| 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 | 45.9 | Very low | 44.5 | Very low | 237 Ų | 237 | 161.5 Ų | 161.5 | 100% | 1.167 | 81% | 0.807 | S | S | * | * | 0 | 156.3 | 0 | -78.1 | 66.7 | 172.6 | 0 | 0 | 109.5 | |||||
| 2 | N | 36.2 | Very low | 43.8 | Very low | 171 Ų | 171 | 158.8 Ų | 158.8 | 91% | 0.914 | 80% | 0.798 | S | S | * | * | trans | -75.8 | 165.3 | -167.8 | -65 | -13.7 | 0 | 0 | 0 | 114 | ||||
| 3 | R | 43.4 | Very low | 43.4 | Very low | 204 Ų | 204 | 160.7 Ų | 160.7 | 77% | 0.77 | 80% | 0.798 | S | S | * | * | trans | -109.7 | 159.5 | 178.2 | -169.2 | -162.3 | -85.5 | 177.5 | -7.2 | 109.4 | ||||
| 4 | F | 37.9 | Very low | 43 | Very low | 165 Ų | 165 | 158.8 Ų | 158.8 | 72% | 0.724 | 80% | 0.799 | S | S | * | * | trans | 81.4 | 161.2 | 163.6 | -59.9 | -58.9 | 0 | 0 | 0 | 117.7 | ||||
| 5 | P | 60.8 | Low | 42.4 | Very low | 112 Ų | 112 | 156.9 Ų | 156.9 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | cis | -140.8 | 171 | -44.3 | 38.9 | -24.5 | 0 | 0 | 0 | 113.1 | ||||
| 6 | M | 45.8 | Very low | 42.1 | Very low | 177 Ų | 177 | 154.6 Ų | 154.6 | 87% | 0.872 | 78% | 0.783 | S | S | * | * | -160.4 | 141.9 | 116.9 | -124 | -177.6 | 176.3 | 0 | 0 | 112.9 | |||||
| 7 | D | 43.1 | Very low | 41.6 | Very low | 122 Ų | 122 | 155.9 Ų | 155.9 | 65% | 0.652 | 79% | 0.786 | S | S | * | * | trans | -94.2 | 151.5 | 170.1 | 178.6 | 24.7 | 0 | 0 | 0 | 108.6 | ||||
| 8 | M | 51.1 | Low | 41.5 | Very low | 170 Ų | 170 | 155.3 Ų | 155.3 | 84% | 0.837 | 78% | 0.782 | S | S | * | * | trans | -147.8 | 108.1 | 160.6 | -93.2 | -59.4 | 169.6 | 0 | 0 | 108.7 | ||||
| 9 | S | 39.5 | Very low | 41.3 | Very low | 80 Ų | 80 | 153.8 Ų | 153.8 | 56% | 0.559 | 78% | 0.781 | S | S | * | * | trans | -67.1 | 152.2 | -176.9 | -37.2 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 10 | E | 42.3 | Very low | 41.3 | Very low | 166 Ų | 166 | 152.8 Ų | 152.8 | 78% | 0.776 | 78% | 0.778 | S | S | * | * | 46 | 114.2 | 119.8 | -162.4 | 167.1 | -127 | 0 | 0 | 118.5 | |||||
| 11 | I | 43.7 | Very low | 41 | Very low | 172 Ų | 172 | 154.6 Ų | 154.6 | 88% | 0.882 | 78% | 0.781 | S | S | * | * | trans | -153.8 | 147.6 | 140.7 | -112.7 | 156.7 | 0 | 0 | 0 | 111.3 | ||||
| 12 | D | 35.6 | Very low | 40.5 | Very low | 130 Ų | 130 | 147.9 Ų | 147.9 | 70% | 0.695 | 76% | 0.757 | S | S | * | * | trans | -86.9 | 162.6 | -154.3 | -76.3 | -72.8 | 0 | 0 | 0 | 118.1 | V14 | D12-V14 PolarHBondContact O-N 3.2Š| ||
| 13 | F | 38.8 | Very low | 40.8 | Very low | 183 Ų | 183 | 149.8 Ų | 149.8 | 80% | 0.803 | 76% | 0.757 | S | S | * | * | trans | -49.3 | 113.8 | 150.9 | 169.4 | -88.1 | 0 | 0 | 0 | 113 | ||||
| 14 | V | 37.5 | Very low | 40.6 | Very low | 134 Ų | 134 | 148.3 Ų | 148.3 | 81% | 0.812 | 76% | 0.763 | S | S | * | * | trans | -160.4 | 138.9 | 159.1 | -177.4 | 0 | 0 | 0 | 0 | 107.6 | D12 | D12-V14 PolarHBondContact O-N 3.2Š| ||
| 15 | D | 34.9 | Very low | 41 | Very low | 131 Ų | 131 | 144.7 Ų | 144.7 | 70% | 0.701 | 76% | 0.764 | S | S | * | * | cis | -161.4 | -164.7 | -32.2 | -160.3 | 177.2 | 0 | 0 | 0 | 108.2 | ||||
| 16 | D | 37.2 | Very low | 40 | Very low | 120 Ų | 120 | 145.5 Ų | 145.5 | 64% | 0.642 | 77% | 0.769 | S | S | * | * | trans | -35.3 | 140.6 | 175.8 | -146.5 | -44.6 | 0 | 0 | 0 | 118.5 | M18 | D16-M18 PolarHBondContact OD1-N 3.48Š| ||
| 17 | Q | 33.3 | Very low | 39.6 | Very low | 177 Ų | 177 | 145 Ų | 145 | 83% | 0.827 | 77% | 0.769 | S | S | * | * | trans | -133.9 | 97 | 147.6 | -132 | -163.3 | 105.6 | 0 | 0 | 111.8 | V19 | Q17-V19 PolarHBondContact O-N 3.25Š| ||
| 18 | M | 39.2 | Very low | 39.6 | Very low | 145 Ų | 145 | 148 Ų | 148 | 71% | 0.714 | 78% | 0.779 | S | S | * | * | trans | -51.8 | 117.2 | 164.5 | -68.6 | -179.4 | 61 | 0 | 0 | 111.6 | D16 | D16-M18 PolarHBondContact OD1-N 3.48Š| ||
| 19 | V | 38 | Very low | 39.2 | Very low | 127 Ų | 127 | 151.4 Ų | 151.4 | 77% | 0.77 | 78% | 0.783 | S | S | * | * | trans | -119.1 | 94.9 | 157.6 | -171.2 | 0 | 0 | 0 | 0 | 108.2 | Q17 | Q17-V19 PolarHBondContact O-N 3.25Š| ||
| 20 | N | 41.4 | Very low | 39.2 | Very low | 132 Ų | 132 | 153.5 Ų | 153.5 | 71% | 0.706 | 79% | 0.794 | S | S | * | * | trans | -122.2 | 93 | -176.2 | -163.1 | 3 | 0 | 0 | 0 | 109.6 | ||||
| 21 | F | 35.3 | Very low | 39.1 | Very low | 192 Ų | 192 | 153.2 Ų | 153.2 | 84% | 0.842 | 80% | 0.797 | S | S | * | * | trans | -139.9 | 125.6 | 172.5 | -93.4 | -78.7 | 0 | 0 | 0 | 112.6 | ||||
| 22 | S | 36.1 | Very low | 38.7 | Very low | 95 Ų | 95 | 152.8 Ų | 152.8 | 66% | 0.664 | 79% | 0.794 | S | S | * | * | trans | 69.5 | 70.7 | 144.8 | -55 | 0 | 0 | 0 | 0 | 119.9 | L24 | S22-L24 PolarHBondContact O-N 3.06Š| ||
| 23 | K | 41.4 | Very low | 38.8 | Very low | 212 Ų | 212 | 157.9 Ų | 157.9 | 92% | 0.922 | 80% | 0.803 | S | S | * | * | -1.7 | 107.1 | 125.1 | -173.6 | -176.9 | -172 | 179.8 | 0 | 115.8 | |||||
| 24 | L | 39.9 | Very low | 38.7 | Very low | 173 Ų | 173 | 153.6 Ų | 153.6 | 91% | 0.906 | 80% | 0.796 | S | S | * | * | trans | -132.7 | 146 | 159.4 | -85.1 | 172.4 | 0 | 0 | 0 | 110.5 | S22 | S22-L24 PolarHBondContact O-N 3.06Š| ||
| 25 | A | 46.1 | Very low | 38.7 | Very low | 89 Ų | 89 | 155.7 Ų | 155.7 | 74% | 0.736 | 80% | 0.796 | S | S | * | * | trans | -89.7 | 154.4 | -166.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | L27 | A25-L27 PolarHBondContact O-N 3.19Å; A25-L27 VanDerWaalsContact O-N 3.17Å | ||
| 26 | P | 40.1 | Very low | 38.6 | Very low | 128 Ų | 128 | 157 Ų | 157 | 83% | 0.831 | 80% | 0.804 | S | S | * | * | trans | -71.2 | 106.4 | 167.4 | -12.4 | 28.4 | 0 | 0 | 0 | 110.8 | Q28 | P26-Q28 PolarHBondContact O-N 2.84Š| ||
| 27 | L | 37.1 | Very low | 38.8 | Very low | 168 Ų | 168 | 158.8 Ų | 158.8 | 88% | 0.88 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 120.3 | 162.5 | -95.6 | 161.8 | 0 | 0 | 0 | 109.2 | A25 R29 | A25-L27 PolarHBondContact O-N 3.19Å; A25-L27 VanDerWaalsContact O-N 3.17Å; L27-R29 PolarHBondContact O-N 3.16Å |
| 28 | Q | 42.3 | Very low | 39.1 | Very low | 183 Ų | 183 | 157.8 Ų | 157.8 | 86% | 0.855 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 126.6 | 171.4 | -66.9 | -175 | -9 | 0 | 0 | 109.5 | P26 P30 | P26-Q28 PolarHBondContact O-N 2.84Å; Q28-P30 WeakPolarHBondContact O-CD 3.37Å |
| 29 | R | 42.7 | Very low | 39 | Very low | 243 Ų | 243 | 155 Ų | 155 | 92% | 0.917 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 121.6 | 168.7 | -65.3 | -173.8 | -173.8 | 111.2 | -0.5 | 109.1 | L27 | L27-R29 PolarHBondContact O-N 3.16Š|
| 30 | P | 40 | Very low | 38.7 | Very low | 123 Ų | 123 | 156.9 Ų | 156.9 | 80% | 0.799 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 132.3 | 172.3 | -16.1 | 31.7 | 0 | 0 | 0 | 110.6 | Q28 M32 | Q28-P30 WeakPolarHBondContact O-CD 3.37Å; P30-M32 PolarHBondContact O-N 2.88Å |
| 31 | L | 39.7 | Very low | 38.1 | Very low | 161 Ų | 161 | 155.4 Ų | 155.4 | 84% | 0.843 | 82% | 0.816 | S | S | * | * | trans | -75 | 115.5 | 168.2 | -179.1 | 69.9 | 0 | 0 | 0 | 108.8 | ||||
| 32 | M | 37 | Very low | 37.9 | Very low | 163 Ų | 163 | 150.9 Ų | 150.9 | 80% | 0.803 | 81% | 0.808 | S | S | * | * | trans | -65.7 | 133.6 | 165.9 | -70.3 | -170.7 | 70.5 | 0 | 0 | 109.7 | P30 | P30-M32 PolarHBondContact O-N 2.88Š| ||
| 33 | R | 35.9 | Very low | 37.7 | Very low | 236 Ų | 236 | 152.7 Ų | 152.7 | 89% | 0.891 | 81% | 0.811 | S | S | * | * | trans | -118.4 | 89.3 | 168.6 | -148.4 | 177.3 | -164.5 | 162.4 | 4.4 | 108.6 | ||||
| 34 | S | 37.4 | Very low | 37.4 | Very low | 94 Ų | 94 | 149.8 Ų | 149.8 | 66% | 0.657 | 80% | 0.803 | S | S | * | * | trans | -66.4 | 158.4 | 173.4 | -66.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 35 | H | 36.8 | Very low | 37.1 | Very low | 177 Ų | 177 | 149.4 Ų | 149.4 | 82% | 0.819 | 80% | 0.802 | S | S | * | * | trans | -72.8 | 144.7 | 179.2 | -61.2 | -174.9 | 0 | 0 | 0 | 111.3 | ||||
| 36 | D | 33.6 | Very low | 36.3 | Very low | 160 Ų | 160 | 151 Ų | 151 | 86% | 0.856 | 81% | 0.808 | S | S | * | * | trans | -108.2 | 134.3 | 159.9 | -78.7 | -50.5 | 0 | 0 | 0 | 110.3 | ||||
| 37 | I | 41.4 | Very low | 35.7 | Very low | 156 Ų | 156 | 149.3 Ų | 149.3 | 80% | 0.8 | 80% | 0.804 | S | S | * | * | trans | -104.7 | 124.2 | -179.6 | -64.5 | 166.3 | 0 | 0 | 0 | 107.4 | ||||
| 38 | I | 40.4 | Very low | 35.2 | Very low | 157 Ų | 157 | 151.8 Ų | 151.8 | 81% | 0.805 | 80% | 0.802 | S | S | * | * | trans | -136.6 | 98.9 | 169.9 | -54.4 | -178.8 | 0 | 0 | 0 | 105.3 | ||||
| 39 | A | 35.8 | Very low | 34.5 | Very low | 87 Ų | 87 | 148.7 Ų | 148.7 | 72% | 0.719 | 79% | 0.787 | S | S | * | * | 70.5 | 121 | 70.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 40 | N | 31.3 | Very low | 33.9 | Very low | 165 Ų | 165 | 144 Ų | 144 | 88% | 0.882 | 78% | 0.776 | S | S | * | * | trans | -112.9 | 126.2 | -163.6 | -179.6 | 47.2 | 0 | 0 | 0 | 110.2 | ||||
| 41 | S | 28.9 | Very low | 33.3 | Very low | 102 Ų | 102 | 144.5 Ų | 144.5 | 71% | 0.713 | 77% | 0.772 | S | S | * | * | trans | -169.5 | 119.4 | 162.6 | 48.5 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 42 | S | 32.7 | Very low | 32.9 | Very low | 97 Ų | 97 | 141 Ų | 141 | 68% | 0.678 | 76% | 0.76 | S | S | * | * | trans | 74.7 | 151.5 | 135.6 | 96 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 43 | D | 31.4 | Very low | 32.8 | Very low | 133 Ų | 133 | 140.2 Ų | 140.2 | 71% | 0.711 | 77% | 0.765 | S | S | * | * | cis | -143.8 | 154.1 | 11.1 | -97.7 | -58.8 | 0 | 0 | 0 | 114.9 | ||||
| 44 | I | 35 | Very low | 32.8 | Very low | 150 Ų | 150 | 133.3 Ų | 133.3 | 77% | 0.769 | 76% | 0.759 | S | S | * | * | trans | 20.1 | 127.8 | 145.2 | -63.5 | 179 | 0 | 0 | 0 | 121.1 | ||||
| 45 | L | 33 | Very low | 33.3 | Very low | 166 Ų | 166 | 135 Ų | 135 | 87% | 0.869 | 77% | 0.767 | S | S | * | * | trans | -66.8 | 135.8 | 159.3 | -72.8 | 149.5 | 0 | 0 | 0 | 112.6 | ||||
| 46 | S | 29.4 | Very low | 33.1 | Very low | 123 Ų | 123 | 130.4 Ų | 130.4 | 86% | 0.86 | 77% | 0.768 | S | S | * | * | trans | -154.5 | 133.7 | 143.4 | -86.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 47 | A | 28.3 | Very low | 33.4 | Very low | 92 Ų | 92 | 132 Ų | 132 | 76% | 0.76 | 77% | 0.77 | S | S | * | * | trans | -117.8 | 177.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 48 | R | 26.6 | Very low | 33 | Very low | 220 Ų | 220 | 130.8 Ų | 130.8 | 83% | 0.83 | 78% | 0.776 | S | S | * | * | trans | 82.4 | 145.8 | 176.9 | -63.6 | -164.8 | 82 | 174.4 | 3.5 | 116.2 | ||||
| 49 | Q | 27.9 | Very low | 32.9 | Very low | 117 Ų | 117 | 126.2 Ų | 126.2 | 55% | 0.547 | 77% | 0.767 | S | S | . | * | cis | -172.3 | 161.1 | -25.9 | -139.1 | -166.8 | -49.6 | 0 | 0 | 109.9 | ||||
| 50 | E | 28.6 | Very low | 33.2 | Very low | 145 Ų | 145 | 127.3 Ų | 127.3 | 68% | 0.678 | 78% | 0.776 | S | S | * | * | trans | 59.6 | 160.8 | 168.2 | -45 | -53.7 | 89.6 | 0 | 0 | 116.5 | ||||
| 51 | D | 28.8 | Very low | 34.1 | Very low | 133 Ų | 133 | 127.3 Ų | 127.3 | 71% | 0.711 | 77% | 0.774 | S | S | * | * | cis | -149.9 | 158.4 | 11.2 | -157.3 | -6.3 | 0 | 0 | 0 | 113.3 | ||||
