE2 3.87Å; W257-H261 AromaticContact CE2-CD2 3.37Å; W257-H261 AromaticContact CE2-NE2 3.18Å; W257-H261 AromaticContact CZ2-CD2 3.63Å; W257-H261 AromaticContact CZ2-NE2 3.38Å; W257-H261 WeakPolarHBondContact CZ2-NE2 3.44Å; W257-H261 AromaticContact NE1-CD2 3.72Å; W257-H261 AromaticContact NE1-NE2 3.21Å; W257-H261 PolarHBondContact NE1-NE2 2.75Å; W257-H261 PolarHBondContact O-CD2 3.34Å; W257-H261 VanDerWaalsContact O-CD2 3.25Å; W257-H261 PolarHBondContact O-N 3.41Å; W257-H261 VanDerWaalsContact O-N 3.15Å |
| 258 | R | 95.1 | Very high | 88.3 | Confident | 138 Ų | 138 | 84.8 Ų | 84.8 | 52% | 0.521 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -59.7 | -39.6 | 175.9 | -72.7 | -172.7 | -62.1 | 123.7 | 0.6 | 113.1 | R254 H261 A262 | R254-R258 WeakPolarHBondContact O-CG 3.42Å; R254-R258 PolarHBondContact O-N 3.46Å; R258-H261 PolarHBondContact O-N 3.13Å; R258-A262 WeakPolarHBondContact O-CB 3.43Å; R258-A262 PolarHBondContact O-N 2.96Å |
| 259 | K | 93.5 | Very high | 86.3 | Confident | 155 Ų | 155 | 88.9 Ų | 88.9 | 67% | 0.674 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -63.1 | -39.4 | 176.6 | -77.5 | -172 | 175.6 | -166.6 | 0 | 112.4 | T255 K256 W257 A263 | T255-K259 WeakPolarHBondContact O-CG 3.41Å; T255-K259 PolarHBondContact O-N 2.91Å; T255-K259 VanDerWaalsContact O-N 3.13Å; K256-K259 PolarHBondContact O-N 3.43Å; W257-K259 VanDerWaalsContact C-N 3.33Å; W257-K259 PolarHBondContact O-N 2.98Å; K259-A263 WeakPolarHBondContact O-CB 3.33Å; K259-A263 PolarHBondContact O-N 3.37Å; K259-A263 VanDerWaalsContact O-N 3.1Å |
| 260 | K | 87.8 | Confident | 84.3 | Confident | 144 Ų | 144 | 94.5 Ų | 94.5 | 63% | 0.626 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -62.2 | -51.3 | 175.5 | -171.5 | -173.6 | 172.7 | -169.4 | 0 | 110.9 | K256 W257 A262 A263 E264 | K256-K260 PolarHBondContact O-N 3.49Å; W257-K260 PolarHBondContact O-N 3.14Å; K260-A262 PolarHBondContact O-N 3.38Å; K260-A263 PolarHBondContact O-N 2.82Å; K260-E264 PolarHBondContact O-N 3.02Å |
| 261 | H | 84.1 | Confident | 82.1 | Confident | 75 Ų | 75 | 101.9 Ų | 101.9 | 35% | 0.347 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.1 | -42.7 | 179 | -77.8 | -68.4 | 0 | 0 | 0 | 113.3 | W257 R258 A263 E264 M265 | W257-H261 AromaticContact CD1-NE2 3.87Å; W257-H261 AromaticContact CD2-CD2 3.58Å; W257-H261 AromaticContact CD2-NE2 3.87Å; W257-H261 AromaticContact CE2-CD2 3.37Å; W257-H261 AromaticContact CE2-NE2 3.18Å; W257-H261 AromaticContact CZ2-CD2 3.63Å; W257-H261 AromaticContact CZ2-NE2 3.38Å; W257-H261 WeakPolarHBondContact CZ2-NE2 3.44Å; W257-H261 AromaticContact NE1-CD2 3.72Å; W257-H261 AromaticContact NE1-NE2 3.21Å; W257-H261 PolarHBondContact NE1-NE2 2.75Å; W257-H261 PolarHBondContact O-CD2 3.34Å; W257-H261 VanDerWaalsContact O-CD2 3.25Å; W257-H261 PolarHBondContact O-N 3.41Å; W257-H261 VanDerWaalsContact O-N 3.15Å; R258-H261 PolarHBondContact O-N 3.13Å; H261-A263 PolarHBondContact O-N 3.42Å; H261-E264 PolarHBondContact O-N 3.44Å; H261-M265 WeakPolarHBondContact O-CG 3.44Å; H261-M265 PolarHBondContact O-N 3.26Å; H261-M265 VanDerWaalsContact O-N 3.13Å |
| 262 | A | 83.9 | Confident | 79.9 | Confident | 66 Ų | 66 | 104.3 Ų | 104.3 | 55% | 0.545 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.6 | -39.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | R258 K260 A266 | R258-A262 WeakPolarHBondContact O-CB 3.43Å; R258-A262 PolarHBondContact O-N 2.96Å; K260-A262 PolarHBondContact O-N 3.38Å; A262-A266 PolarHBondContact O-N 2.74Å; A262-A266 VanDerWaalsContact O-N 3.14Å |