| 52 | S | 30.7 | Very low | 34.6 | Very low | 87 Ų | 87 | 129.5 Ų | 129.5 | 61% | 0.608 | 78% | 0.778 | S | S | * | * | trans | 6.6 | 128.4 | 157.3 | -60.6 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 53 | T | 35.3 | Very low | 35.2 | Very low | 147 Ų | 147 | 133.6 Ų | 133.6 | 90% | 0.902 | 79% | 0.789 | S | S | * | * | 175.6 | 146.8 | 93.8 | 32.6 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 54 | A | 35.1 | Very low | 35.9 | Very low | 91 Ų | 91 | 138.1 Ų | 138.1 | 75% | 0.752 | 80% | 0.796 | S | S | * | * | trans | -123.6 | -175.5 | 167.9 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 55 | P | 47.5 | Very low | 36.3 | Very low | 130 Ų | 130 | 137.4 Ų | 137.4 | 84% | 0.844 | 80% | 0.798 | S | S | * | * | cis | -132.3 | -176.2 | -4.2 | 41.5 | -24.5 | 0 | 0 | 0 | 113.8 | ||||
| 56 | G | 33.3 | Very low | 36.6 | Very low | 80 Ų | 80 | 132.9 Ų | 132.9 | 83% | 0.825 | 79% | 0.792 | S | S | * | * | trans | -176.6 | 105.8 | 167.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 57 | Q | 39.1 | Very low | 37.5 | Very low | 193 Ų | 193 | 134.4 Ų | 134.4 | 90% | 0.902 | 79% | 0.789 | S | S | * | * | trans | -98.1 | 163.1 | 178.6 | -65.1 | -177.4 | 1.5 | 0 | 0 | 112.4 | ||||
| 58 | S | 34.8 | Very low | 38 | Very low | 132 Ų | 132 | 137.3 Ų | 137.3 | 92% | 0.923 | 79% | 0.791 | S | S | * | * | trans | 84.1 | 151.6 | 151.4 | -150.5 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 59 | G | 37.6 | Very low | 39.1 | Very low | 61 Ų | 61 | 134 Ų | 134 | 63% | 0.629 | 79% | 0.788 | S | S | * | * | trans | 122.6 | 78 | 170.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 60 | A | 41.7 | Very low | 40 | Very low | 109 Ų | 109 | 134.1 Ų | 134.1 | 90% | 0.901 | 80% | 0.799 | S | S | * | * | trans | -71.8 | 133.6 | 156.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 61 | I | 49.6 | Very low | 40.2 | Very low | 165 Ų | 165 | 132.3 Ų | 132.3 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | trans | -129.5 | 143.1 | 173.8 | 57.3 | 169.9 | 0 | 0 | 0 | 112.1 | ||||
| 62 | D | 41.1 | Very low | 40.8 | Very low | 148 Ų | 148 | 131.9 Ų | 131.9 | 79% | 0.791 | 81% | 0.805 | S | S | * | * | trans | -83.9 | 138.5 | -166.6 | -174.1 | 16.8 | 0 | 0 | 0 | 112.5 | R64 | D62-R64 VanDerWaalsContact C-N 3.33Å; D62-R64 PolarHBondContact O-N 3Å | ||
| 63 | M | 43.8 | Very low | 41.5 | Very low | 184 Ų | 184 | 133.8 Ų | 133.8 | 91% | 0.906 | 82% | 0.815 | S | S | * | * | trans | -86.2 | 70.5 | -179.5 | -75.2 | -171.2 | 68.4 | 0 | 0 | 111.4 | V65 | M63-V65 PolarHBondContact O-N 3.44Š| ||
| 64 | R | 46.8 | Very low | 41.6 | Very low | 227 Ų | 227 | 132.8 Ų | 132.8 | 86% | 0.857 | 81% | 0.809 | S | S | * | * | trans | -76.9 | 123.4 | 175.8 | -159.8 | 171.4 | -168.2 | 170.1 | 4.2 | 111.4 | D62 G66 | D62-R64 VanDerWaalsContact C-N 3.33Å; D62-R64 PolarHBondContact O-N 3Å; R64-G66 PolarHBondContact O-N 2.57Å | ||
| 65 | V | 44.3 | Very low | 41.7 | Very low | 136 Ų | 136 | 138.3 Ų | 138.3 | 82% | 0.824 | 82% | 0.816 | S | S | * | * | trans | -59.4 | 118.7 | 178.6 | 175.7 | 0 | 0 | 0 | 0 | 110.9 | M63 | M63-V65 PolarHBondContact O-N 3.44Š| ||
| 66 | G | 39.2 | Very low | 41.1 | Very low | 71 Ų | 71 | 137.8 Ų | 137.8 | 73% | 0.732 | 81% | 0.81 | S | S | * | * | trans | -120.4 | 104.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | R64 | R64-G66 PolarHBondContact O-N 2.57Š| ||
| 67 | I | 46.9 | Very low | 41.4 | Very low | 155 Ų | 155 | 139.6 Ų | 139.6 | 80% | 0.795 | 81% | 0.81 | S | S | * | * | trans | -75.1 | 125.4 | 174.2 | -26.9 | 173.3 | 0 | 0 | 0 | 107.8 | ||||
| 68 | N | 39.3 | Very low | 41.2 | Very low | 152 Ų | 152 | 139.1 Ų | 139.1 | 81% | 0.813 | 81% | 0.808 | S | S | * | * | trans | -148.1 | 121.9 | 170.5 | -130.4 | -31.6 | 0 | 0 | 0 | 111.5 | ||||
| 69 | I | 50 | Low | 41.2 | Very low | 150 Ų | 150 | 138.2 Ų | 138.2 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | trans | -111.6 | 131.9 | 176.8 | -64.8 | 169.2 | 0 | 0 | 0 | 107.1 | ||||
| 70 | P | 45.7 | Very low | 41.5 | Very low | 120 Ų | 120 | 141 Ų | 141 | 78% | 0.779 | 81% | 0.809 | S | S | * | * | trans | -116.8 | 144.3 | 149.3 | -0.5 | 21.5 | 0 | 0 | 0 | 112 | ||||
| 71 | S | 34.5 | Very low | 41.1 | Very low | 107 Ų | 107 | 140.4 Ų | 140.4 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | trans | -79.2 | 157.1 | -179.6 | 53.7 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 72 | V | 40.7 | Very low | 40.6 | Very low | 124 Ų | 124 | 137.8 Ų | 137.8 | 75% | 0.752 | 80% | 0.8 | S | S | * | * | trans | -48.8 | 162.2 | 165.7 | -66.8 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 73 | P | 45.4 | Very low | 40.7 | Very low | 128 Ų | 128 | 136.9 Ų | 136.9 | 83% | 0.831 | 80% | 0.803 | S | S | * | * | -131.4 | 158.3 | 100.2 | 38.2 | -31.8 | 0 | 0 | 0 | 115.9 | |||||
| 74 | T | 37 | Very low | 40.5 | Very low | 125 Ų | 125 | 135.7 Ų | 135.7 | 77% | 0.767 | 80% | 0.799 | S | S | * | * | trans | -69.7 | 144.9 | -174 | -37.6 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 75 | K | 36.7 | Very low | 39.8 | Very low | 207 Ų | 207 | 130.1 Ų | 130.1 | 90% | 0.9 | 80% | 0.795 | S | S | * | * | trans | -142.2 | 131.2 | 148.1 | -161.6 | 166.8 | -176.8 | 177.4 | 0 | 112 | ||||
| 76 | V | 35.6 | Very low | 39.7 | Very low | 120 Ų | 120 | 134 Ų | 134 | 73% | 0.727 | 80% | 0.796 | S | S | * | * | trans | -80.5 | 138.7 | -179.4 | 171.4 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 77 | S | 39.3 | Very low | 39.9 | Very low | 118 Ų | 118 | 139.3 Ų | 139.3 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | trans | -149.6 | 152.3 | 151.8 | -161.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 78 | Q | 35.3 | Very low | 39.7 | Very low | 182 Ų | 182 | 139.1 Ų | 139.1 | 85% | 0.85 | 80% | 0.797 | S | S | * | * | trans | -89.1 | 170.8 | -170.1 | -70.7 | 173.5 | -9.7 | 0 | 0 | 113.2 | ||||
| 79 | S | 34.6 | Very low | 40.1 | Very low | 113 Ų | 113 | 137.3 Ų | 137.3 | 79% | 0.79 | 79% | 0.787 | S | S | * | * | trans | -79.2 | 175.9 | -169.6 | 65.2 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 80 | P | 44.7 | Very low | 40.1 | Very low | 120 Ų | 120 | 133.8 Ų | 133.8 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | -145 | 169.3 | 78.5 | 37.5 | -19.2 | 0 | 0 | 0 | 116.9 | |||||
| 81 | A | 32.1 | Very low | 40.5 | Very low | 97 Ų | 97 | 135.5 Ų | 135.5 | 80% | 0.802 | 77% | 0.773 | S | S | * | * | trans | 62.3 | 115.4 | 155.8 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 82 | S | 39.7 | Very low | 41 | Very low | 109 Ų | 109 | 138.9 Ų | 138.9 | 76% | 0.762 | 77% | 0.769 | S | S | * | * | trans | -66.6 | 161.6 | 157.9 | -43.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 83 | P | 42.5 | Very low | 41.3 | Very low | 130 Ų | 130 | 136.6 Ų | 136.6 | 84% | 0.844 | 76% | 0.756 | S | S | * | * | -119.9 | 164.3 | 95.7 | -1.6 | 21 | 0 | 0 | 0 | 113.5 | S85 | P83-S85 PolarHBondContact O-N 3.2Š| |||
| 84 | L | 40.3 | Very low | 41.7 | Very low | 158 Ų | 158 | 136.5 Ų | 136.5 | 83% | 0.827 | 75% | 0.748 | S | S | * | * | trans | -59.4 | 115.6 | -175 | -70.3 | 158 | 0 | 0 | 0 | 112.1 | Y86 | L84-Y86 PolarHBondContact O-N 3.14Å; L84-Y86 VanDerWaalsContact O-N 3.16Å | ||
| 85 | S | 31.3 | Very low | 42.4 | Very low | 111 Ų | 111 | 135.7 Ų | 135.7 | 78% | 0.776 | 75% | 0.747 | S | S | * | * | trans | -59.4 | 114.8 | 160 | 178.1 | 0 | 0 | 0 | 0 | 108.5 | P83 H87 | P83-S85 PolarHBondContact O-N 3.2Å; S85-H87 PolarHBondContact O-N 3Å | ||
| 86 | Y | 43.1 | Very low | 43.2 | Very low | 217 Ų | 217 | 131 Ų | 131 | 85% | 0.851 | 73% | 0.731 | S | S | * | * | trans | -59.4 | 120.7 | 168.6 | -85.7 | -105 | 0 | 0 | 0 | 107.9 | L84 E88 | L84-Y86 PolarHBondContact O-N 3.14Å; L84-Y86 VanDerWaalsContact O-N 3.16Å; Y86-E88 VanDerWaalsContact C-N 3.27Å; Y86-E88 PolarHBondContact O-N 3.03Å | ||
| 87 | H | 44 | Very low | 43.7 | Very low | 182 Ų | 182 | 129.9 Ų | 129.9 | 84% | 0.843 | 73% | 0.728 | S | S | * | * | trans | -69.4 | 92.5 | 170.6 | -126.3 | -62.8 | 0 | 0 | 0 | 107.7 | S85 I89 | S85-H87 PolarHBondContact O-N 3Å; H87-I89 WeakPolarHBondContact O-CG1 3.37Å; H87-I89 PolarHBondContact O-N 3.12Å | ||
| 88 | E | 41.4 | Very low | 44.1 | Very low | 151 Ų | 151 | 131 Ų | 131 | 71% | 0.706 | 72% | 0.721 | S | S | * | * | trans | -66.5 | 102.9 | -177.3 | -162.2 | -169.1 | 132.9 | 0 | 0 | 109.6 | Y86 S90 | Y86-E88 VanDerWaalsContact C-N 3.27Å; Y86-E88 PolarHBondContact O-N 3.03Å; E88-S90 WeakPolarHBondContact CG-OG 3.19Å; E88-S90 PolarHBondContact O-N 3.46Å; E88-S90 WeakPolarHBondContact OE1-CB 3.39Å; E88-S90 PolarHBondContact OE1-OG 3.12Å | ||
| 89 | I | 48.9 | Very low | 44.7 | Very low | 115 Ų | 115 | 127.5 Ų | 127.5 | 59% | 0.59 | 71% | 0.714 | S | S | * | * | trans | -80.7 | 58.6 | 178.6 | -45.6 | -175.8 | 0 | 0 | 0 | 109.5 | H87 H91 | H87-I89 WeakPolarHBondContact O-CG1 3.37Å; H87-I89 PolarHBondContact O-N 3.12Å; I89-H91 VanDerWaalsContact C-N 3.31Å; I89-H91 PolarHBondContact O-N 3.47Å | ||
| 90 | S | 49.5 | Very low | 45.9 | Very low | 76 Ų | 76 | 130.4 Ų | 130.4 | 53% | 0.531 | 72% | 0.719 | S | S | . | * | trans | -91.6 | 26.1 | 179 | -76.4 | 0 | 0 | 0 | 0 | 113.5 | E88 W92 | E88-S90 WeakPolarHBondContact CG-OG 3.19Å; E88-S90 PolarHBondContact O-N 3.46Å; E88-S90 WeakPolarHBondContact OE1-CB 3.39Å; E88-S90 PolarHBondContact OE1-OG 3.12Å; S90-W92 PolarHBondContact O-N 3.34Å | ||
| 91 | H | 53.8 | Low | 46.1 | Very low | 156 Ų | 156 | 131.3 Ų | 131.3 | 72% | 0.722 | 72% | 0.718 | S | S | * | * | trans | -85.5 | 32.8 | 172.6 | 75.2 | -90.5 | 0 | 0 | 0 | 113.1 | I89 P93 | I89-H91 VanDerWaalsContact C-N 3.31Å; I89-H91 PolarHBondContact O-N 3.47Å; H91-P93 WeakPolarHBondContact O-CD 3.48Å | ||
| 92 | W | 46 | Very low | 46.7 | Very low | 178 Ų | 178 | 134.7 Ų | 134.7 | 67% | 0.674 | 72% | 0.722 | S | S | * | * | trans | -63.3 | 121.6 | 164 | -73.4 | 101 | 0 | 0 | 0 | 108.4 | S90 I94 I96 | S90-W92 PolarHBondContact O-N 3.34Å; W92-I94 PolarHBondContact O-N 3.28Å; W92-I96 HydrophobicContact CE3-CD1 3.72Å; W92-I96 HydrophobicContact CZ3-CD1 4.31Å | ||
| 93 | P | 45.9 | Very low | 47.2 | Very low | 75 Ų | 75 | 139.5 Ų | 139.5 | 49% | 0.487 | 72% | 0.724 | S | S | . | * | trans | -63.8 | 129.6 | -178.6 | 23.6 | -32 | 0 | 0 | 0 | 110.2 | H91 S95 I96 | H91-P93 WeakPolarHBondContact O-CD 3.48Å; P93-S95 PolarHBondContact O-N 3.45Å; P93-I96 HydrophobicContact CG-CD1 3.81Å; P93-I96 HydrophobicContact CG-CG1 4.36Å; P93-I96 WeakPolarHBondContact O-CG1 3.39Å; P93-I96 PolarHBondContact O-N 3.08Å | ||
| 94 | I | 54.2 | Low | 47.3 | Very low | 126 Ų | 126 | 141.7 Ų | 141.7 | 65% | 0.646 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -50.8 | -20.6 | -176.2 | -65.8 | 124.1 | 0 | 0 | 0 | 113.8 | W92 I96 S97 | W92-I94 PolarHBondContact O-N 3.28Å; I94-I96 PolarHBondContact O-N 3.03Å; I94-S97 PolarHBondContact O-N 2.86Å; I94-S97 PolarHBondContact O-OG 3.37Å |
| 95 | S | 51.5 | Low | 47.7 | Very low | 108 Ų | 108 | 144 Ų | 144 | 76% | 0.755 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -56.3 | -14.9 | 171.5 | -42.2 | 0 | 0 | 0 | 0 | 115.5 | P93 | P93-S95 PolarHBondContact O-N 3.45Š|
| 96 | I | 54 | Low | 48.1 | Very low | 108 Ų | 108 | 146.3 Ų | 146.3 | 55% | 0.554 | 73% | 0.733 | S | S | * | * | G | 310 helix | trans | -90.8 | -23.6 | -175.7 | -58.5 | 168.3 | 0 | 0 | 0 | 112.3 | W92 P93 I94 | W92-I96 HydrophobicContact CE3-CD1 3.72Å; W92-I96 HydrophobicContact CZ3-CD1 4.31Å; P93-I96 HydrophobicContact CG-CD1 3.81Å; P93-I96 HydrophobicContact CG-CG1 4.36Å; P93-I96 WeakPolarHBondContact O-CG1 3.39Å; P93-I96 PolarHBondContact O-N 3.08Å; I94-I96 PolarHBondContact O-N 3.03Å |
| 97 | S | 45.6 | Very low | 47.8 | Very low | 97 Ų | 97 | 138.9 Ų | 138.9 | 68% | 0.678 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -105.1 | 0.4 | -169.7 | 53.7 | 0 | 0 | 0 | 0 | 115.8 | I94 P99 | I94-S97 PolarHBondContact O-N 2.86Å; I94-S97 PolarHBondContact O-OG 3.37Å; S97-P99 WeakPolarHBondContact O-CD 3.37Å |
| 98 | Q | 48.6 | Very low | 47.5 | Very low | 143 Ų | 143 | 138.2 Ų | 138.2 | 67% | 0.668 | 73% | 0.725 | S | S | * | * | trans | -79.9 | 126.2 | -177.2 | -68.3 | -169.9 | -6.7 | 0 | 0 | 113.1 | ||||
| 99 | P | 47.7 | Very low | 47.2 | Very low | 108 Ų | 108 | 139.1 Ų | 139.1 | 70% | 0.701 | 73% | 0.729 | S | S | * | * | trans | -64.4 | 140.2 | 170.6 | -18.9 | 31.8 | 0 | 0 | 0 | 111.6 | S97 N101 | S97-P99 WeakPolarHBondContact O-CD 3.37Å; P99-N101 PolarHBondContact O-N 2.91Å | ||
| 100 | L | 58.3 | Low | 46.2 | Very low | 174 Ų | 174 | 139.6 Ų | 139.6 | 91% | 0.911 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -70 | 6.7 | -178 | -71.5 | 167.7 | 0 | 0 | 0 | 115.1 | N102 | L100-N102 PolarHBondContact O-N 3.09Š|
| 101 | N | 49.6 | Very low | 45.4 | Very low | 139 Ų | 139 | 141.5 Ų | 141.5 | 74% | 0.743 | 75% | 0.751 | S | S | * | * | trans | -85.1 | 91.4 | -179.3 | -70.5 | -17.4 | 0 | 0 | 0 | 110.4 | P99 | P99-N101 PolarHBondContact O-N 2.91Š| ||
| 102 | N | 45.8 | Very low | 44.6 | Very low | 168 Ų | 168 | 141.3 Ų | 141.3 | 90% | 0.898 | 75% | 0.754 | S | S | * | * | trans | 171.5 | 51.9 | 144 | -85.4 | -21.7 | 0 | 0 | 0 | 112.7 | L100 | L100-N102 PolarHBondContact O-N 3.09Š| ||
| 103 | R | 48.7 | Very low | 44.2 | Very low | 209 Ų | 209 | 138.4 Ų | 138.4 | 79% | 0.789 | 76% | 0.758 | S | S | * | * | trans | -118.1 | 19.5 | 178.7 | -124.8 | -63.6 | 167.5 | -159.1 | -9 | 116.3 | ||||
| 104 | L | 46.2 | Very low | 43.8 | Very low | 176 Ų | 176 | 141.5 Ų | 141.5 | 92% | 0.921 | 78% | 0.775 | S | S | * | * | trans | -137.9 | 75.9 | 173.6 | -67.9 | 175.6 | 0 | 0 | 0 | 112 | ||||
| 105 | K | 47.3 | Very low | 43.2 | Very low | 208 Ų | 208 | 141.2 Ų | 141.2 | 90% | 0.904 | 78% | 0.782 | S | S | * | * | trans | -146.4 | 57.7 | 160.4 | -151.9 | 165.2 | -177.7 | 175.8 | 0 | 112.4 | ||||
| 106 | L | 39.5 | Very low | 42.3 | Very low | 158 Ų | 158 | 140.9 Ų | 140.9 | 83% | 0.827 | 79% | 0.785 | S | S | * | * | trans | -104.6 | 120.2 | 146.9 | -60.3 | 172.1 | 0 | 0 | 0 | 103.5 | ||||
| 107 | G | 38 | Very low | 41.3 | Very low | 61 Ų | 61 | 140.1 Ų | 140.1 | 63% | 0.629 | 80% | 0.795 | S | S | * | * | cis | 109.7 | 41 | 34.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 108 | L | 37.1 | Very low | 40.5 | Very low | 169 Ų | 169 | 142.4 Ų | 142.4 | 89% | 0.885 | 81% | 0.806 | S | S | * | * | trans | -129.3 | 105.5 | 173.4 | -75.8 | 174.6 | 0 | 0 | 0 | 108.4 | ||||
| 109 | H | 35.5 | Very low | 39.8 | Very low | 170 Ų | 170 | 141.8 Ų | 141.8 | 79% | 0.787 | 82% | 0.817 | S | S | * | * | trans | -77.5 | 123.2 | 167.4 | 25.7 | -95.2 | 0 | 0 | 0 | 108.1 | ||||
| 110 | S | 28.2 | Very low | 39 | Very low | 125 Ų | 125 | 140.3 Ų | 140.3 | 87% | 0.874 | 82% | 0.821 | S | S | * | * | trans | -139 | 135.7 | 165.8 | -167.2 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 111 | T | 32.2 | Very low | 37.8 | Very low | 115 Ų | 115 | 139.1 Ų | 139.1 | 71% | 0.706 | 82% | 0.821 | S | S | * | * | trans | -119.9 | 148.6 | -155.1 | -30.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 112 | L | 36.8 | Very low | 36.9 | Very low | 153 Ų | 153 | 140.6 Ų | 140.6 | 80% | 0.801 | 83% | 0.828 | S | S | * | * | trans | 78.1 | 162.8 | 164.3 | -47 | -179 | 0 | 0 | 0 | 116.1 | ||||
| 113 | P | 37.5 | Very low | 36.2 | Very low | 117 Ų | 117 | 137.6 Ų | 137.6 | 76% | 0.76 | 82% | 0.82 | S | S | * | * | -135.3 | 173.2 | -84.2 | 34.4 | -13.9 | 0 | 0 | 0 | 115.1 | |||||
| 114 | V | 38.1 | Very low | 36.2 | Very low | 139 Ų | 139 | 133.1 Ų | 133.1 | 84% | 0.842 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -89.4 | 139 | 174.7 | 172.3 | 0 | 0 | 0 | 0 | 111.4 | ||
| 115 | P | 41.8 | Very low | 35.5 | Very low | 120 Ų | 120 | 130.5 Ų | 130.5 | 78% | 0.779 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -100.5 | 162.5 | 156.3 | 36.1 | -29.3 | 0 | 0 | 0 | 112.5 | ||
| 116 | A | 31.4 | Very low | 34.8 | Very low | 101 Ų | 101 | 129.6 Ų | 129.6 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -91.6 | 170.6 | -152 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||
| 117 | A | 33.2 | Very low | 34.5 | Very low | 92 Ų | 92 | 131.7 Ų | 131.7 | 76% | 0.76 | 82% | 0.818 | S | S | * | * | trans | -30.4 | 149.4 | 171.6 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 118 | T | 30 | Very low | 34.2 | Very low | 146 Ų | 146 | 132.9 Ų | 132.9 | 90% | 0.896 | 82% | 0.822 | S | S | * | * | trans | -140.5 | 146.4 | 139.1 | 40.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 119 | S | 33.9 | Very low | 33.7 | Very low | 130 Ų | 130 | 134.5 Ų | 134.5 | 91% | 0.909 | 82% | 0.822 | S | S | * | * | trans | -84.1 | 157 | 179.3 | -47.2 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 120 | G | 30.5 | Very low | 33.4 | Very low | 77 Ų | 77 | 132 Ų | 132 | 79% | 0.794 | 82% | 0.823 | S | S | * | * | trans | 178.2 | 96.4 | 170.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 121 | T | 32.5 | Very low | 33.3 | Very low | 148 Ų | 148 | 136.8 Ų | 136.8 | 91% | 0.908 | 82% | 0.822 | S | S | * | * | trans | -94.9 | 110.6 | 174.4 | -58.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 122 | I | 31.3 | Very low | 33 | Very low | 171 Ų | 171 | 139.5 Ų | 139.5 | 88% | 0.877 | 83% | 0.827 | S | S | * | * | trans | -148.8 | 146 | 158.5 | -29.8 | 175.1 | 0 | 0 | 0 | 111 | ||||
| 123 | S | 30.1 | Very low | 32.5 | Very low | 105 Ų | 105 | 136.4 Ų | 136.4 | 73% | 0.734 | 82% | 0.818 | S | S | * | * | trans | -154.1 | 164.5 | 175.8 | -178.1 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 124 | P | 49.9 | Very low | 32.1 | Very low | 115 Ų | 115 | 135.5 Ų | 135.5 | 75% | 0.747 | 81% | 0.814 | S | S | * | * | cis | -122.5 | 171.7 | -24.5 | 34.6 | -19.8 | 0 | 0 | 0 | 112.3 | ||||
| 125 | S | 29.7 | Very low | 32.1 | Very low | 120 Ų | 120 | 136.9 Ų | 136.9 | 84% | 0.839 | 82% | 0.816 | S | S | * | * | trans | -169.6 | 159 | 148.6 | 47.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 126 | H | 33.8 | Very low | 32.1 | Very low | 190 Ų | 190 | 137.3 Ų | 137.3 | 88% | 0.88 | 82% | 0.819 | S | S | * | * | trans | -83.2 | 141.3 | -168.9 | -65.6 | -129.2 | 0 | 0 | 0 | 113.8 | ||||
| 127 | Q | 34 | Very low | 32 | Very low | 202 Ų | 202 | 136.4 Ų | 136.4 | 94% | 0.944 | 82% | 0.819 | S | S | * | * | trans | -152.8 | 129.3 | 138.2 | -121.4 | 173.6 | 34.3 | 0 | 0 | 110.7 | ||||
| 128 | A | 30.3 | Very low | 32.2 | Very low | 86 Ų | 86 | 140.5 Ų | 140.5 | 71% | 0.711 | 82% | 0.822 | S | S | * | * | trans | -110.9 | 139.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 129 | F | 26.3 | Very low | 32.7 | Very low | 202 Ų | 202 | 139 Ų | 139 | 89% | 0.886 | 82% | 0.815 | S | S | * | * | trans | -164.7 | 99.2 | 149.5 | -102.1 | -78.6 | 0 | 0 | 0 | 105.5 | ||||
| 130 | C | 28.9 | Very low | 32.7 | Very low | 119 Ų | 119 | 136.3 Ų | 136.3 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | 61.8 | 107.5 | 94.6 | -71.6 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 131 | W | 26.3 | Very low | 32.8 | Very low | 224 Ų | 224 | 140 Ų | 140 | 85% | 0.848 | 81% | 0.808 | S | S | * | * | trans | -121.5 | 127 | 146.6 | 74.6 | -76.9 | 0 | 0 | 0 | 108.3 | S133 | W131-S133 WeakPolarHBondContact CH2-OG 3.5Å; W131-S133 WeakPolarHBondContact CZ3-OG 3.38Å | ||
| 132 | E | 25.7 | Very low | 33.2 | Very low | 172 Ų | 172 | 137.3 Ų | 137.3 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | trans | -96 | 132 | -173.5 | -169.9 | 167.7 | 167.9 | 0 | 0 | 109 | ||||
| 133 | S | 26.9 | Very low | 33.5 | Very low | 89 Ų | 89 | 135.3 Ų | 135.3 | 62% | 0.622 | 80% | 0.799 | S | S | * | * | trans | -107.8 | 82.2 | 179.1 | -77.8 | 0 | 0 | 0 | 0 | 110.7 | W131 | W131-S133 WeakPolarHBondContact CH2-OG 3.5Å; W131-S133 WeakPolarHBondContact CZ3-OG 3.38Å | ||
| 134 | S | 29.4 | Very low | 33.6 | Very low | 97 Ų | 97 | 142.1 Ų | 142.1 | 68% | 0.678 | 81% | 0.809 | S | S | * | * | trans | -77.6 | 119.2 | 174.1 | -50.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 135 | L | 37.5 | Very low | 32.9 | Very low | 168 Ų | 168 | 143.5 Ų | 143.5 | 88% | 0.88 | 82% | 0.815 | S | S | * | * | trans | -82 | 147.4 | 148.2 | -70.7 | 170.3 | 0 | 0 | 0 | 107.4 | ||||
| 136 | P | 42.1 | Very low | 33.2 | Very low | 130 Ų | 130 | 143.5 Ų | 143.5 | 84% | 0.844 | 82% | 0.815 | S | S | * | * | -152.2 | 170.2 | 82.4 | 38.4 | -19.3 | 0 | 0 | 0 | 116.3 | |||||
| 137 | G | 29.4 | Very low | 33.1 | Very low | 81 Ų | 81 | 141.9 Ų | 141.9 | 84% | 0.835 | 81% | 0.807 | S | S | * | * | trans | 150.2 | 89.6 | 161.7 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 138 | Q | 37.8 | Very low | 33.2 | Very low | 178 Ų | 178 | 138 Ų | 138 | 83% | 0.832 | 80% | 0.802 | S | S | * | * | trans | -92.8 | 170.8 | 160.2 | -92.3 | -124.7 | 43.2 | 0 | 0 | 109.4 | ||||
| 139 | P | 41.6 | Very low | 33.5 | Very low | 115 Ų | 115 | 142.5 Ų | 142.5 | 75% | 0.747 | 81% | 0.805 | S | S | * | * | cis | -146.5 | 168.5 | 28.6 | 42 | -21.3 | 0 | 0 | 0 | 120.8 | ||||
| 140 | A | 32.8 | Very low | 33.8 | Very low | 73 Ų | 73 | 140.2 Ų | 140.2 | 60% | 0.603 | 80% | 0.803 | S | S | * | * | trans | 56.7 | 121.4 | 142.1 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 141 | T | 33 | Very low | 34.2 | Very low | 155 Ų | 155 | 143.7 Ų | 143.7 | 95% | 0.951 | 81% | 0.806 | S | S | * | * | -171.1 | 165.8 | 111.5 | 21.6 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 142 | A | 40.6 | Very low | 34.6 | Very low | 92 Ų | 92 | 138.9 Ų | 138.9 | 76% | 0.76 | 80% | 0.802 | S | S | * | * | trans | -82 | 165 | -162.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 143 | P | 36.8 | Very low | 35.1 | Very low | 128 Ų | 128 | 139.1 Ų | 139.1 | 83% | 0.831 | 80% | 0.8 | S | S | * | * | trans | -84.8 | 145.8 | -171.2 | 33.9 | -34.7 | 0 | 0 | 0 | 113.7 | ||||
| 144 | R | 33.7 | Very low | 35.3 | Very low | 248 Ų | 248 | 141.6 Ų | 141.6 | 94% | 0.936 | 81% | 0.812 | S | S | * | * | trans | -117 | 129.3 | 162.7 | -84.2 | -166.6 | -179.4 | -144.7 | 1.5 | 111.9 | ||||
| 145 | V | 34.1 | Very low | 35.6 | Very low | 145 Ų | 145 | 144.9 Ų | 144.9 | 88% | 0.879 | 82% | 0.816 | S | S | * | * | trans | -63 | 128.4 | 167.7 | -177 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 146 | S | 36 | Very low | 35.5 | Very low | 119 Ų | 119 | 143.8 Ų | 143.8 | 83% | 0.832 | 82% | 0.816 | S | S | * | * | trans | -99.6 | 110.4 | 174.2 | -158.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 147 | Q | 33.1 | Very low | 35 | Very low | 156 Ų | 156 | 142.8 Ų | 142.8 | 73% | 0.729 | 81% | 0.812 | S | S | * | * | trans | -100.7 | 125.2 | 179.4 | -170.9 | 170.3 | 12.6 | 0 | 0 | 108.8 | F149 | Q147-F149 HydrophobicContact CG-CE2 4.4Š| ||