| 263 | A | 81.7 | Confident | 77.7 | Confident | 60 Ų | 60 | 105 Ų | 105 | 50% | 0.496 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.1 | -36.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | K259 K260 H261 A266 S267 | K259-A263 WeakPolarHBondContact O-CB 3.33Å; K259-A263 PolarHBondContact O-N 3.37Å; K259-A263 VanDerWaalsContact O-N 3.1Å; K260-A263 PolarHBondContact O-N 2.82Å; H261-A263 PolarHBondContact O-N 3.42Å; A263-A266 PolarHBondContact O-N 3.4Å; A263-S267 WeakPolarHBondContact O-CB 3.41Å; A263-S267 PolarHBondContact O-N 3.39Å; A263-S267 PolarHBondContact O-OG 3.13Å |
| 264 | E | 77.4 | Confident | 75.5 | Confident | 94 Ų | 94 | 103.4 Ų | 103.4 | 44% | 0.439 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.4 | -49.1 | 177.1 | -163.1 | 167.8 | 144.2 | 0 | 0 | 111.1 | K260 H261 A266 S267 A268 | K260-E264 PolarHBondContact O-N 3.02Å; H261-E264 PolarHBondContact O-N 3.44Å; E264-A266 VanDerWaalsContact C-N 3.34Å; E264-A266 PolarHBondContact O-N 3.39Å; E264-S267 PolarHBondContact O-N 2.93Å; E264-S267 VanDerWaalsContact O-N 3.13Å; E264-S267 PolarHBondContact O-OG 3.26Å; E264-A268 PolarHBondContact O-N 3.13Å |
| 265 | M | 74.6 | Confident | 73.2 | Confident | 129 Ų | 129 | 107.3 Ų | 107.3 | 64% | 0.635 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -62.9 | -36.8 | 176.5 | -64.7 | -64.4 | 139.7 | 0 | 0 | 112.9 | H261 K269 | H261-M265 WeakPolarHBondContact O-CG 3.44Å; H261-M265 PolarHBondContact O-N 3.26Å; H261-M265 VanDerWaalsContact O-N 3.13Å; M265-K269 PolarHBondContact O-N 2.94Å |
| 266 | A | 75.1 | Confident | 71 | Confident | 68 Ų | 68 | 108.9 Ų | 108.9 | 56% | 0.562 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -67.8 | -37 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | A262 A263 E264 | A262-A266 PolarHBondContact O-N 2.74Å; A262-A266 VanDerWaalsContact O-N 3.14Å; A263-A266 PolarHBondContact O-N 3.4Å; E264-A266 VanDerWaalsContact C-N 3.34Å; E264-A266 PolarHBondContact O-N 3.39Å |
| 267 | S | 68.1 | Low | 68.8 | Low | 71 Ų | 71 | 108 Ų | 108 | 50% | 0.497 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -75.2 | -32.5 | 179.1 | 73.8 | 0 | 0 | 0 | 0 | 113.2 | A263 E264 K270 K271 | A263-S267 WeakPolarHBondContact O-CB 3.41Å; A263-S267 PolarHBondContact O-N 3.39Å; A263-S267 PolarHBondContact O-OG 3.13Å; E264-S267 PolarHBondContact O-N 2.93Å; E264-S267 VanDerWaalsContact O-N 3.13Å; E264-S267 PolarHBondContact O-OG 3.26Å; S267-K270 PolarHBondContact O-N 3Å; S267-K271 PolarHBondContact O-N 3.08Å |
| 268 | A | 58.9 | Low | 66.8 | Low | 56 Ų | 56 | 112.2 Ų | 112.2 | 46% | 0.463 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.1 | -43 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | E264 K270 K271 Q272 | E264-A268 PolarHBondContact O-N 3.13Å; A268-K270 VanDerWaalsContact C-N 3.28Å; A268-K270 PolarHBondContact O-N 2.72Å; A268-K271 PolarHBondContact O-N 3.37Å; A268-Q272 PolarHBondContact O-N 3.42Å |
| 269 | K | 56.1 | Low | 64.7 | Low | 162 Ų | 162 | 111.4 Ų | 111.4 | 70% | 0.704 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -60.8 | -36.1 | 176.4 | -168.6 | 174 | -178.9 | -179 | 0 | 112.6 | M265 K271 Q272 D273 | M265-K269 PolarHBondContact O-N 2.94Å; K269-K271 VanDerWaalsContact C-N 3.3Å; K269-K271 PolarHBondContact O-N 3.26Å; K269-Q272 PolarHBondContact O-N 3.05Å; K269-D273 WeakPolarHBondContact O-CB 3.42Å; K269-D273 PolarHBondContact O-N 3.31Å; K269-D273 VanDerWaalsContact O-N 3.08Å |
| 270 | K | 55.4 | Low | 62.6 | Low | 150 Ų | 150 | 111.7 Ų | 111.7 | 65% | 0.652 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -67.9 | -27.9 | 176.1 | -166.7 | 174 | -177.3 | -178.7 | 0 | 112.9 | S267 A268 S274 | S267-K270 PolarHBondContact O-N 3Å; A268-K270 VanDerWaalsContact C-N 3.28Å; A268-K270 PolarHBondContact O-N 2.72Å; K270-S274 WeakPolarHBondContact O-CB 3.47Å; K270-S274 PolarHBondContact O-N 3.32Å; K270-S274 PolarHBondContact O-OG 3.27Å |