| 148 | C | 35.7 | Very low | 35.4 | Very low | 122 Ų | 122 | 148 Ų | 148 | 82% | 0.824 | 82% | 0.815 | S | S | * | * | trans | -70.9 | 138.1 | 178.6 | -57.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 149 | F | 34.9 | Very low | 35.2 | Very low | 179 Ų | 179 | 148.5 Ų | 148.5 | 79% | 0.785 | 82% | 0.817 | S | S | * | * | trans | -140.5 | 137.4 | 159.6 | -92.9 | -77.3 | 0 | 0 | 0 | 110.4 | Q147 | Q147-F149 HydrophobicContact CG-CE2 4.4Š| ||
| 150 | D | 34 | Very low | 35 | Very low | 155 Ų | 155 | 153.1 Ų | 153.1 | 83% | 0.829 | 83% | 0.826 | S | S | * | * | trans | -65 | 144.5 | 176.6 | -62.6 | -93.1 | 0 | 0 | 0 | 112.6 | ||||
| 151 | H | 36.6 | Very low | 35.1 | Very low | 191 Ų | 191 | 158.2 Ų | 158.2 | 88% | 0.884 | 84% | 0.837 | S | S | * | * | trans | -143.2 | 146.2 | 149.7 | -140.4 | 70.8 | 0 | 0 | 0 | 114 | ||||
| 152 | V | 35.6 | Very low | 35.5 | Very low | 124 Ų | 124 | 154.7 Ų | 154.7 | 75% | 0.752 | 82% | 0.818 | S | S | * | * | trans | -84.8 | 141.4 | -169.8 | 161.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 153 | K | 35.7 | Very low | 35.9 | Very low | 177 Ų | 177 | 156.5 Ų | 156.5 | 77% | 0.77 | 82% | 0.822 | S | S | * | * | trans | -10.8 | 116.4 | 156.6 | -176.6 | -174 | -177.1 | -176.9 | 0 | 116.8 | ||||
| 154 | T | 30.6 | Very low | 36.1 | Very low | 141 Ų | 141 | 160.8 Ų | 160.8 | 87% | 0.865 | 82% | 0.822 | S | S | * | * | trans | -137 | 128.9 | 139.5 | -67.9 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 155 | Q | 35.2 | Very low | 36.5 | Very low | 166 Ų | 166 | 158.7 Ų | 158.7 | 78% | 0.776 | 82% | 0.82 | S | S | * | * | trans | -98 | 138.7 | 170.8 | -71.8 | -171.9 | -3.1 | 0 | 0 | 109.5 | ||||
| 156 | V | 36.8 | Very low | 36.9 | Very low | 145 Ų | 145 | 161.3 Ų | 161.3 | 88% | 0.879 | 81% | 0.814 | S | S | * | * | trans | 162.5 | 113.6 | 135 | 157.5 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 157 | S | 30.8 | Very low | 37.8 | Very low | 108 Ų | 108 | 161.8 Ų | 161.8 | 76% | 0.755 | 81% | 0.812 | S | S | * | * | trans | -165.1 | 118.3 | 152.2 | -168.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 158 | E | 38 | Very low | 38.9 | Very low | 191 Ų | 191 | 157.8 Ų | 157.8 | 89% | 0.893 | 81% | 0.812 | S | S | * | * | trans | -80.2 | 132.4 | 171.6 | -65.7 | 177.2 | 103.8 | 0 | 0 | 109.7 | ||||
| 159 | Q | 33.9 | Very low | 40.1 | Very low | 188 Ų | 188 | 156.3 Ų | 156.3 | 88% | 0.879 | 80% | 0.799 | S | S | * | * | trans | -133.7 | 119.2 | 157.3 | -69.6 | -161.8 | -69.8 | 0 | 0 | 110.6 | ||||
| 160 | K | 38 | Very low | 41.3 | Very low | 213 Ų | 213 | 153.3 Ų | 153.3 | 93% | 0.926 | 79% | 0.791 | S | S | * | * | trans | -68.6 | 128.9 | 164.6 | -80.7 | 174.9 | 169.6 | 172.7 | 0 | 109.2 | ||||
| 161 | E | 34.7 | Very low | 42.6 | Very low | 179 Ų | 179 | 150 Ų | 150 | 84% | 0.836 | 79% | 0.786 | S | S | * | * | trans | -141.6 | 128.8 | 144 | -150.9 | -175.1 | 140.7 | 0 | 0 | 114.1 | ||||
| 162 | S | 40.4 | Very low | 43.7 | Very low | 81 Ų | 81 | 145 Ų | 145 | 57% | 0.566 | 77% | 0.765 | S | S | * | * | trans | -4 | 130.7 | 163.3 | -159.8 | 0 | 0 | 0 | 0 | 121.1 | R164 | S162-R164 PolarHBondContact O-N 3.35Å; S162-R164 VanDerWaalsContact O-N 3.14Å | ||
| 163 | P | 48.9 | Very low | 44.9 | Very low | 130 Ų | 130 | 142 Ų | 142 | 84% | 0.844 | 75% | 0.747 | S | S | * | * | trans | -80.2 | 90.1 | 170.8 | 33.6 | -33.7 | 0 | 0 | 0 | 112.3 | K165 | P163-K165 PolarHBondContact O-N 2.87Š| ||
| 164 | R | 41.3 | Very low | 46.1 | Very low | 219 Ų | 219 | 140 Ų | 140 | 83% | 0.826 | 74% | 0.735 | S | S | * | * | trans | -77.4 | 109.1 | 171.4 | -83 | -176.5 | 172.2 | 163.6 | -0.2 | 112.4 | S162 | S162-R164 PolarHBondContact O-N 3.35Å; S162-R164 VanDerWaalsContact O-N 3.14Å | ||
| 165 | K | 41.3 | Very low | 47.6 | Very low | 203 Ų | 203 | 136.4 Ų | 136.4 | 88% | 0.883 | 72% | 0.72 | S | S | * | * | trans | 24.9 | 99.3 | 155.6 | -68.4 | -177.7 | 175.5 | -178.7 | 0 | 116.3 | P163 V167 | P163-K165 PolarHBondContact O-N 2.87Å; K165-V167 PolarHBondContact O-N 3.31Å | ||
| 166 | R | 42.7 | Very low | 48.8 | Very low | 200 Ų | 200 | 135.3 Ų | 135.3 | 76% | 0.755 | 71% | 0.709 | S | S | * | * | trans | -68.4 | 114.8 | 162 | -65.6 | -171.7 | -177.5 | -179.6 | 6 | 109.5 | ||||
| 167 | V | 55.4 | Low | 50.3 | Low | 130 Ų | 130 | 133 Ų | 133 | 79% | 0.788 | 69% | 0.69 | S | S | * | * | trans | -60.6 | 134.9 | 148.8 | 173.1 | 0 | 0 | 0 | 0 | 106.8 | K165 V169 | K165-V167 PolarHBondContact O-N 3.31Å; V167-V169 PolarHBondContact O-N 2.89Å | ||
| 168 | G | 57.1 | Low | 52.5 | Low | 71 Ų | 71 | 131.7 Ų | 131.7 | 73% | 0.732 | 68% | 0.68 | S | S | * | * | trans | -60.9 | 110.4 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 169 | V | 60 | Low | 54.5 | Low | 92 Ų | 92 | 128.4 Ų | 128.4 | 56% | 0.558 | 66% | 0.664 | S | S | * | * | trans | -112.6 | 119.9 | 157.3 | 178.7 | 0 | 0 | 0 | 0 | 105 | V167 T173 | V167-V169 PolarHBondContact O-N 2.89Å; V169-T173 HydrophobicContact CG1-CG2 4.16Å | ||
| 170 | D | 60.8 | Low | 56.8 | Low | 115 Ų | 115 | 123.7 Ų | 123.7 | 62% | 0.615 | 65% | 0.648 | S | S | * | * | trans | -54.2 | 146.1 | -167.1 | -52.5 | -84.5 | 0 | 0 | 0 | 112.6 | D172 T173 R174 | D170-D172 PolarHBondContact O-N 2.79Å; D170-T173 WeakPolarHBondContact O-CB 3.45Å; D170-T173 PolarHBondContact O-N 3Å; D170-T173 VanDerWaalsContact O-N 3.11Å; D170-R174 PolarHBondContact O-N 3.43Å | ||
| 171 | A | 60.5 | Low | 59.3 | Low | 87 Ų | 87 | 120.5 Ų | 120.5 | 72% | 0.719 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -59 | -34 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | R174 A175 | A171-R174 WeakPolarHBondContact O-CB 3.43Å; A171-R174 PolarHBondContact O-N 2.97Å; A171-A175 PolarHBondContact O-N 3.2Å; A171-A175 VanDerWaalsContact O-N 3.09Å |
| 172 | D | 61 | Low | 62 | Low | 84 Ų | 84 | 114.4 Ų | 114.4 | 45% | 0.449 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -59.1 | -48.4 | 174.1 | 178 | 41.3 | 0 | 0 | 0 | 112.3 | D170 R174 A175 R176 | D170-D172 PolarHBondContact O-N 2.79Å; D172-R174 PolarHBondContact O-N 2.94Å; D172-A175 PolarHBondContact O-N 3.39Å; D172-R176 WeakPolarHBondContact O-CG 3.37Å; D172-R176 PolarHBondContact O-N 3.35Å; D172-R176 IonicContact OD1-CZ 2.75Å; D172-R176 IonicContact OD1-NE 3.08Å; D172-R176 PolarHBondContact OD1-NE 2.94Å; D172-R176 IonicContact OD1-NH2 3.59Å; D172-R176 IonicContact OD2-CZ 3.29Å; D172-R176 VanDerWaalsContact OD2-CZ 3.3Å; D172-R176 IonicContact OD2-NE 3.59Å; D172-R176 PolarHBondContact OD2-NE 3.3Å; D172-R176 VanDerWaalsContact OD2-NE 3.08Å; D172-R176 IonicContact OD2-NH2 3.41Å; D172-R176 PolarHBondContact OD2-NH2 2.94Å |
| 173 | T | 60.7 | Low | 64.4 | Low | 62 Ų | 62 | 114.1 Ų | 114.1 | 38% | 0.38 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -58.8 | -33.4 | 176.7 | -37.8 | 0 | 0 | 0 | 0 | 111.9 | V169 D170 L177 | V169-T173 HydrophobicContact CG1-CG2 4.16Å; D170-T173 WeakPolarHBondContact O-CB 3.45Å; D170-T173 PolarHBondContact O-N 3Å; D170-T173 VanDerWaalsContact O-N 3.11Å; T173-L177 WeakPolarHBondContact O-CG 3.37Å |
| 174 | R | 59.9 | Low | 66.7 | Low | 134 Ų | 134 | 111.9 Ų | 111.9 | 51% | 0.506 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -75.1 | -31.3 | 176.8 | -166.2 | 178.3 | -66.6 | -126.9 | -3.7 | 112.9 | D170 A171 D172 P178 | D170-R174 PolarHBondContact O-N 3.43Å; A171-R174 WeakPolarHBondContact O-CB 3.43Å; A171-R174 PolarHBondContact O-N 2.97Å; D172-R174 PolarHBondContact O-N 2.94Å; R174-P178 WeakPolarHBondContact O-CD 3.3Å |
| 175 | A | 61.4 | Low | 69.3 | Low | 67 Ų | 67 | 107.4 Ų | 107.4 | 55% | 0.554 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -76.2 | -35.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | A171 D172 P178 | A171-A175 PolarHBondContact O-N 3.2Å; A171-A175 VanDerWaalsContact O-N 3.09Å; D172-A175 PolarHBondContact O-N 3.39Å; A175-P178 WeakPolarHBondContact O-CD 3.46Å |
| 176 | R | 61.9 | Low | 71.9 | Confident | 143 Ų | 143 | 101.5 Ų | 101.5 | 54% | 0.54 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -70.9 | -26.6 | 176.3 | -62.9 | -175.5 | -158.3 | -143.8 | 19.4 | 113.9 | D172 E179 V180 | D172-R176 WeakPolarHBondContact O-CG 3.37Å; D172-R176 PolarHBondContact O-N 3.35Å; D172-R176 IonicContact OD1-CZ 2.75Å; D172-R176 IonicContact OD1-NE 3.08Å; D172-R176 PolarHBondContact OD1-NE 2.94Å; D172-R176 IonicContact OD1-NH2 3.59Å; D172-R176 IonicContact OD2-CZ 3.29Å; D172-R176 VanDerWaalsContact OD2-CZ 3.3Å; D172-R176 IonicContact OD2-NE 3.59Å; D172-R176 PolarHBondContact OD2-NE 3.3Å; D172-R176 VanDerWaalsContact OD2-NE 3.08Å; D172-R176 IonicContact OD2-NH2 3.41Å; D172-R176 PolarHBondContact OD2-NH2 2.94Å; R176-E179 PolarHBondContact O-N 3.23Å; R176-V180 WeakPolarHBondContact O-CG2 3.29Å; R176-V180 PolarHBondContact O-N 3.31Å |
| 177 | L | 67.9 | Low | 74.5 | Confident | 95 Ų | 95 | 99.6 Ų | 99.6 | 50% | 0.497 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60.8 | -44.5 | -178.5 | -81 | 168.6 | 0 | 0 | 0 | 114.1 | T173 K181 | T173-L177 WeakPolarHBondContact O-CG 3.37Å; L177-K181 VanDerWaalsContact O-CG 3.27Å; L177-K181 WeakPolarHBondContact O-CG 3.36Å; L177-K181 PolarHBondContact O-N 2.95Å; L177-K181 VanDerWaalsContact O-N 3.08Å |
| 178 | P | 76.9 | Confident | 76.5 | Confident | 81 Ų | 81 | 101.2 Ų | 101.2 | 53% | 0.526 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -56.4 | -43.3 | 168.1 | -29.3 | 34.5 | 0 | 0 | 0 | 114.4 | R174 A175 K181 A182 | R174-P178 WeakPolarHBondContact O-CD 3.3Å; A175-P178 WeakPolarHBondContact O-CD 3.46Å; P178-K181 WeakPolarHBondContact O-CB 3.38Å; P178-K181 PolarHBondContact O-N 3.15Å; P178-A182 PolarHBondContact O-N 3.32Å |
| 179 | E | 80.5 | Confident | 78.5 | Confident | 122 Ų | 122 | 102.8 Ų | 102.8 | 57% | 0.57 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65 | -47.2 | -179.9 | -170.6 | -171.4 | 168.1 | 0 | 0 | 111.5 | R176 K181 A182 I183 | R176-E179 PolarHBondContact O-N 3.23Å; E179-K181 VanDerWaalsContact C-N 3.27Å; E179-K181 PolarHBondContact O-N 3.43Å; E179-A182 WeakPolarHBondContact O-CB 3.4Å; E179-A182 PolarHBondContact O-N 2.89Å; E179-A182 VanDerWaalsContact O-N 3.09Å; E179-I183 HydrophobicContact CG-CD1 4.1Å; E179-I183 WeakPolarHBondContact O-CG1 3.41Å; E179-I183 PolarHBondContact O-N 2.79Å |
| 180 | V | 82.5 | Confident | 80.3 | Confident | 90 Ų | 90 | 103 Ų | 103 | 55% | 0.545 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -58.7 | -39.2 | 174.5 | 171.9 | 0 | 0 | 0 | 0 | 111.3 | R176 Q184 | R176-V180 WeakPolarHBondContact O-CG2 3.29Å; R176-V180 PolarHBondContact O-N 3.31Å; V180-Q184 WeakPolarHBondContact O-CB 3.44Å; V180-Q184 PolarHBondContact O-N 3.4Å |
| 181 | K | 89.5 | Confident | 82.1 | Confident | 146 Ų | 146 | 99.9 Ų | 99.9 | 64% | 0.635 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.9 | -42.6 | 174.2 | -74.3 | 171.1 | -178.2 | -178.4 | 0 | 112.1 | L177 P178 E179 Q184 Q185 | L177-K181 VanDerWaalsContact O-CG 3.27Å; L177-K181 WeakPolarHBondContact O-CG 3.36Å; L177-K181 PolarHBondContact O-N 2.95Å; L177-K181 VanDerWaalsContact O-N 3.08Å; P178-K181 WeakPolarHBondContact O-CB 3.38Å; P178-K181 PolarHBondContact O-N 3.15Å; E179-K181 VanDerWaalsContact C-N 3.27Å; E179-K181 PolarHBondContact O-N 3.43Å; K181-Q184 PolarHBondContact O-N 2.88Å; K181-Q185 WeakPolarHBondContact O-CB 3.48Å; K181-Q185 PolarHBondContact O-N 3.08Å |
| 182 | A | 90.9 | Very high | 83.9 | Confident | 50 Ų | 50 | 100.2 Ų | 100.2 | 41% | 0.413 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.7 | -46 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | P178 E179 Q184 Q185 T186 | P178-A182 PolarHBondContact O-N 3.32Å; E179-A182 WeakPolarHBondContact O-CB 3.4Å; E179-A182 PolarHBondContact O-N 2.89Å; E179-A182 VanDerWaalsContact O-N 3.09Å; A182-Q184 VanDerWaalsContact C-N 3.31Å; A182-Q184 PolarHBondContact O-N 2.95Å; A182-Q185 WeakPolarHBondContact O-CB 3.41Å; A182-Q185 PolarHBondContact O-N 3.39Å; A182-T186 PolarHBondContact O-N 3.23Å; A182-T186 PolarHBondContact O-OG1 3.22Å |
| 183 | I | 92.1 | Very high | 85.7 | Confident | 76 Ų | 76 | 98.5 Ų | 98.5 | 39% | 0.39 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.1 | -44.6 | 174.2 | -66.8 | 165.1 | 0 | 0 | 0 | 110.5 | E179 Q185 T186 R187 | E179-I183 HydrophobicContact CG-CD1 4.1Å; E179-I183 WeakPolarHBondContact O-CG1 3.41Å; E179-I183 PolarHBondContact O-N 2.79Å; I183-Q185 PolarHBondContact O-N 3.4Å; I183-T186 PolarHBondContact O-N 2.98Å; I183-R187 VanDerWaalsContact O-CG 3.31Å; I183-R187 WeakPolarHBondContact O-CG 3.08Å; I183-R187 PolarHBondContact O-N 3.03Å |
| 184 | Q | 95.6 | Very high | 87.5 | Confident | 82 Ų | 82 | 104.5 Ų | 104.5 | 38% | 0.383 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67 | -34.5 | 178.2 | -174.6 | 55.2 | 56.8 | 0 | 0 | 112.9 | V180 K181 A182 R188 | V180-Q184 WeakPolarHBondContact O-CB 3.44Å; V180-Q184 PolarHBondContact O-N 3.4Å; K181-Q184 PolarHBondContact O-N 2.88Å; A182-Q184 VanDerWaalsContact C-N 3.31Å; A182-Q184 PolarHBondContact O-N 2.95Å; Q184-R188 WeakPolarHBondContact O-CG 3.46Å; Q184-R188 PolarHBondContact O-N 3.39Å |
| 185 | Q | 96 | Very high | 89.3 | Confident | 126 Ų | 126 | 101.9 Ų | 101.9 | 59% | 0.589 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -66.1 | -47.3 | 172.8 | -179.7 | 172.2 | -13.9 | 0 | 0 | 111.1 | K181 A182 I183 R187 R188 L189 | K181-Q185 WeakPolarHBondContact O-CB 3.48Å; K181-Q185 PolarHBondContact O-N 3.08Å; A182-Q185 WeakPolarHBondContact O-CB 3.41Å; A182-Q185 PolarHBondContact O-N 3.39Å; I183-Q185 PolarHBondContact O-N 3.4Å; Q185-R187 VanDerWaalsContact C-N 3.33Å; Q185-R187 PolarHBondContact O-N 3.43Å; Q185-R188 WeakPolarHBondContact O-CB 3.36Å; Q185-R188 PolarHBondContact O-N 2.88Å; Q185-R188 VanDerWaalsContact O-N 3.1Å; Q185-L189 HydrophobicContact CG-CD1 4.24Å; Q185-L189 WeakPolarHBondContact O-CG 3.44Å; Q185-L189 PolarHBondContact O-N 2.79Å |
| 186 | T | 96.1 | Very high | 91.1 | Very high | 78 Ų | 78 | 106.7 Ų | 106.7 | 48% | 0.479 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.2 | -42.6 | 175.2 | -61.3 | 0 | 0 | 0 | 0 | 111.7 | A182 I183 R188 L189 L190 | A182-T186 PolarHBondContact O-N 3.23Å; A182-T186 PolarHBondContact O-OG1 3.22Å; I183-T186 PolarHBondContact O-N 2.98Å; T186-R188 PolarHBondContact O-N 3.36Å; T186-L189 PolarHBondContact O-N 3.38Å; T186-L190 HydrophobicContact CG2-CD1 4.1Å; T186-L190 WeakPolarHBondContact O-CB 3.1Å; T186-L190 WeakPolarHBondContact O-CG 3.46Å; T186-L190 PolarHBondContact O-N 3.46Å |
| 187 | R | 97.7 | Very high | 92.9 | Very high | 160 Ų | 160 | 104.1 Ų | 104.1 | 60% | 0.604 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -58.6 | -43.8 | 172.9 | -73.6 | 173.7 | 179.8 | -164.2 | -0.1 | 112.4 | I183 Q185 A191 | I183-R187 VanDerWaalsContact O-CG 3.31Å; I183-R187 WeakPolarHBondContact O-CG 3.08Å; I183-R187 PolarHBondContact O-N 3.03Å; Q185-R187 VanDerWaalsContact C-N 3.33Å; Q185-R187 PolarHBondContact O-N 3.43Å; R187-A191 WeakPolarHBondContact O-CB 3.37Å; R187-A191 PolarHBondContact O-N 3.46Å |
| 188 | R | 98.3 | Very high | 94.3 | Very high | 164 Ų | 164 | 106 Ų | 106 | 62% | 0.619 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.3 | -42.9 | 175.5 | -74 | 170.7 | 178 | -177.4 | -0.3 | 112.2 | Q184 Q185 T186 A191 N192 | Q184-R188 WeakPolarHBondContact O-CG 3.46Å; Q184-R188 PolarHBondContact O-N 3.39Å; Q185-R188 WeakPolarHBondContact O-CB 3.36Å; Q185-R188 PolarHBondContact O-N 2.88Å; Q185-R188 VanDerWaalsContact O-N 3.1Å; T186-R188 PolarHBondContact O-N 3.36Å; R188-A191 PolarHBondContact O-N 2.87Å; R188-N192 WeakPolarHBondContact O-CB 3.08Å; R188-N192 PolarHBondContact O-N 2.96Å |
| 189 | L | 98.1 | Very high | 95.4 | Very high | 105 Ų | 105 | 105 Ų | 105 | 55% | 0.55 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.7 | -44.8 | 177.6 | -70.1 | 172.9 | 0 | 0 | 0 | 111.7 | Q185 T186 N192 A193 | Q185-L189 HydrophobicContact CG-CD1 4.24Å; Q185-L189 WeakPolarHBondContact O-CG 3.44Å; Q185-L189 PolarHBondContact O-N 2.79Å; T186-L189 PolarHBondContact O-N 3.38Å; L189-N192 PolarHBondContact O-N 3.37Å; L189-A193 WeakPolarHBondContact O-CB 3.33Å; L189-A193 PolarHBondContact O-N 3.3Å |
| 190 | L | 98.1 | Very high | 96.2 | Very high | 95 Ų | 95 | 105.4 Ų | 105.4 | 50% | 0.497 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.6 | -39.6 | 175.7 | -70.8 | 171.2 | 0 | 0 | 0 | 112.4 | T186 A193 R194 | T186-L190 HydrophobicContact CG2-CD1 4.1Å; T186-L190 WeakPolarHBondContact O-CB 3.1Å; T186-L190 WeakPolarHBondContact O-CG 3.46Å; T186-L190 PolarHBondContact O-N 3.46Å; L190-A193 PolarHBondContact O-N 3.34Å; L190-R194 VanDerWaalsContact O-CG 3.31Å; L190-R194 WeakPolarHBondContact O-CG 3.5Å; L190-R194 PolarHBondContact O-N 2.88Å |
| 191 | A | 98.3 | Very high | 97 | Very high | 51 Ų | 51 | 105.2 Ų | 105.2 | 42% | 0.421 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.9 | -46.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | R187 R188 A193 R194 E195 | R187-A191 WeakPolarHBondContact O-CB 3.37Å; R187-A191 PolarHBondContact O-N 3.46Å; R188-A191 PolarHBondContact O-N 2.87Å; A191-A193 VanDerWaalsContact C-N 3.34Å; A191-A193 PolarHBondContact O-N 3.06Å; A191-R194 PolarHBondContact O-N 3.47Å; A191-E195 PolarHBondContact O-N 3.05Å |
| 192 | N | 98.6 | Very high | 97.4 | Very high | 93 Ų | 93 | 101.8 Ų | 101.8 | 50% | 0.497 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.6 | -37.6 | 177.2 | -71.5 | -9.8 | 0 | 0 | 0 | 112.5 | R188 L189 E195 R196 | R188-N192 WeakPolarHBondContact O-CB 3.08Å; R188-N192 PolarHBondContact O-N 2.96Å; L189-N192 PolarHBondContact O-N 3.37Å; N192-E195 PolarHBondContact O-N 2.83Å; N192-R196 WeakPolarHBondContact O-CG 3.17Å; N192-R196 PolarHBondContact O-N 3.05Å; N192-R196 VanDerWaalsContact O-N 3.08Å |
| 193 | A | 98.6 | Very high | 97.8 | Very high | 48 Ų | 48 | 101.7 Ų | 101.7 | 40% | 0.397 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.2 | -46.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L189 L190 A191 E195 R196 T197 | L189-A193 WeakPolarHBondContact O-CB 3.33Å; L189-A193 PolarHBondContact O-N 3.3Å; L190-A193 PolarHBondContact O-N 3.34Å; A191-A193 VanDerWaalsContact C-N 3.34Å; A191-A193 PolarHBondContact O-N 3.06Å; A193-E195 PolarHBondContact O-N 2.75Å; A193-R196 PolarHBondContact O-N 2.8Å; A193-T197 PolarHBondContact O-N 3.39Å; A193-T197 VanDerWaalsContact O-N 3.14Å; A193-T197 PolarHBondContact O-OG1 2.96Å |
| 194 | R | 98.7 | Very high | 98.1 | Very high | 188 Ų | 188 | 101.1 Ų | 101.1 | 71% | 0.709 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61 | -41.8 | 175.5 | -70.7 | 170.5 | -177.8 | -175.2 | 0.9 | 112.4 | L190 A191 R196 T197 R198 | L190-R194 VanDerWaalsContact O-CG 3.31Å; L190-R194 WeakPolarHBondContact O-CG 3.5Å; L190-R194 PolarHBondContact O-N 2.88Å; A191-R194 PolarHBondContact O-N 3.47Å; R194-R196 PolarHBondContact O-N 3.08Å; R194-T197 WeakPolarHBondContact O-CB 3.25Å; R194-T197 PolarHBondContact O-N 3.03Å; R194-R198 PolarHBondContact O-N 3.35Å |
| 195 | E | 98.7 | Very high | 98.2 | Very high | 80 Ų | 80 | 99.4 Ų | 99.4 | 37% | 0.374 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.5 | -38.1 | 179.1 | -179.7 | 55.1 | -161.6 | 0 | 0 | 112 | A191 N192 A193 R198 V199 | A191-E195 PolarHBondContact O-N 3.05Å; N192-E195 PolarHBondContact O-N 2.83Å; A193-E195 PolarHBondContact O-N 2.75Å; E195-R198 WeakPolarHBondContact O-CB 3.49Å; E195-R198 PolarHBondContact O-N 3.48Å; E195-R198 IonicContact OE1-CZ 2.8Å; E195-R198 IonicContact OE1-NE 3.69Å; E195-R198 PolarHBondContact OE1-NE 3.41Å; E195-R198 IonicContact OE1-NH2 3.28Å; E195-R198 PolarHBondContact OE1-NH2 2.89Å; E195-R198 IonicContact OE2-CZ 2.71Å; E195-R198 IonicContact OE2-NE 3.12Å; E195-R198 PolarHBondContact OE2-NE 3.27Å; E195-R198 IonicContact OE2-NH2 2.9Å; E195-V199 WeakPolarHBondContact O-CG2 3.47Å; E195-V199 PolarHBondContact O-N 3.49Å; E195-V199 WeakPolarHBondContact OE1-CG2 3.43Å |
| 196 | R | 98.8 | Very high | 98.3 | Very high | 168 Ų | 168 | 95 Ų | 95 | 63% | 0.634 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -58.5 | -49.1 | 170.4 | -71.1 | 171.6 | -175.4 | 161.2 | 0.1 | 111.1 | N192 A193 R194 R198 V199 H200 | N192-R196 WeakPolarHBondContact O-CG 3.17Å; N192-R196 PolarHBondContact O-N 3.05Å; N192-R196 VanDerWaalsContact O-N 3.08Å; A193-R196 PolarHBondContact O-N 2.8Å; R194-R196 PolarHBondContact O-N 3.08Å; R196-R198 VanDerWaalsContact C-N 3.32Å; R196-R198 PolarHBondContact O-N 3.26Å; R196-V199 PolarHBondContact O-N 3.3Å; R196-H200 PolarHBondContact O-CD2 2.9Å; R196-H200 PolarHBondContact O-N 3.31Å |
| 197 | T | 98.6 | Very high | 98.4 | Very high | 89 Ų | 89 | 95.2 Ų | 95.2 | 55% | 0.546 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -56.9 | -45 | 176.5 | -54.9 | 0 | 0 | 0 | 0 | 111.6 | A193 R194 V199 H200 T201 | A193-T197 PolarHBondContact O-N 3.39Å; A193-T197 VanDerWaalsContact O-N 3.14Å; A193-T197 PolarHBondContact O-OG1 2.96Å; R194-T197 WeakPolarHBondContact O-CB 3.25Å; R194-T197 PolarHBondContact O-N 3.03Å; T197-V199 PolarHBondContact O-N 3.47Å; T197-H200 PolarHBondContact O-N 3.18Å; T197-T201 PolarHBondContact O-N 3.33Å; T197-T201 PolarHBondContact O-OG1 2.8Å; T197-T201 VanDerWaalsContact O-OG1 3.05Å |
| 198 | R | 98.8 | Very high | 98.4 | Very high | 133 Ų | 133 | 90 Ų | 90 | 50% | 0.502 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -58.2 | -46.8 | 175.8 | -165.4 | -171.1 | 72.4 | 94.1 | 3.3 | 111.9 | R194 E195 R196 T201 I202 | R194-R198 PolarHBondContact O-N 3.35Å; E195-R198 WeakPolarHBondContact O-CB 3.49Å; E195-R198 PolarHBondContact O-N 3.48Å; E195-R198 IonicContact OE1-CZ 2.8Å; E195-R198 IonicContact OE1-NE 3.69Å; E195-R198 PolarHBondContact OE1-NE 3.41Å; E195-R198 IonicContact OE1-NH2 3.28Å; E195-R198 PolarHBondContact OE1-NH2 2.89Å; E195-R198 IonicContact OE2-CZ 2.71Å; E195-R198 IonicContact OE2-NE 3.12Å; E195-R198 PolarHBondContact OE2-NE 3.27Å; E195-R198 IonicContact OE2-NH2 2.9Å; R196-R198 VanDerWaalsContact C-N 3.32Å; R196-R198 PolarHBondContact O-N 3.26Å; R198-T201 PolarHBondContact O-N 3.04Å; R198-I202 HydrophobicContact CG-CD1 4.1Å; R198-I202 VanDerWaalsContact O-CG1 3.31Å; R198-I202 WeakPolarHBondContact O-CG1 3.43Å; R198-I202 PolarHBondContact O-N 3.24Å |