| 271 | K | 53.2 | Low | 60.6 | Low | 163 Ų | 163 | 107.3 Ų | 107.3 | 71% | 0.709 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -71.2 | -42.3 | 173.6 | -76.7 | -161.7 | 171.7 | -166.9 | 0 | 112.2 | S267 A268 K269 D273 S274 E275 | S267-K271 PolarHBondContact O-N 3.08Å; A268-K271 PolarHBondContact O-N 3.37Å; K269-K271 VanDerWaalsContact C-N 3.3Å; K269-K271 PolarHBondContact O-N 3.26Å; K271-D273 VanDerWaalsContact C-N 3.35Å; K271-S274 CarbonylContact O-C 3.54Å; K271-S274 PolarHBondContact O-N 2.83Å; K271-E275 VanDerWaalsContact O-CB 3.28Å; K271-E275 WeakPolarHBondContact O-CB 3.32Å; K271-E275 PolarHBondContact O-N 2.94Å |
| 272 | Q | 51.8 | Low | 58.4 | Low | 135 Ų | 135 | 108.6 Ų | 108.6 | 63% | 0.631 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -63.7 | -42 | 175.5 | -165.9 | -177.5 | 13.8 | 0 | 0 | 111.4 | A268 K269 S274 E275 T276 | A268-Q272 PolarHBondContact O-N 3.42Å; K269-Q272 PolarHBondContact O-N 3.05Å; Q272-S274 VanDerWaalsContact C-N 3.33Å; Q272-S274 PolarHBondContact O-N 2.99Å; Q272-E275 PolarHBondContact O-N 2.98Å; Q272-E275 VanDerWaalsContact O-N 3.13Å; Q272-T276 PolarHBondContact O-N 3.13Å; Q272-T276 PolarHBondContact O-OG1 2.81Å |
| 273 | D | 50.6 | Low | 56.3 | Low | 108 Ų | 108 | 108.2 Ų | 108.2 | 58% | 0.578 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -60.8 | -41 | 175.3 | -156.6 | 46.1 | 0 | 0 | 0 | 111.7 | K269 K271 T276 E277 | K269-D273 WeakPolarHBondContact O-CB 3.42Å; K269-D273 PolarHBondContact O-N 3.31Å; K269-D273 VanDerWaalsContact O-N 3.08Å; K271-D273 VanDerWaalsContact C-N 3.35Å; D273-T276 WeakPolarHBondContact CA-OG1 3.32Å; D273-T276 PolarHBondContact O-OG1 3.27Å; D273-E277 WeakPolarHBondContact O-CB 3.39Å; D273-E277 PolarHBondContact O-N 3.45Å |
| 274 | S | 52.6 | Low | 54.4 | Low | 53 Ų | 53 | 111.9 Ų | 111.9 | 37% | 0.371 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -74.3 | -22.9 | 174.9 | -54.3 | 0 | 0 | 0 | 0 | 113.6 | K270 K271 Q272 R278 | K270-S274 WeakPolarHBondContact O-CB 3.47Å; K270-S274 PolarHBondContact O-N 3.32Å; K270-S274 PolarHBondContact O-OG 3.27Å; K271-S274 CarbonylContact O-C 3.54Å; K271-S274 PolarHBondContact O-N 2.83Å; Q272-S274 VanDerWaalsContact C-N 3.33Å; Q272-S274 PolarHBondContact O-N 2.99Å; S274-R278 WeakPolarHBondContact O-CB 3.23Å; S274-R278 VanDerWaalsContact O-CD 3.25Å; S274-R278 WeakPolarHBondContact O-CD 3.28Å; S274-R278 WeakPolarHBondContact O-CG 3.42Å; S274-R278 PolarHBondContact O-N 2.9Å |
| 275 | E | 48.7 | Very low | 52.6 | Low | 125 Ų | 125 | 115.1 Ų | 115.1 | 58% | 0.584 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -83.1 | -36.7 | 176.2 | -172 | 169.2 | -174.7 | 0 | 0 | 110.4 | K271 Q272 R278 L279 | K271-E275 VanDerWaalsContact O-CB 3.28Å; K271-E275 WeakPolarHBondContact O-CB 3.32Å; K271-E275 PolarHBondContact O-N 2.94Å; Q272-E275 PolarHBondContact O-N 2.98Å; Q272-E275 VanDerWaalsContact O-N 3.13Å; E275-R278 PolarHBondContact O-N 2.83Å; E275-L279 WeakPolarHBondContact O-CB 3.2Å; E275-L279 VanDerWaalsContact O-CG 3.32Å; E275-L279 WeakPolarHBondContact O-CG 3.25Å; E275-L279 PolarHBondContact O-N 3.33Å |
| 276 | T | 51.6 | Low | 51.3 | Low | 77 Ų | 77 | 114.6 Ų | 114.6 | 47% | 0.472 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -67.7 | -38.7 | 168.9 | 47.6 | 0 | 0 | 0 | 0 | 112.1 | Q272 D273 K280 | Q272-T276 PolarHBondContact O-N 3.13Å; Q272-T276 PolarHBondContact O-OG1 2.81Å; D273-T276 WeakPolarHBondContact CA-OG1 3.32Å; D273-T276 PolarHBondContact O-OG1 3.27Å; T276-K280 VanDerWaalsContact O-CB 3.23Å; T276-K280 WeakPolarHBondContact O-CB 3.02Å; T276-K280 PolarHBondContact O-N 2.97Å |
| 277 | E | 50.2 | Low | 50 | Low | 129 Ų | 129 | 121.3 Ų | 121.3 | 60% | 0.603 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -67.1 | -35.8 | 169.7 | -88.7 | -77.5 | -160.9 | 0 | 0 | 112.6 | D273 K280 G281 | D273-E277 WeakPolarHBondContact O-CB 3.39Å; D273-E277 PolarHBondContact O-N 3.45Å; E277-K280 CarbonylContact O-C 3.37Å; E277-K280 PolarHBondContact O-N 2.76Å; E277-G281 PolarHBondContact O-N 3.22Å |
| 278 | R | 52.5 | Low | 49.3 | Very low | 199 Ų | 199 | 126.3 Ų | 126.3 | 75% | 0.751 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -75.8 | -25.9 | 176.7 | -73.7 | 169.1 | 81.3 | 115.3 | 11 | 113.6 | S274 E275 T282 | S274-R278 WeakPolarHBondContact O-CB 3.23Å; S274-R278 VanDerWaalsContact O-CD 3.25Å; S274-R278 WeakPolarHBondContact O-CD 3.28Å; S274-R278 WeakPolarHBondContact O-CG 3.42Å; S274-R278 PolarHBondContact O-N 2.9Å; E275-R278 PolarHBondContact O-N 2.83Å; R278-T282 WeakPolarHBondContact O-CB 3.42Å; R278-T282 WeakPolarHBondContact O-CG2 3.11Å; R278-T282 PolarHBondContact O-N 2.58Å; R278-T282 VanDerWaalsContact O-N 3.12Å |
| 279 | L | 50.4 | Low | 48.9 | Very low | 121 Ų | 121 | 128.9 Ų | 128.9 | 63% | 0.634 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -77.8 | -24.6 | 167.1 | -70 | 172.5 | 0 | 0 | 0 | 111.8 | E275 T282 | E275-L279 WeakPolarHBondContact O-CB 3.2Å; E275-L279 VanDerWaalsContact O-CG 3.32Å; E275-L279 WeakPolarHBondContact O-CG 3.25Å; E275-L279 PolarHBondContact O-N 3.33Å; L279-T282 HydrophobicContact CD2-CG2 4.36Å |
| 280 | K | 49.2 | Very low | 48.7 | Very low | 161 Ų | 161 | 128.2 Ų | 128.2 | 70% | 0.7 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -79.7 | -32.1 | 172.6 | -170.9 | 61.3 | -179.1 | 162.1 | 0 | 113.3 | T276 E277 | T276-K280 VanDerWaalsContact O-CB 3.23Å; T276-K280 WeakPolarHBondContact O-CB 3.02Å; T276-K280 PolarHBondContact O-N 2.97Å; E277-K280 CarbonylContact O-C 3.37Å; E277-K280 PolarHBondContact O-N 2.76Å |
| 281 | G | 46.1 | Very low | 48.5 | Very low | 51 Ų | 51 | 127 Ų | 127 | 53% | 0.526 | 65% | 0.647 | S | S | . | * | S | Bend | trans | -105 | 18.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | E277 | E277-G281 PolarHBondContact O-N 3.22Š|
| 282 | T | 38.5 | Very low | 48.5 | Very low | 103 Ų | 103 | 129.1 Ų | 129.1 | 63% | 0.632 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -114.6 | 9.6 | 163.5 | -162.9 | 0 | 0 | 0 | 0 | 112.1 | R278 L279 | R278-T282 WeakPolarHBondContact O-CB 3.42Å; R278-T282 WeakPolarHBondContact O-CG2 3.11Å; R278-T282 PolarHBondContact O-N 2.58Å; R278-T282 VanDerWaalsContact O-N 3.12Å; L279-T282 HydrophobicContact CD2-CG2 4.36Å |
| 283 | S | 40 | Very low | 48.9 | Very low | 57 Ų | 57 | 129.9 Ų | 129.9 | 40% | 0.399 | 66% | 0.66 | S | S | . | * | trans | -110.2 | 67 | 161.3 | 160.8 | 0 | 0 | 0 | 0 | 105.5 | E286 | S283-E286 WeakPolarHBondContact CB-OE1 3.16Å; S283-E286 VanDerWaalsContact OG-CD 3.31Å; S283-E286 PolarHBondContact OG-OE1 3.12Å | ||
| 284 | D | 40.9 | Very low | 49.7 | Very low | 137 Ų | 137 | 130.4 Ų | 130.4 | 73% | 0.733 | 66% | 0.657 | S | S | * | * | trans | -142.7 | 42.1 | 173.3 | -134.5 | -24.8 | 0 | 0 | 0 | 107.1 | ||||
| 285 | N | 40.9 | Very low | 50.2 | Low | 163 Ų | 163 | 133.3 Ų | 133.3 | 87% | 0.872 | 68% | 0.675 | S | S | * | * | trans | -140.8 | 50.1 | 166.5 | -95.1 | -104.6 | 0 | 0 | 0 | 106.1 | ||||
| 286 | E | 45.8 | Very low | 50.8 | Low | 118 Ų | 118 | 135.2 Ų | 135.2 | 55% | 0.551 | 69% | 0.689 | S | S | * | * | trans | -120.6 | 52 | 173.9 | -76.7 | 170.1 | -141.2 | 0 | 0 | 108.6 | S283 E288 | S283-E286 WeakPolarHBondContact CB-OE1 3.16Å; S283-E286 VanDerWaalsContact OG-CD 3.31Å; S283-E286 PolarHBondContact OG-OE1 3.12Å; E286-E288 PolarHBondContact O-N 3.3Å; E286-E288 VanDerWaalsContact O-N 3.14Å | ||