| 199 | V | 98.8 | Very high | 98.4 | Very high | 62 Ų | 62 | 85.1 Ų | 85.1 | 38% | 0.376 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -66.2 | -36.6 | 178 | 171.7 | 0 | 0 | 0 | 0 | 112 | E195 R196 T197 S203 | E195-V199 WeakPolarHBondContact O-CG2 3.47Å; E195-V199 PolarHBondContact O-N 3.49Å; E195-V199 WeakPolarHBondContact OE1-CG2 3.43Å; R196-V199 PolarHBondContact O-N 3.3Å; T197-V199 PolarHBondContact O-N 3.47Å; V199-S203 VanDerWaalsContact O-CB 3.3Å; V199-S203 WeakPolarHBondContact O-CB 3.37Å; V199-S203 PolarHBondContact O-N 3.34Å; V199-S203 PolarHBondContact O-OG 3.29Å |
| 200 | H | 98.6 | Very high | 98.3 | Very high | 129 Ų | 129 | 82 Ų | 82 | 60% | 0.597 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -63.3 | -47.3 | 173 | -71.5 | -59 | 0 | 0 | 0 | 111.5 | R196 T197 I202 S203 A204 | R196-H200 PolarHBondContact O-CD2 2.9Å; R196-H200 PolarHBondContact O-N 3.31Å; T197-H200 PolarHBondContact O-N 3.18Å; H200-I202 PolarHBondContact O-N 3.43Å; H200-S203 PolarHBondContact O-N 3.49Å; H200-A204 PolarHBondContact O-N 3.39Å |
| 201 | T | 98.4 | Very high | 98.2 | Very high | 86 Ų | 86 | 83.4 Ų | 83.4 | 53% | 0.528 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -58 | -48.2 | 175.8 | -55 | 0 | 0 | 0 | 0 | 111.7 | T197 R198 S203 A204 A205 | T197-T201 PolarHBondContact O-N 3.33Å; T197-T201 PolarHBondContact O-OG1 2.8Å; T197-T201 VanDerWaalsContact O-OG1 3.05Å; R198-T201 PolarHBondContact O-N 3.04Å; T201-S203 VanDerWaalsContact C-N 3.3Å; T201-S203 PolarHBondContact O-N 3.37Å; T201-A204 PolarHBondContact O-N 2.92Å; T201-A205 PolarHBondContact O-N 2.95Å |
| 202 | I | 98.5 | Very high | 98.2 | Very high | 75 Ų | 75 | 87.1 Ų | 87.1 | 39% | 0.385 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -60.5 | -41.4 | 176.8 | -69.1 | 165.3 | 0 | 0 | 0 | 111 | R198 H200 A205 F206 | R198-I202 HydrophobicContact CG-CD1 4.1Å; R198-I202 VanDerWaalsContact O-CG1 3.31Å; R198-I202 WeakPolarHBondContact O-CG1 3.43Å; R198-I202 PolarHBondContact O-N 3.24Å; H200-I202 PolarHBondContact O-N 3.43Å; I202-A205 PolarHBondContact O-N 3.35Å; I202-F206 WeakPolarHBondContact O-CB 3.5Å; I202-F206 PolarHBondContact O-N 3.03Å |
| 203 | S | 98.4 | Very high | 98.1 | Very high | 47 Ų | 47 | 83 Ų | 83 | 33% | 0.329 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -69.9 | -34.8 | -178.9 | -56.9 | 0 | 0 | 0 | 0 | 112.3 | V199 H200 T201 F206 E207 | V199-S203 VanDerWaalsContact O-CB 3.3Å; V199-S203 WeakPolarHBondContact O-CB 3.37Å; V199-S203 PolarHBondContact O-N 3.34Å; V199-S203 PolarHBondContact O-OG 3.29Å; H200-S203 PolarHBondContact O-N 3.49Å; T201-S203 VanDerWaalsContact C-N 3.3Å; T201-S203 PolarHBondContact O-N 3.37Å; S203-F206 WeakPolarHBondContact O-CB 3.48Å; S203-F206 PolarHBondContact O-N 3.07Å; S203-E207 PolarHBondContact O-N 3.26Å |
| 204 | A | 98 | Very high | 97.9 | Very high | 64 Ų | 64 | 82.8 Ų | 82.8 | 53% | 0.529 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -66.4 | -46.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | H200 T201 F206 E207 A208 | H200-A204 PolarHBondContact O-N 3.39Å; T201-A204 PolarHBondContact O-N 2.92Å; A204-F206 PolarHBondContact O-N 3.44Å; A204-E207 PolarHBondContact O-N 2.87Å; A204-A208 PolarHBondContact O-N 3.01Å |
| 205 | A | 98.4 | Very high | 97.7 | Very high | 47 Ų | 47 | 76 Ų | 76 | 39% | 0.388 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -59.6 | -36 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | T201 I202 A208 L209 | T201-A205 PolarHBondContact O-N 2.95Å; I202-A205 PolarHBondContact O-N 3.35Å; A205-A208 PolarHBondContact O-N 3.32Å; A205-L209 PolarHBondContact O-N 3.37Å |
| 206 | F | 98.4 | Very high | 97.4 | Very high | 32 Ų | 32 | 78.7 Ų | 78.7 | 14% | 0.14 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -68.1 | -39.3 | 177.8 | -149.9 | -88.1 | 0 | 0 | 0 | 113.4 | I202 S203 A204 R210 K224 I227 L228 | I202-F206 WeakPolarHBondContact O-CB 3.5Å; I202-F206 PolarHBondContact O-N 3.03Å; S203-F206 WeakPolarHBondContact O-CB 3.48Å; S203-F206 PolarHBondContact O-N 3.07Å; A204-F206 PolarHBondContact O-N 3.44Å; F206-R210 WeakPolarHBondContact O-CB 3.48Å; F206-R210 PolarHBondContact O-N 2.8Å; F206-K224 HydrophobicContact CD1-CG 4.05Å; F206-K224 HydrophobicContact CE1-CB 3.97Å; F206-K224 HydrophobicContact CE1-CG 3.78Å; F206-K224 HydrophobicContact CE2-CB 4.34Å; F206-K224 HydrophobicContact CE2-CG 4.46Å; F206-K224 VanDerWaalsContact CZ-CA 3.48Å; F206-K224 HydrophobicContact CZ-CB 3.81Å; F206-K224 HydrophobicContact CZ-CG 4.04Å; F206-K224 WeakPolarHBondContact CZ-O 3.38Å; F206-I227 HydrophobicContact CD1-CD1 4.2Å; F206-I227 HydrophobicContact CD1-CG2 4.44Å; F206-I227 HydrophobicContact CE1-CB 3.61Å; F206-I227 HydrophobicContact CE1-CD1 3.54Å; F206-I227 HydrophobicContact CE1-CG1 4.17Å; F206-I227 HydrophobicContact CE1-CG2 3.58Å; F206-I227 HydrophobicContact CE2-CG2 4.45Å; F206-I227 HydrophobicContact CZ-CB 3.68Å; F206-I227 HydrophobicContact CZ-CD1 4.48Å; F206-I227 HydrophobicContact CZ-CG2 3.55Å; F206-L228 HydrophobicContact CE2-CD1 4.47Å; F206-L228 HydrophobicContact CE2-CD2 4.04Å; F206-L228 HydrophobicContact CE2-CG 4.01Å; F206-L228 HydrophobicContact CZ-CG 4.12Å |
| 207 | E | 97.2 | Very high | 97 | Very high | 83 Ų | 83 | 74.1 Ų | 74.1 | 39% | 0.388 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -74.5 | -28.5 | 175.1 | -165.5 | 63.9 | -161.2 | 0 | 0 | 111.8 | S203 A204 R210 K211 | S203-E207 PolarHBondContact O-N 3.26Å; A204-E207 PolarHBondContact O-N 2.87Å; E207-R210 IonicContact OE1-CZ 3.83Å; E207-R210 IonicContact OE1-NE 3.66Å; E207-R210 IonicContact OE1-NH1 2.69Å; E207-R210 PolarHBondContact OE1-NH1 2.9Å; E207-R210 WeakPolarHBondContact OE2-CD 3.46Å; E207-R210 IonicContact OE2-NH1 2.68Å; E207-R210 PolarHBondContact OE2-NH1 2.84Å; E207-K211 WeakPolarHBondContact O-CG 3.3Å; E207-K211 PolarHBondContact O-N 3.28Å |
| 208 | A | 97.6 | Very high | 96.4 | Very high | 50 Ų | 50 | 79 Ų | 79 | 41% | 0.413 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -64.8 | -50.3 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | A204 A205 R210 K211 | A204-A208 PolarHBondContact O-N 3.01Å; A205-A208 PolarHBondContact O-N 3.32Å; A208-R210 VanDerWaalsContact C-N 3.28Å; A208-R210 PolarHBondContact O-N 2.98Å; A208-K211 PolarHBondContact O-N 3.44Å; A208-K211 VanDerWaalsContact O-N 3.15Å |
| 209 | L | 98.2 | Very high | 95.8 | Very high | 62 Ų | 62 | 75.2 Ų | 75.2 | 33% | 0.325 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -54.9 | -45 | 174.4 | 175 | 60.6 | 0 | 0 | 0 | 111.4 | A205 K211 Q212 V213 I227 L228 A231 | A205-L209 PolarHBondContact O-N 3.37Å; L209-K211 VanDerWaalsContact C-N 3.26Å; L209-K211 PolarHBondContact O-N 2.89Å; L209-Q212 PolarHBondContact O-N 3.01Å; L209-V213 HydrophobicContact CD1-CG2 4.08Å; L209-V213 HydrophobicContact CG-CG2 4.22Å; L209-V213 WeakPolarHBondContact O-CG2 3.41Å; L209-V213 PolarHBondContact O-N 2.71Å; L209-I227 HydrophobicContact CD2-CG2 3.81Å; L209-I227 HydrophobicContact CG-CG2 3.88Å; L209-L228 HydrophobicContact CD2-CD2 4.33Å; L209-A231 HydrophobicContact CD1-CB 4.18Å |
| 210 | R | 97.1 | Very high | 95.4 | Very high | 41 Ų | 41 | 74 Ų | 74 | 16% | 0.155 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -54.8 | -38.5 | 179 | -178.5 | -178.9 | 173.6 | -171.3 | -20.2 | 113.7 | F206 E207 A208 Q212 V213 Q220 I227 | F206-R210 WeakPolarHBondContact O-CB 3.48Å; F206-R210 PolarHBondContact O-N 2.8Å; E207-R210 IonicContact OE1-CZ 3.83Å; E207-R210 IonicContact OE1-NE 3.66Å; E207-R210 IonicContact OE1-NH1 2.69Å; E207-R210 PolarHBondContact OE1-NH1 2.9Å; E207-R210 WeakPolarHBondContact OE2-CD 3.46Å; E207-R210 IonicContact OE2-NH1 2.68Å; E207-R210 PolarHBondContact OE2-NH1 2.84Å; A208-R210 VanDerWaalsContact C-N 3.28Å; A208-R210 PolarHBondContact O-N 2.98Å; R210-Q212 PolarHBondContact O-N 3.35Å; R210-V213 PolarHBondContact O-N 2.9Å; R210-Q220 VanDerWaalsContact NH2-C 3.29Å; R210-Q220 PolarHBondContact NH2-O 3.42Å; R210-I227 HydrophobicContact CB-CD1 3.78Å; R210-I227 HydrophobicContact CB-CG1 4.31Å; R210-I227 HydrophobicContact CG-CD1 3.64Å; R210-I227 HydrophobicContact CG-CG1 4.17Å |
| 211 | K | 96.1 | Very high | 95 | Very high | 123 Ų | 123 | 75.6 Ų | 75.6 | 54% | 0.535 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -65.8 | -25.8 | 179.2 | -69.4 | 169.4 | -177.9 | 180 | 0 | 112.7 | E207 A208 L209 | E207-K211 WeakPolarHBondContact O-CG 3.3Å; E207-K211 PolarHBondContact O-N 3.28Å; A208-K211 PolarHBondContact O-N 3.44Å; A208-K211 VanDerWaalsContact O-N 3.15Å; L209-K211 VanDerWaalsContact C-N 3.26Å; L209-K211 PolarHBondContact O-N 2.89Å |
| 212 | Q | 97.1 | Very high | 94.7 | Very high | 129 Ų | 129 | 72.7 Ų | 72.7 | 60% | 0.603 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -90 | -8 | 178 | -50.3 | -52.3 | 99.8 | 0 | 0 | 113.2 | L209 R210 | L209-Q212 PolarHBondContact O-N 3.01Å; R210-Q212 PolarHBondContact O-N 3.35Å |
| 213 | V | 96.4 | Very high | 94.6 | Very high | 7 Ų | 7 | 71.9 Ų | 71.9 | 4% | 0.042 | 39% | 0.391 | C | S | . | . | S | Bend | trans | -95.1 | 130.5 | -174.6 | 167.5 | 0 | 0 | 0 | 0 | 110.9 | L209 R210 C215 I227 I230 A231 | L209-V213 HydrophobicContact CD1-CG2 4.08Å; L209-V213 HydrophobicContact CG-CG2 4.22Å; L209-V213 WeakPolarHBondContact O-CG2 3.41Å; L209-V213 PolarHBondContact O-N 2.71Å; R210-V213 PolarHBondContact O-N 2.9Å; V213-C215 PolarHBondContact O-N 2.99Å; V213-I227 HydrophobicContact CG2-CG2 4.39Å; V213-I230 HydrophobicContact CG1-CB 3.67Å; V213-I230 HydrophobicContact CG1-CD1 4.48Å; V213-I230 HydrophobicContact CG1-CG2 3.5Å; V213-A231 HydrophobicContact CG2-CB 3.8Å |
| 214 | P | 95.6 | Very high | 94.5 | Very high | 43 Ų | 43 | 75.3 Ų | 75.3 | 28% | 0.279 | 40% | 0.4 | S | S | . | . | trans | -55.3 | 134.2 | 177.4 | -27.7 | 34.8 | 0 | 0 | 0 | 113.3 | Y234 | P214-Y234 VanDerWaalsContact CD-CD1 3.44Å; P214-Y234 HydrophobicContact CG-CD1 3.83Å; P214-Y234 HydrophobicContact CG-CD2 3.66Å; P214-Y234 HydrophobicContact CG-CE1 3.94Å; P214-Y234 HydrophobicContact CG-CE2 3.8Å; P214-Y234 HydrophobicContact CG-CG 3.68Å | ||
| 215 | C | 93.9 | Very high | 94.4 | Very high | 47 Ų | 47 | 76.8 Ų | 76.8 | 32% | 0.318 | 40% | 0.398 | S | S | . | . | trans | -151 | 163.5 | 177.6 | 58.6 | 0 | 0 | 0 | 0 | 111.6 | V213 S217 L222 | V213-C215 PolarHBondContact O-N 2.99Å; C215-S217 VanDerWaalsContact C-N 3.29Å; C215-S217 PolarHBondContact O-N 3.48Å; C215-S217 PolarHBondContact SG-O 3.36Å; C215-S217 VanDerWaalsContact SG-O 3.37Å; C215-L222 HydrophobicContact CB-CD1 4.3Å | ||
| 216 | Y | 92.1 | Very high | 94.3 | Very high | 136 Ų | 136 | 74.6 Ų | 74.6 | 53% | 0.533 | 38% | 0.38 | S | S | . | . | S | Bend | trans | -74.7 | -19.1 | -179.5 | -67.2 | -62.4 | 0 | 0 | 0 | 113.7 | L266 Q267 | Y216-L266 HydrophobicContact CD1-CD2 4.38Å; Y216-L266 HydrophobicContact CD2-CD1 4.25Å; Y216-L266 HydrophobicContact CD2-CD2 4.36Å; Y216-L266 HydrophobicContact CD2-CG 4.09Å; Y216-L266 HydrophobicContact CE1-CD2 4.07Å; Y216-L266 HydrophobicContact CE1-CG 4.48Å; Y216-L266 HydrophobicContact CE2-CD1 4.19Å; Y216-L266 HydrophobicContact CE2-CD2 4.07Å; Y216-L266 HydrophobicContact CE2-CG 3.62Å; Y216-Q267 WeakPolarHBondContact OH-CG 3.31Å |
| 217 | S | 90.1 | Very high | 94.2 | Very high | 72 Ų | 72 | 73.2 Ų | 73.2 | 50% | 0.503 | 37% | 0.374 | S | S | . | . | trans | -158.2 | 136.9 | 178.2 | 176.8 | 0 | 0 | 0 | 0 | 109.1 | C215 G219 Q220 | C215-S217 VanDerWaalsContact C-N 3.29Å; C215-S217 PolarHBondContact O-N 3.48Å; C215-S217 PolarHBondContact SG-O 3.36Å; C215-S217 VanDerWaalsContact SG-O 3.37Å; S217-G219 PolarHBondContact O-N 3.3Å; S217-G219 VanDerWaalsContact O-N 3.08Å; S217-Q220 WeakPolarHBondContact O-CB 3.35Å; S217-Q220 PolarHBondContact O-N 3.42Å | ||