| 287 | E | 48.1 | Very low | 51.2 | Low | 209 Ų | 209 | 136 Ų | 136 | 98% | 0.977 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | 26.9 | 162.1 | -68.6 | -169 | 160.8 | 0 | 0 | 111.5 | ||
| 288 | E | 53.1 | Low | 52 | Low | 175 Ų | 175 | 135.3 Ų | 135.3 | 82% | 0.818 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.1 | 19.9 | -173.1 | -149.5 | -177.7 | 177.2 | 0 | 0 | 114.1 | E286 | E286-E288 PolarHBondContact O-N 3.3Å; E286-E288 VanDerWaalsContact O-N 3.14Å |
| 289 | D | 51.3 | Low | 52.3 | Low | 110 Ų | 110 | 130.8 Ų | 130.8 | 59% | 0.588 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -124.7 | -8.4 | 175.8 | -129.7 | 0.9 | 0 | 0 | 0 | 114.6 | D291 | D289-D291 VanDerWaalsContact C-N 3.3Å; D289-D291 PolarHBondContact O-N 3.28Å |
| 290 | D | 51.2 | Low | 53.1 | Low | 149 Ų | 149 | 128 Ų | 128 | 80% | 0.797 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -75 | -15.3 | 171.7 | -86.2 | -34 | 0 | 0 | 0 | 113.4 | Y292 N293 | D290-Y292 VanDerWaalsContact C-N 3.32Å; D290-Y292 PolarHBondContact O-N 3.5Å; D290-N293 PolarHBondContact O-N 3.42Å |
| 291 | D | 52.5 | Low | 54 | Low | 123 Ų | 123 | 125.3 Ų | 125.3 | 66% | 0.658 | 67% | 0.671 | S | S | * | * | G | 310 helix | trans | -66.9 | -32.4 | -179.3 | -163.7 | -121.6 | 0 | 0 | 0 | 112.2 | D289 N293 K294 | D289-D291 VanDerWaalsContact C-N 3.3Å; D289-D291 PolarHBondContact O-N 3.28Å; D291-N293 VanDerWaalsContact C-N 3.29Å; D291-N293 PolarHBondContact O-N 3.48Å; D291-K294 WeakPolarHBondContact O-CB 3.49Å; D291-K294 PolarHBondContact O-N 3.14Å |
| 292 | Y | 53.3 | Low | 55.3 | Low | 208 Ų | 208 | 127 Ų | 127 | 82% | 0.816 | 67% | 0.668 | S | S | * | * | G | 310 helix | trans | -72.5 | -13.2 | -177.3 | -95.8 | -82.9 | 0 | 0 | 0 | 115.3 | D290 | D290-Y292 VanDerWaalsContact C-N 3.32Å; D290-Y292 PolarHBondContact O-N 3.5Å |
| 293 | N | 59.9 | Low | 56.7 | Low | 151 Ų | 151 | 128 Ų | 128 | 81% | 0.807 | 67% | 0.665 | S | S | * | * | G | 310 helix | trans | -107.3 | 1.5 | 175.9 | -106.2 | -46.9 | 0 | 0 | 0 | 113.6 | D290 D291 P295 | D290-N293 PolarHBondContact O-N 3.42Å; D291-N293 VanDerWaalsContact C-N 3.29Å; D291-N293 PolarHBondContact O-N 3.48Å; N293-P295 WeakPolarHBondContact O-CD 3.5Å |
| 294 | K | 67.8 | Low | 58.2 | Low | 119 Ų | 119 | 131.3 Ų | 131.3 | 52% | 0.517 | 67% | 0.673 | S | S | . | * | S | Bend | trans | -68.8 | 127.6 | 171.2 | -171.9 | 170.5 | 177.4 | -69.7 | 0 | 108.6 | D291 L296 | D291-K294 WeakPolarHBondContact O-CB 3.49Å; D291-K294 PolarHBondContact O-N 3.14Å; K294-L296 PolarHBondContact O-N 3.01Å; K294-L296 VanDerWaalsContact O-N 3.08Å |
| 295 | P | 62.3 | Low | 59.7 | Low | 114 Ų | 114 | 128.3 Ų | 128.3 | 74% | 0.74 | 66% | 0.656 | S | S | * | * | trans | -51.1 | 122.4 | 172.1 | -28.1 | 35.7 | 0 | 0 | 0 | 109.8 | N293 D297 | N293-P295 WeakPolarHBondContact O-CD 3.5Å; P295-D297 PolarHBondContact O-N 3.08Å | ||
| 296 | L | 60.4 | Low | 61.2 | Low | 166 Ų | 166 | 124.8 Ų | 124.8 | 87% | 0.869 | 64% | 0.641 | S | S | * | * | trans | -54.5 | 113 | -177.2 | -67.5 | 173 | 0 | 0 | 0 | 108.7 | K294 P298 | K294-L296 PolarHBondContact O-N 3.01Å; K294-L296 VanDerWaalsContact O-N 3.08Å; L296-P298 VanDerWaalsContact O-CD 3.23Å; L296-P298 WeakPolarHBondContact O-CD 3.43Å | ||
| 297 | D | 61.6 | Low | 62.5 | Low | 92 Ų | 92 | 125.3 Ų | 125.3 | 49% | 0.492 | 64% | 0.643 | S | S | . | * | trans | -71.3 | 112.6 | 179.4 | -164.5 | -32.6 | 0 | 0 | 0 | 107.6 | P295 N299 S300 | P295-D297 PolarHBondContact O-N 3.08Å; D297-N299 PolarHBondContact O-N 3.01Å; D297-S300 WeakPolarHBondContact O-CB 3.23Å; D297-S300 PolarHBondContact O-N 2.94Å | ||
| 298 | P | 65.3 | Low | 63.9 | Low | 115 Ų | 115 | 119.6 Ų | 119.6 | 75% | 0.747 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.9 | -19.6 | -168.6 | -25 | 35.2 | 0 | 0 | 0 | 113.9 | L296 | L296-P298 VanDerWaalsContact O-CD 3.23Å; L296-P298 WeakPolarHBondContact O-CD 3.43Å |
| 299 | N | 58.9 | Low | 64.8 | Low | 104 Ų | 104 | 116.9 Ų | 116.9 | 56% | 0.556 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90 | -6.7 | -176.3 | -147.1 | 11.3 | 0 | 0 | 0 | 113.1 | D297 | D297-N299 PolarHBondContact O-N 3.01Š|
| 300 | S | 67.1 | Low | 65.9 | Low | 63 Ų | 63 | 119 Ų | 119 | 44% | 0.441 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -72.8 | -32.2 | -175.3 | -170.4 | 0 | 0 | 0 | 0 | 113.4 | D297 | D297-S300 WeakPolarHBondContact O-CB 3.23Å; D297-S300 PolarHBondContact O-N 2.94Å |
| 301 | D | 68.6 | Low | 67.1 | Low | 105 Ų | 105 | 118.2 Ų | 118.2 | 56% | 0.561 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -73.9 | -35.1 | 176.2 | -114.4 | -80.2 | 0 | 0 | 0 | 111.8 | E303 K304 I305 | D301-E303 VanDerWaalsContact C-N 3.27Å; D301-E303 PolarHBondContact O-N 2.82Å; D301-K304 PolarHBondContact O-N 3.03Å; D301-I305 HydrophobicContact CB-CD1 4.34Å; D301-I305 WeakPolarHBondContact O-CB 3.41Å; D301-I305 VanDerWaalsContact O-CG1 3.25Å; D301-I305 WeakPolarHBondContact O-CG1 3.23Å; D301-I305 PolarHBondContact O-N 2.87Å |
| 302 | D | 73 | Confident | 67.8 | Low | 85 Ų | 85 | 118.2 Ų | 118.2 | 46% | 0.455 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -60.6 | -33.8 | 178.8 | -74.7 | -45.2 | 0 | 0 | 0 | 112.8 | T306 | D302-T306 WeakPolarHBondContact O-CB 3.25Å; D302-T306 WeakPolarHBondContact O-CG2 3.45Å; D302-T306 PolarHBondContact O-N 3.27Å; D302-T306 PolarHBondContact O-OG1 2.86Å |
| 303 | E | 69.4 | Low | 68.3 | Low | 124 Ų | 124 | 116 Ų | 116 | 58% | 0.579 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -69.8 | -36 | 173.6 | -65.7 | -162 | 153.2 | 0 | 0 | 112.9 | D301 T306 Q307 | D301-E303 VanDerWaalsContact C-N 3.27Å; D301-E303 PolarHBondContact O-N 2.82Å; E303-T306 WeakPolarHBondContact CA-OG1 3.42Å; E303-T306 PolarHBondContact O-OG1 3.38Å; E303-Q307 WeakPolarHBondContact O-CB 3.38Å; E303-Q307 WeakPolarHBondContact O-CG 3.22Å; E303-Q307 PolarHBondContact O-N 3.05Å; E303-Q307 PolarHBondContact O-NE2 3.16Å |
| 304 | K | 69.9 | Low | 68.2 | Low | 127 Ų | 127 | 113.7 Ų | 113.7 | 55% | 0.552 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -72.4 | -40.5 | 174.6 | -73.1 | 176 | -179.2 | 166.6 | 0 | 111.1 | D301 Q307 L308 | D301-K304 PolarHBondContact O-N 3.03Å; K304-Q307 PolarHBondContact O-N 3.21Å; K304-L308 WeakPolarHBondContact O-CB 3.34Å; K304-L308 WeakPolarHBondContact O-CG 3.4Å; K304-L308 PolarHBondContact O-N 2.76Å |
| 305 | I | 72.3 | Confident | 67.6 | Low | 74 Ų | 74 | 110.3 Ų | 110.3 | 38% | 0.379 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -61.9 | -49.7 | 175.5 | -68.9 | 165 | 0 | 0 | 0 | 109.9 | D301 Q307 L308 L309 | D301-I305 HydrophobicContact CB-CD1 4.34Å; D301-I305 WeakPolarHBondContact O-CB 3.41Å; D301-I305 VanDerWaalsContact O-CG1 3.25Å; D301-I305 WeakPolarHBondContact O-CG1 3.23Å; D301-I305 PolarHBondContact O-N 2.87Å; I305-Q307 PolarHBondContact O-N 2.84Å; I305-L308 PolarHBondContact O-N 3.43Å; I305-L309 HydrophobicContact CG2-CD1 3.86Å; I305-L309 WeakPolarHBondContact O-CB 3.41Å; I305-L309 VanDerWaalsContact O-CD1 3.23Å; I305-L309 WeakPolarHBondContact O-CD1 3.16Å; I305-L309 PolarHBondContact O-N 3.38Å |
| 306 | T | 73.7 | Confident | 67 | Low | 90 Ų | 90 | 109.6 Ų | 109.6 | 55% | 0.552 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -63.8 | -37.2 | 176.9 | 47.6 | 0 | 0 | 0 | 0 | 112.8 | D302 E303 K310 | D302-T306 WeakPolarHBondContact O-CB 3.25Å; D302-T306 WeakPolarHBondContact O-CG2 3.45Å; D302-T306 PolarHBondContact O-N 3.27Å; D302-T306 PolarHBondContact O-OG1 2.86Å; E303-T306 WeakPolarHBondContact CA-OG1 3.42Å; E303-T306 PolarHBondContact O-OG1 3.38Å; T306-K310 WeakPolarHBondContact O-CB 3.48Å; T306-K310 PolarHBondContact O-N 3.23Å |