| 218 | Y | 87.3 | Confident | 94.3 | Very high | 190 Ų | 190 | 73.5 Ų | 73.5 | 75% | 0.745 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.1 | -33.4 | 177.4 | -174.9 | -107.5 | 0 | 0 | 0 | 113.1 | Q220 | Y218-Q220 VanDerWaalsContact C-N 3.35Å; Y218-Q220 PolarHBondContact O-N 3Å |
| 219 | G | 85.4 | Confident | 94.2 | Very high | 55 Ų | 55 | 77 Ų | 77 | 57% | 0.567 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.9 | -3.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | S217 K221 | S217-G219 PolarHBondContact O-N 3.3Å; S217-G219 VanDerWaalsContact O-N 3.08Å; G219-K221 PolarHBondContact O-N 3.13Å |
| 220 | Q | 90.2 | Very high | 94.2 | Very high | 36 Ų | 36 | 74 Ų | 74 | 17% | 0.168 | 37% | 0.365 | C | S | . | . | trans | -65.7 | 107 | -172.6 | -177.9 | -179 | -13.5 | 0 | 0 | 111.5 | R210 S217 Y218 L222 | R210-Q220 VanDerWaalsContact NH2-C 3.29Å; R210-Q220 PolarHBondContact NH2-O 3.42Å; S217-Q220 WeakPolarHBondContact O-CB 3.35Å; S217-Q220 PolarHBondContact O-N 3.42Å; Y218-Q220 VanDerWaalsContact C-N 3.35Å; Y218-Q220 PolarHBondContact O-N 3Å; Q220-L222 HydrophobicContact CG-CD2 4.21Å; Q220-L222 HydrophobicContact CG-CG 4.41Å; Q220-L222 PolarHBondContact O-N 3.32Å | ||
| 221 | K | 90.6 | Very high | 94.2 | Very high | 162 Ų | 162 | 72.5 Ų | 72.5 | 70% | 0.704 | 36% | 0.361 | S | S | * | . | trans | -65.5 | 98.3 | 173.3 | -66.2 | -172.7 | 178.6 | -177.3 | 0 | 110.9 | G219 | G219-K221 PolarHBondContact O-N 3.13Š| ||
| 222 | L | 92.8 | Very high | 94.3 | Very high | 25 Ų | 25 | 70.2 Ų | 70.2 | 13% | 0.131 | 36% | 0.36 | C | S | . | . | trans | -87.3 | 156.2 | 170.2 | -64.8 | 173.8 | 0 | 0 | 0 | 111.1 | C215 Q220 A226 I227 I230 | C215-L222 HydrophobicContact CB-CD1 4.3Å; Q220-L222 HydrophobicContact CG-CD2 4.21Å; Q220-L222 HydrophobicContact CG-CG 4.41Å; Q220-L222 PolarHBondContact O-N 3.32Å; L222-A226 HydrophobicContact CB-CB 4.29Å; L222-A226 HydrophobicContact CD2-CB 4.42Å; L222-I227 HydrophobicContact CB-CD1 3.71Å; L222-I227 HydrophobicContact CB-CG1 3.66Å; L222-I227 HydrophobicContact CD1-CD1 4.48Å; L222-I227 HydrophobicContact CD1-CG1 3.79Å; L222-I227 HydrophobicContact CG-CG1 4.39Å; L222-I230 HydrophobicContact CD1-CD1 4.11Å; L222-I230 HydrophobicContact CD2-CD1 4.31Å | ||
| 223 | S | 95.5 | Very high | 94.2 | Very high | 59 Ų | 59 | 65.4 Ų | 65.4 | 41% | 0.413 | 34% | 0.338 | S | S | . | . | trans | -82.5 | 166 | 174 | 79.7 | 0 | 0 | 0 | 0 | 111.6 | L225 A226 I227 | S223-L225 VanDerWaalsContact C-N 3.31Å; S223-L225 PolarHBondContact O-N 3.47Å; S223-L225 PolarHBondContact OG-N 2.96Å; S223-A226 PolarHBondContact O-N 2.94Å; S223-A226 VanDerWaalsContact OG-CB 3.32Å; S223-A226 WeakPolarHBondContact OG-CB 3.32Å; S223-A226 PolarHBondContact OG-N 3.36Å; S223-I227 PolarHBondContact O-N 3.05Å | ||
| 224 | K | 96.4 | Very high | 94.2 | Very high | 118 Ų | 118 | 69.1 Ų | 69.1 | 51% | 0.513 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -61.1 | -40 | 173.9 | -67.7 | -170.6 | 176.6 | -175.9 | 0 | 112.3 | F206 L228 | F206-K224 HydrophobicContact CD1-CG 4.05Å; F206-K224 HydrophobicContact CE1-CB 3.97Å; F206-K224 HydrophobicContact CE1-CG 3.78Å; F206-K224 HydrophobicContact CE2-CB 4.34Å; F206-K224 HydrophobicContact CE2-CG 4.46Å; F206-K224 VanDerWaalsContact CZ-CA 3.48Å; F206-K224 HydrophobicContact CZ-CB 3.81Å; F206-K224 HydrophobicContact CZ-CG 4.04Å; F206-K224 WeakPolarHBondContact CZ-O 3.38Å; K224-L228 WeakPolarHBondContact O-CG 3.44Å; K224-L228 PolarHBondContact O-N 3.28Å |
| 225 | L | 96.6 | Very high | 94.3 | Very high | 96 Ų | 96 | 72 Ų | 72 | 50% | 0.503 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -68 | -39.4 | 176.9 | -175.6 | 58.8 | 0 | 0 | 0 | 111.9 | S223 L228 R229 | S223-L225 VanDerWaalsContact C-N 3.31Å; S223-L225 PolarHBondContact O-N 3.47Å; S223-L225 PolarHBondContact OG-N 2.96Å; L225-L228 PolarHBondContact O-N 3.39Å; L225-R229 HydrophobicContact CD1-CG 4.35Å; L225-R229 HydrophobicContact CG-CG 4.49Å; L225-R229 WeakPolarHBondContact O-CB 3.39Å; L225-R229 VanDerWaalsContact O-CG 3.32Å; L225-R229 WeakPolarHBondContact O-CG 3.2Å; L225-R229 PolarHBondContact O-N 3.26Å |
| 226 | A | 95.8 | Very high | 94.2 | Very high | 1 Ų | 1 | 73 Ų | 73 | 1% | 0.008 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -61.5 | -48.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | L222 S223 L228 R229 I230 E269 | L222-A226 HydrophobicContact CB-CB 4.29Å; L222-A226 HydrophobicContact CD2-CB 4.42Å; S223-A226 PolarHBondContact O-N 2.94Å; S223-A226 VanDerWaalsContact OG-CB 3.32Å; S223-A226 WeakPolarHBondContact OG-CB 3.32Å; S223-A226 PolarHBondContact OG-N 3.36Å; A226-L228 VanDerWaalsContact C-N 3.34Å; A226-L228 PolarHBondContact O-N 3.38Å; A226-R229 PolarHBondContact O-N 3.49Å; A226-I230 WeakPolarHBondContact O-CD1 3.32Å; A226-I230 VanDerWaalsContact O-CG1 3.25Å; A226-I230 WeakPolarHBondContact O-CG1 3.49Å; A226-I230 PolarHBondContact O-N 3.02Å; A226-E269 HydrophobicContact CB-CB 3.79Å; A226-E269 HydrophobicContact CB-CG 3.65Å; A226-E269 WeakPolarHBondContact CB-OE2 3.47Å |
| 227 | I | 96.9 | Very high | 94.3 | Very high | 3 Ų | 3 | 66.9 Ų | 66.9 | 2% | 0.015 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -61.6 | -42.5 | -179.6 | -77.4 | 155 | 0 | 0 | 0 | 111.1 | F206 L209 R210 V213 L222 S223 A231 | F206-I227 HydrophobicContact CD1-CD1 4.2Å; F206-I227 HydrophobicContact CD1-CG2 4.44Å; F206-I227 HydrophobicContact CE1-CB 3.61Å; F206-I227 HydrophobicContact CE1-CD1 3.54Å; F206-I227 HydrophobicContact CE1-CG1 4.17Å; F206-I227 HydrophobicContact CE1-CG2 3.58Å; F206-I227 HydrophobicContact CE2-CG2 4.45Å; F206-I227 HydrophobicContact CZ-CB 3.68Å; F206-I227 HydrophobicContact CZ-CD1 4.48Å; F206-I227 HydrophobicContact CZ-CG2 3.55Å; L209-I227 HydrophobicContact CD2-CG2 3.81Å; L209-I227 HydrophobicContact CG-CG2 3.88Å; R210-I227 HydrophobicContact CB-CD1 3.78Å; R210-I227 HydrophobicContact CB-CG1 4.31Å; R210-I227 HydrophobicContact CG-CD1 3.64Å; R210-I227 HydrophobicContact CG-CG1 4.17Å; V213-I227 HydrophobicContact CG2-CG2 4.39Å; L222-I227 HydrophobicContact CB-CD1 3.71Å; L222-I227 HydrophobicContact CB-CG1 3.66Å; L222-I227 HydrophobicContact CD1-CD1 4.48Å; L222-I227 HydrophobicContact CD1-CG1 3.79Å; L222-I227 HydrophobicContact CG-CG1 4.39Å; S223-I227 PolarHBondContact O-N 3.05Å; I227-A231 WeakPolarHBondContact O-CB 3.44Å; I227-A231 PolarHBondContact O-N 2.94Å |
| 228 | L | 98.1 | Very high | 94.6 | Very high | 88 Ų | 88 | 67 Ų | 67 | 46% | 0.461 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -62.4 | -47.7 | 174.8 | -67.7 | 173.4 | 0 | 0 | 0 | 111.8 | F206 L209 K224 L225 A226 I230 A231 C232 | F206-L228 HydrophobicContact CE2-CD1 4.47Å; F206-L228 HydrophobicContact CE2-CD2 4.04Å; F206-L228 HydrophobicContact CE2-CG 4.01Å; F206-L228 HydrophobicContact CZ-CG 4.12Å; L209-L228 HydrophobicContact CD2-CD2 4.33Å; K224-L228 WeakPolarHBondContact O-CG 3.44Å; K224-L228 PolarHBondContact O-N 3.28Å; L225-L228 PolarHBondContact O-N 3.39Å; A226-L228 VanDerWaalsContact C-N 3.34Å; A226-L228 PolarHBondContact O-N 3.38Å; L228-I230 PolarHBondContact O-N 3.29Å; L228-A231 PolarHBondContact O-N 3.24Å; L228-C232 PolarHBondContact O-N 3.45Å; L228-C232 PolarHBondContact O-SG 2.98Å |
| 229 | R | 96.9 | Very high | 94.9 | Very high | 123 Ų | 123 | 58.3 Ų | 58.3 | 46% | 0.464 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -60.2 | -47.5 | 179.4 | -76 | 173.2 | 167.9 | 179.4 | -7.8 | 112.8 | L225 A226 C232 N233 T265 E269 | L225-R229 HydrophobicContact CD1-CG 4.35Å; L225-R229 HydrophobicContact CG-CG 4.49Å; L225-R229 WeakPolarHBondContact O-CB 3.39Å; L225-R229 VanDerWaalsContact O-CG 3.32Å; L225-R229 WeakPolarHBondContact O-CG 3.2Å; L225-R229 PolarHBondContact O-N 3.26Å; A226-R229 PolarHBondContact O-N 3.49Å; R229-C232 PolarHBondContact O-N 3.21Å; R229-N233 PolarHBondContact O-N 2.85Å; R229-N233 PolarHBondContact O-ND2 2.9Å; R229-T265 HydrophobicContact CB-CG2 3.91Å; R229-E269 WeakPolarHBondContact CD-OE1 3.31Å; R229-E269 IonicContact CZ-OE1 2.8Å; R229-E269 IonicContact NH1-OE1 3Å; R229-E269 PolarHBondContact NH1-OE1 3.18Å |
| 230 | I | 97 | Very high | 95.1 | Very high | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -68.4 | -40.4 | -179.4 | -57.4 | 159.3 | 0 | 0 | 0 | 109.7 | V213 L222 A226 L228 C232 N233 Y234 T265 L266 | V213-I230 HydrophobicContact CG1-CB 3.67Å; V213-I230 HydrophobicContact CG1-CD1 4.48Å; V213-I230 HydrophobicContact CG1-CG2 3.5Å; L222-I230 HydrophobicContact CD1-CD1 4.11Å; L222-I230 HydrophobicContact CD2-CD1 4.31Å; A226-I230 WeakPolarHBondContact O-CD1 3.32Å; A226-I230 VanDerWaalsContact O-CG1 3.25Å; A226-I230 WeakPolarHBondContact O-CG1 3.49Å; A226-I230 PolarHBondContact O-N 3.02Å; L228-I230 PolarHBondContact O-N 3.29Å; I230-C232 PolarHBondContact O-N 3.14Å; I230-N233 PolarHBondContact O-N 3.18Å; I230-Y234 VanDerWaalsContact O-CB 3.3Å; I230-Y234 WeakPolarHBondContact O-CB 3.4Å; I230-Y234 PolarHBondContact O-N 3.36Å; I230-T265 HydrophobicContact CG1-CG2 3.82Å; I230-L266 HydrophobicContact CD1-CD1 3.99Å |
| 231 | A | 98.2 | Very high | 95.1 | Very high | 9 Ų | 9 | 61.3 Ų | 61.3 | 7% | 0.074 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -56.9 | -47 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L209 V213 I227 L228 N233 Y234 I235 | L209-A231 HydrophobicContact CD1-CB 4.18Å; V213-A231 HydrophobicContact CG2-CB 3.8Å; I227-A231 WeakPolarHBondContact O-CB 3.44Å; I227-A231 PolarHBondContact O-N 2.94Å; L228-A231 PolarHBondContact O-N 3.24Å; A231-N233 PolarHBondContact O-N 2.98Å; A231-Y234 PolarHBondContact O-N 2.71Å; A231-I235 VanDerWaalsContact O-CG1 3.29Å; A231-I235 WeakPolarHBondContact O-CG1 3.37Å; A231-I235 PolarHBondContact O-N 2.92Å |
| 232 | C | 96.4 | Very high | 95.3 | Very high | 75 Ų | 75 | 56.5 Ų | 56.5 | 51% | 0.507 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -59.9 | -48.2 | 178.1 | -63.7 | 0 | 0 | 0 | 0 | 112.4 | L228 R229 I230 Y234 I235 L236 | L228-C232 PolarHBondContact O-N 3.45Å; L228-C232 PolarHBondContact O-SG 2.98Å; R229-C232 PolarHBondContact O-N 3.21Å; I230-C232 PolarHBondContact O-N 3.14Å; C232-Y234 VanDerWaalsContact C-N 3.3Å; C232-Y234 PolarHBondContact O-N 2.92Å; C232-I235 PolarHBondContact O-N 3.26Å; C232-L236 WeakPolarHBondContact O-CG 3.49Å; C232-L236 PolarHBondContact O-N 3.5Å |
| 233 | N | 96.1 | Very high | 95 | Very high | 28 Ų | 28 | 64.2 Ų | 64.2 | 15% | 0.15 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -64 | -35.9 | 178.3 | -74.7 | -95.3 | 0 | 0 | 0 | 112 | R229 I230 A231 S237 C262 | R229-N233 PolarHBondContact O-N 2.85Å; R229-N233 PolarHBondContact O-ND2 2.9Å; I230-N233 PolarHBondContact O-N 3.18Å; A231-N233 PolarHBondContact O-N 2.98Å; N233-S237 WeakPolarHBondContact O-CB 3.49Å; N233-S237 PolarHBondContact O-N 3Å; N233-S237 PolarHBondContact O-OG 3.46Å; N233-C262 HydrophobicContact CB-CB 3.83Å |