| 307 | Q | 73.3 | Confident | 66.6 | Low | 129 Ų | 129 | 105.8 Ų | 105.8 | 60% | 0.603 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -66.1 | -39.9 | 172.8 | -76.6 | 178.4 | 72.6 | 0 | 0 | 113 | E303 K304 I305 K310 K311 | E303-Q307 WeakPolarHBondContact O-CB 3.38Å; E303-Q307 WeakPolarHBondContact O-CG 3.22Å; E303-Q307 PolarHBondContact O-N 3.05Å; E303-Q307 PolarHBondContact O-NE2 3.16Å; K304-Q307 PolarHBondContact O-N 3.21Å; I305-Q307 PolarHBondContact O-N 2.84Å; Q307-K310 PolarHBondContact O-N 2.88Å; Q307-K311 WeakPolarHBondContact O-CB 3.18Å; Q307-K311 PolarHBondContact O-N 2.85Å |
| 308 | L | 75.9 | Confident | 66.2 | Low | 89 Ų | 89 | 108.8 Ų | 108.8 | 47% | 0.466 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.5 | -47.4 | 174.4 | -81.7 | 163.7 | 0 | 0 | 0 | 111.7 | K304 I305 K310 K311 H312 | K304-L308 WeakPolarHBondContact O-CB 3.34Å; K304-L308 WeakPolarHBondContact O-CG 3.4Å; K304-L308 PolarHBondContact O-N 2.76Å; I305-L308 PolarHBondContact O-N 3.43Å; L308-K310 VanDerWaalsContact C-N 3.27Å; L308-K310 PolarHBondContact O-N 3.39Å; L308-K311 PolarHBondContact O-N 2.82Å; L308-H312 PolarHBondContact O-CD2 3.22Å; L308-H312 PolarHBondContact O-N 3.37Å |
| 309 | L | 73.4 | Confident | 65.6 | Low | 117 Ų | 117 | 110.3 Ų | 110.3 | 61% | 0.613 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -59.5 | -39.5 | 174.2 | -92.9 | 72.2 | 0 | 0 | 0 | 111.2 | I305 H312 K313 | I305-L309 HydrophobicContact CG2-CD1 3.86Å; I305-L309 WeakPolarHBondContact O-CB 3.41Å; I305-L309 VanDerWaalsContact O-CD1 3.23Å; I305-L309 WeakPolarHBondContact O-CD1 3.16Å; I305-L309 PolarHBondContact O-N 3.38Å; L309-H312 PolarHBondContact O-N 3.14Å; L309-K313 WeakPolarHBondContact O-CB 3.34Å; L309-K313 PolarHBondContact O-N 2.87Å |
| 310 | K | 73.3 | Confident | 65.2 | Low | 155 Ų | 155 | 113.4 Ų | 113.4 | 67% | 0.674 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -68.5 | -41.7 | 177.2 | -167.7 | 162.4 | -177.1 | 173.5 | 0 | 112.1 | T306 Q307 L308 K313 T314 | T306-K310 WeakPolarHBondContact O-CB 3.48Å; T306-K310 PolarHBondContact O-N 3.23Å; Q307-K310 PolarHBondContact O-N 2.88Å; L308-K310 VanDerWaalsContact C-N 3.27Å; L308-K310 PolarHBondContact O-N 3.39Å; K310-K313 PolarHBondContact O-N 3.44Å; K310-T314 PolarHBondContact O-N 3.22Å; K310-T314 PolarHBondContact O-OG1 3.5Å |
| 311 | K | 76.3 | Confident | 64 | Low | 132 Ų | 132 | 119.7 Ų | 119.7 | 57% | 0.574 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -63.4 | -38.6 | 175 | -171.4 | 175.8 | 76 | 177.2 | 0 | 112.3 | Q307 L308 T314 G315 | Q307-K311 WeakPolarHBondContact O-CB 3.18Å; Q307-K311 PolarHBondContact O-N 2.85Å; L308-K311 PolarHBondContact O-N 2.82Å; K311-T314 PolarHBondContact O-OG1 2.91Å; K311-T314 VanDerWaalsContact O-OG1 3.05Å; K311-G315 PolarHBondContact O-N 3.26Å; K311-G315 VanDerWaalsContact O-N 3.14Å |
| 312 | H | 67.3 | Low | 62.7 | Low | 123 Ų | 123 | 121.1 Ų | 121.1 | 57% | 0.569 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -81.2 | -28.4 | 178.2 | -74 | -120.2 | 0 | 0 | 0 | 112.1 | L308 L309 G315 S316 | L308-H312 PolarHBondContact O-CD2 3.22Å; L308-H312 PolarHBondContact O-N 3.37Å; L309-H312 PolarHBondContact O-N 3.14Å; H312-G315 PolarHBondContact O-N 3.05Å; H312-S316 WeakPolarHBondContact O-CB 3.13Å; H312-S316 PolarHBondContact O-N 3.06Å |
| 313 | K | 63.4 | Low | 61.5 | Low | 163 Ų | 163 | 122.7 Ų | 122.7 | 71% | 0.709 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -65.9 | -36.9 | 171.1 | -176.9 | 67.6 | 69.9 | 176.7 | 0 | 112.2 | L309 K310 | L309-K313 WeakPolarHBondContact O-CB 3.34Å; L309-K313 PolarHBondContact O-N 2.87Å; K310-K313 PolarHBondContact O-N 3.44Å |
| 314 | T | 58.4 | Low | 60.3 | Low | 102 Ų | 102 | 126.1 Ų | 126.1 | 63% | 0.626 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -76.4 | -33.8 | 173.9 | 53.2 | 0 | 0 | 0 | 0 | 112.9 | K310 K311 | K310-T314 PolarHBondContact O-N 3.22Å; K310-T314 PolarHBondContact O-OG1 3.5Å; K311-T314 PolarHBondContact O-OG1 2.91Å; K311-T314 VanDerWaalsContact O-OG1 3.05Å |
| 315 | G | 56.3 | Low | 59.2 | Low | 48 Ų | 48 | 126.5 Ų | 126.5 | 50% | 0.495 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -72.8 | -34.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | K311 H312 A317 | K311-G315 PolarHBondContact O-N 3.26Å; K311-G315 VanDerWaalsContact O-N 3.14Å; H312-G315 PolarHBondContact O-N 3.05Å; G315-A317 VanDerWaalsContact C-N 3.26Å; G315-A317 PolarHBondContact O-N 3.29Å |
| 316 | S | 48.5 | Very low | 57.9 | Low | 99 Ų | 99 | 128.8 Ų | 128.8 | 69% | 0.692 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | 2.5 | -174.7 | -169.7 | 0 | 0 | 0 | 0 | 114.8 | H312 | H312-S316 WeakPolarHBondContact O-CB 3.13Å; H312-S316 PolarHBondContact O-N 3.06Å |
| 317 | A | 52.3 | Low | 56.7 | Low | 86 Ų | 86 | 128.9 Ų | 128.9 | 71% | 0.711 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.1 | -5.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114 | G315 | G315-A317 VanDerWaalsContact C-N 3.26Å; G315-A317 PolarHBondContact O-N 3.29Å |
| 318 | L | 52.8 | Low | 55.6 | Low | 155 Ų | 155 | 132.3 Ų | 132.3 | 81% | 0.812 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -106.6 | -3.7 | -171 | -153.4 | 78.4 | 0 | 0 | 0 | 114.9 | ||
| 319 | L | 53 | Low | 54.6 | Low | 147 Ų | 147 | 134.5 Ų | 134.5 | 77% | 0.77 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -133.1 | 45.5 | -170 | -81 | 174.8 | 0 | 0 | 0 | 114.3 | ||
| 320 | M | 50.3 | Low | 53.6 | Low | 168 Ų | 168 | 135.4 Ų | 135.4 | 83% | 0.828 | 76% | 0.755 | S | S | * | * | trans | -136.8 | 95 | 159.2 | -76 | -65.5 | 147.4 | 0 | 0 | 109.2 | ||||
| 321 | H | 41.4 | Very low | 52.5 | Low | 196 Ų | 196 | 134.3 Ų | 134.3 | 91% | 0.907 | 76% | 0.76 | S | S | * | * | trans | -174.4 | 106.9 | 130.9 | -94.1 | -62.6 | 0 | 0 | 0 | 108.1 | ||||
| 322 | T | 42.2 | Very low | 51.1 | Low | 135 Ų | 135 | 134.4 Ų | 134.4 | 83% | 0.828 | 77% | 0.771 | S | S | * | * | trans | -78.9 | 157.1 | 180 | 43.2 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 323 | S | 48.3 | Very low | 50.1 | Low | 117 Ų | 117 | 135.1 Ų | 135.1 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -38.2 | 138 | 168.9 | -37.3 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 324 | E | 43.6 | Very low | 49.2 | Very low | 196 Ų | 196 | 133.3 Ų | 133.3 | 92% | 0.916 | 79% | 0.788 | S | S | * | * | trans | -177.6 | 144.7 | 149.2 | -101.6 | 166.5 | 165.2 | 0 | 0 | 105.5 | ||||
| 325 | N | 47.9 | Very low | 48.6 | Very low | 135 Ų | 135 | 135.5 Ų | 135.5 | 72% | 0.722 | 80% | 0.8 | S | S | * | * | cis | -179.9 | 172 | -16.5 | 174.7 | 47.2 | 0 | 0 | 0 | 104.6 | ||||
| 326 | D | 43.1 | Very low | 48 | Very low | 122 Ų | 122 | 142.2 Ų | 142.2 | 65% | 0.652 | 82% | 0.823 | S | S | * | * | trans | 79 | 103 | 155.7 | -113.9 | -105.7 | 0 | 0 | 0 | 122.2 | ||||
| 327 | S | 48.9 | Very low | 48 | Very low | 93 Ų | 93 | 145.8 Ų | 145.8 | 65% | 0.65 | 83% | 0.834 | S | S | * | * | 81.4 | 138.4 | 115.7 | -64.7 | 0 | 0 | 0 | 0 | 125.1 | |||||
| 328 | S | 51.6 | Low | 47.6 | Very low | 200 Ų | 200 | 151.3 Ų | 151.3 | 100% | 1.399 | 85% | 0.846 | S | S | * | * | trans | 79.3 | 0 | 160.5 | -55.9 | 0 | 0 | 0 | 0 | 118.5 |
Retrieved 328 of 328 residues in 71.3 ms
(Link to these results)