| 234 | Y | 97.4 | Very high | 94.5 | Very high | 85 Ų | 85 | 65.6 Ų | 65.6 | 33% | 0.333 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -70.5 | -43.4 | 178.9 | -175.5 | -134.7 | 0 | 0 | 0 | 111.9 | P214 I230 A231 C232 L236 S237 L238 | P214-Y234 VanDerWaalsContact CD-CD1 3.44Å; P214-Y234 HydrophobicContact CG-CD1 3.83Å; P214-Y234 HydrophobicContact CG-CD2 3.66Å; P214-Y234 HydrophobicContact CG-CE1 3.94Å; P214-Y234 HydrophobicContact CG-CE2 3.8Å; P214-Y234 HydrophobicContact CG-CG 3.68Å; I230-Y234 VanDerWaalsContact O-CB 3.3Å; I230-Y234 WeakPolarHBondContact O-CB 3.4Å; I230-Y234 PolarHBondContact O-N 3.36Å; A231-Y234 PolarHBondContact O-N 2.71Å; C232-Y234 VanDerWaalsContact C-N 3.3Å; C232-Y234 PolarHBondContact O-N 2.92Å; Y234-L236 VanDerWaalsContact C-N 3.35Å; Y234-L236 PolarHBondContact O-N 3.45Å; Y234-S237 PolarHBondContact O-N 3.28Å; Y234-L238 HydrophobicContact CD1-CD1 4.15Å; Y234-L238 HydrophobicContact CD2-CD1 4.34Å; Y234-L238 HydrophobicContact CD2-CG 4.13Å; Y234-L238 HydrophobicContact CE1-CD1 3.78Å; Y234-L238 HydrophobicContact CE2-CD1 3.96Å; Y234-L238 HydrophobicContact CE2-CD2 3.92Å; Y234-L238 HydrophobicContact CE2-CG 3.82Å; Y234-L238 HydrophobicContact CG-CD1 4.42Å; Y234-L238 WeakPolarHBondContact O-CG 3.5Å; Y234-L238 PolarHBondContact O-N 2.8Å |
| 235 | I | 96.1 | Very high | 93.6 | Very high | 104 Ų | 104 | 63.5 Ų | 63.5 | 53% | 0.533 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -58.8 | -46.5 | 173.6 | -68.9 | 165 | 0 | 0 | 0 | 110.4 | A231 C232 S237 L238 A239 | A231-I235 VanDerWaalsContact O-CG1 3.29Å; A231-I235 WeakPolarHBondContact O-CG1 3.37Å; A231-I235 PolarHBondContact O-N 2.92Å; C232-I235 PolarHBondContact O-N 3.26Å; I235-S237 VanDerWaalsContact C-N 3.33Å; I235-S237 PolarHBondContact O-N 2.99Å; I235-L238 PolarHBondContact O-N 3.15Å; I235-A239 WeakPolarHBondContact O-CB 3.4Å; I235-A239 PolarHBondContact O-N 3.33Å |
| 236 | L | 92.9 | Very high | 92.5 | Very high | 69 Ų | 69 | 66.1 Ų | 66.1 | 36% | 0.361 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -60.8 | -41.6 | 176.3 | -70.2 | 170.3 | 0 | 0 | 0 | 112 | C232 Y234 A239 H240 C258 | C232-L236 WeakPolarHBondContact O-CG 3.49Å; C232-L236 PolarHBondContact O-N 3.5Å; Y234-L236 VanDerWaalsContact C-N 3.35Å; Y234-L236 PolarHBondContact O-N 3.45Å; L236-A239 PolarHBondContact O-N 3.19Å; L236-H240 PolarHBondContact O-N 3.06Å; L236-H240 VanDerWaalsContact O-N 3.09Å; L236-H240 PolarHBondContact O-ND1 3.31Å; L236-C258 VanDerWaalsContact C-SG 3.59Å; L236-C258 VanDerWaalsContact CB-SG 3.57Å |
| 237 | S | 94.3 | Very high | 91.2 | Very high | 6 Ų | 6 | 67.4 Ų | 67.4 | 4% | 0.042 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64.6 | -42.9 | 177.6 | -57.3 | 0 | 0 | 0 | 0 | 112 | N233 Y234 I235 L241 F255 C258 | N233-S237 WeakPolarHBondContact O-CB 3.49Å; N233-S237 PolarHBondContact O-N 3Å; N233-S237 PolarHBondContact O-OG 3.46Å; Y234-S237 PolarHBondContact O-N 3.28Å; I235-S237 VanDerWaalsContact C-N 3.33Å; I235-S237 PolarHBondContact O-N 2.99Å; S237-L241 PolarHBondContact O-N 3.47Å; S237-L241 VanDerWaalsContact O-N 3.12Å; S237-F255 WeakPolarHBondContact O-CD2 3.32Å; S237-F255 WeakPolarHBondContact O-CE2 3.37Å; S237-C258 VanDerWaalsContact OG-C 3.32Å; S237-C258 PolarHBondContact OG-O 3.44Å |
| 238 | L | 95.4 | Very high | 89.8 | Confident | 75 Ų | 75 | 72.9 Ų | 72.9 | 39% | 0.393 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -66.9 | -35.8 | 176.1 | -70.4 | 177.6 | 0 | 0 | 0 | 112.3 | Y234 I235 L241 A242 | Y234-L238 HydrophobicContact CD1-CD1 4.15Å; Y234-L238 HydrophobicContact CD2-CD1 4.34Å; Y234-L238 HydrophobicContact CD2-CG 4.13Å; Y234-L238 HydrophobicContact CE1-CD1 3.78Å; Y234-L238 HydrophobicContact CE2-CD1 3.96Å; Y234-L238 HydrophobicContact CE2-CD2 3.92Å; Y234-L238 HydrophobicContact CE2-CG 3.82Å; Y234-L238 HydrophobicContact CG-CD1 4.42Å; Y234-L238 WeakPolarHBondContact O-CG 3.5Å; Y234-L238 PolarHBondContact O-N 2.8Å; I235-L238 PolarHBondContact O-N 3.15Å; L238-L241 WeakPolarHBondContact O-CB 3.41Å; L238-L241 PolarHBondContact O-N 2.91Å; L238-A242 WeakPolarHBondContact O-CB 3.31Å; L238-A242 PolarHBondContact O-N 3.46Å |
| 239 | A | 93.1 | Very high | 88.5 | Confident | 7 Ų | 7 | 74.9 Ų | 74.9 | 6% | 0.058 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -63.8 | -46.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | I235 L236 L241 A242 E243 L244 Y246 | I235-A239 WeakPolarHBondContact O-CB 3.4Å; I235-A239 PolarHBondContact O-N 3.33Å; L236-A239 PolarHBondContact O-N 3.19Å; A239-L241 VanDerWaalsContact C-N 3.27Å; A239-L241 PolarHBondContact O-N 2.75Å; A239-A242 CarbonylContact O-C 3.58Å; A239-A242 WeakPolarHBondContact O-CA 3.36Å; A239-A242 PolarHBondContact O-N 3.44Å; A239-E243 PolarHBondContact O-N 3.08Å; A239-E243 VanDerWaalsContact O-N 3.12Å; A239-L244 CarbonylContact C-O 3.38Å; A239-L244 HydrophobicContact CB-CB 4.25Å; A239-L244 PolarHBondContact O-N 3.29Å; A239-Y246 HydrophobicContact CB-CD2 3.46Å; A239-Y246 VanDerWaalsContact CB-CD2 3.46Å; A239-Y246 HydrophobicContact CB-CE2 3.49Å; A239-Y246 VanDerWaalsContact CB-CE2 3.49Å |
| 240 | H | 90.2 | Very high | 86.9 | Confident | 44 Ų | 44 | 76 Ų | 76 | 20% | 0.204 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -64.7 | -31.5 | 175.9 | -72.4 | 74.9 | 0 | 0 | 0 | 112.4 | L236 A242 E243 V253 F255 | L236-H240 PolarHBondContact O-N 3.06Å; L236-H240 VanDerWaalsContact O-N 3.09Å; L236-H240 PolarHBondContact O-ND1 3.31Å; H240-A242 VanDerWaalsContact C-N 3.31Å; H240-E243 PolarHBondContact O-N 3.47Å; H240-V253 PolarHBondContact CD2-O 3.27Å; H240-V253 PolarHBondContact NE2-O 3.32Å; H240-V253 VanDerWaalsContact NE2-O 3.08Å; H240-F255 HydrophobicContact CB-CB 4.23Å; H240-F255 HydrophobicContact CB-CD2 4.29Å |
| 241 | L | 91.4 | Very high | 85.4 | Confident | 111 Ų | 111 | 79.6 Ų | 79.6 | 58% | 0.581 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -69.4 | -28.6 | 172.3 | -175.3 | 60.6 | 0 | 0 | 0 | 113 | S237 L238 A239 F255 | S237-L241 PolarHBondContact O-N 3.47Å; S237-L241 VanDerWaalsContact O-N 3.12Å; L238-L241 WeakPolarHBondContact O-CB 3.41Å; L238-L241 PolarHBondContact O-N 2.91Å; A239-L241 VanDerWaalsContact C-N 3.27Å; A239-L241 PolarHBondContact O-N 2.75Å; L241-F255 HydrophobicContact CB-CD2 4.06Å; L241-F255 HydrophobicContact CB-CE2 3.76Å; L241-F255 HydrophobicContact CB-CZ 4.46Å; L241-F255 HydrophobicContact CD1-CE2 4.24Å; L241-F255 HydrophobicContact CD1-CZ 4.14Å; L241-F255 HydrophobicContact CD2-CE2 4.44Å; L241-F255 HydrophobicContact CG-CE2 4.37Å |
| 242 | A | 93.4 | Very high | 84 | Confident | 61 Ų | 61 | 83.5 Ų | 83.5 | 50% | 0.504 | 45% | 0.451 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.8 | 11.4 | 178 | 0 | 0 | 0 | 0 | 0 | 113.2 | L238 A239 H240 L244 | L238-A242 WeakPolarHBondContact O-CB 3.31Å; L238-A242 PolarHBondContact O-N 3.46Å; A239-A242 CarbonylContact O-C 3.58Å; A239-A242 WeakPolarHBondContact O-CA 3.36Å; A239-A242 PolarHBondContact O-N 3.44Å; H240-A242 VanDerWaalsContact C-N 3.31Å; A242-L244 HydrophobicContact CB-CD1 4.21Å; A242-L244 HydrophobicContact CB-CG 4.2Å; A242-L244 PolarHBondContact O-N 2.91Å; A242-L244 VanDerWaalsContact O-N 3.14Å |
| 243 | E | 87.4 | Confident | 83.2 | Confident | 186 Ų | 186 | 82.3 Ų | 82.3 | 87% | 0.869 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57 | 24.9 | -177.9 | -58.2 | 177.4 | -167.7 | 0 | 0 | 113.9 | A239 H240 | A239-E243 PolarHBondContact O-N 3.08Å; A239-E243 VanDerWaalsContact O-N 3.12Å; H240-E243 PolarHBondContact O-N 3.47Å |
| 244 | L | 85.3 | Confident | 82.8 | Confident | 89 Ų | 89 | 83.6 Ų | 83.6 | 47% | 0.466 | 45% | 0.453 | S | S | . | . | trans | -94 | 114.7 | 176.9 | -65.2 | 175.4 | 0 | 0 | 0 | 110.7 | A239 A242 Y246 | A239-L244 CarbonylContact C-O 3.38Å; A239-L244 HydrophobicContact CB-CB 4.25Å; A239-L244 PolarHBondContact O-N 3.29Å; A242-L244 HydrophobicContact CB-CD1 4.21Å; A242-L244 HydrophobicContact CB-CG 4.2Å; A242-L244 PolarHBondContact O-N 2.91Å; A242-L244 VanDerWaalsContact O-N 3.14Å; L244-Y246 HydrophobicContact CB-CD2 4.3Å; L244-Y246 HydrophobicContact CB-CE2 3.79Å; L244-Y246 HydrophobicContact CD1-CE2 4.3Å | ||
| 245 | D | 75.6 | Confident | 82.5 | Confident | 73 Ų | 73 | 83.9 Ų | 83.9 | 39% | 0.39 | 46% | 0.456 | S | S | . | . | trans | -85.9 | 117.1 | 175.9 | -163.2 | 1.7 | 0 | 0 | 0 | 111.8 | S247 H250 | D245-S247 WeakPolarHBondContact OD1-CA 3.5Å; D245-S247 WeakPolarHBondContact OD1-CB 3.4Å; D245-S247 PolarHBondContact OD1-N 2.93Å; D245-H250 IonicContact OD2-CE1 3.46Å; D245-H250 IonicContact OD2-CG 3.55Å; D245-H250 IonicContact OD2-ND1 3.3Å; D245-H250 PolarHBondContact OD2-ND1 3.49Å | ||
| 246 | Y | 75.1 | Confident | 82.4 | Confident | 152 Ų | 152 | 83 Ų | 83 | 60% | 0.596 | 46% | 0.459 | S | S | * | . | trans | -108.5 | 8.4 | 170.6 | -68.9 | -91.4 | 0 | 0 | 0 | 111.9 | A239 L244 | A239-Y246 HydrophobicContact CB-CD2 3.46Å; A239-Y246 VanDerWaalsContact CB-CD2 3.46Å; A239-Y246 HydrophobicContact CB-CE2 3.49Å; A239-Y246 VanDerWaalsContact CB-CE2 3.49Å; L244-Y246 HydrophobicContact CB-CD2 4.3Å; L244-Y246 HydrophobicContact CB-CE2 3.79Å; L244-Y246 HydrophobicContact CD1-CE2 4.3Å | ||
| 247 | S | 68.1 | Low | 82.4 | Confident | 27 Ų | 27 | 84.2 Ų | 84.2 | 19% | 0.189 | 46% | 0.463 | C | S | . | . | trans | -76.6 | 126 | 175.4 | -166.4 | 0 | 0 | 0 | 0 | 109.8 | D245 D249 S251 | D245-S247 WeakPolarHBondContact OD1-CA 3.5Å; D245-S247 WeakPolarHBondContact OD1-CB 3.4Å; D245-S247 PolarHBondContact OD1-N 2.93Å; S247-D249 PolarHBondContact O-N 2.98Å; S247-S251 PolarHBondContact OG-N 2.69Å; S247-S251 PolarHBondContact OG-O 3.41Å; S247-S251 PolarHBondContact OG-OG 3.16Å | ||
| 248 | P | 66.6 | Low | 82.3 | Confident | 118 Ų | 118 | 84 Ų | 84 | 77% | 0.766 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.3 | -20.5 | 179.5 | 28 | -34.9 | 0 | 0 | 0 | 113.2 | ||
| 249 | D | 71.7 | Confident | 82.3 | Confident | 130 Ų | 130 | 83.1 Ų | 83.1 | 70% | 0.695 | 46% | 0.459 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -117.7 | 11.7 | -173.2 | -57.1 | -49.2 | 0 | 0 | 0 | 113.1 | S247 S251 | S247-D249 PolarHBondContact O-N 2.98Å; D249-S251 PolarHBondContact O-N 3.2Å |
| 250 | H | 62.7 | Low | 82.5 | Confident | 148 Ų | 148 | 87.5 Ų | 87.5 | 69% | 0.685 | 48% | 0.478 | S | S | * | . | trans | 51.6 | 18.6 | -171.8 | -62.2 | -59.4 | 0 | 0 | 0 | 115.2 | D245 S252 | D245-H250 IonicContact OD2-CE1 3.46Å; D245-H250 IonicContact OD2-CG 3.55Å; D245-H250 IonicContact OD2-ND1 3.3Å; D245-H250 PolarHBondContact OD2-ND1 3.49Å; H250-S252 PolarHBondContact O-N 3.28Å | ||
| 251 | S | 66.5 | Low | 82.7 | Confident | 75 Ų | 75 | 89 Ų | 89 | 52% | 0.524 | 49% | 0.485 | S | S | . | . | trans | -74.2 | 81.3 | 169.6 | 48.8 | 0 | 0 | 0 | 0 | 108.5 | S247 D249 V253 | S247-S251 PolarHBondContact OG-N 2.69Å; S247-S251 PolarHBondContact OG-O 3.41Å; S247-S251 PolarHBondContact OG-OG 3.16Å; D249-S251 PolarHBondContact O-N 3.2Å; S251-V253 PolarHBondContact O-N 2.94Å | ||
| 252 | S | 68.6 | Low | 82.9 | Confident | 90 Ų | 90 | 84.3 Ų | 84.3 | 63% | 0.629 | 46% | 0.462 | S | S | * | . | trans | -69 | 101.5 | -175.9 | 54.2 | 0 | 0 | 0 | 0 | 110.8 | H250 S254 | H250-S252 PolarHBondContact O-N 3.28Å; S252-S254 PolarHBondContact O-N 2.87Å | ||
| 253 | V | 78.6 | Confident | 83 | Confident | 51 Ų | 51 | 84.3 Ų | 84.3 | 31% | 0.309 | 46% | 0.455 | S | S | . | . | trans | -61.1 | 123.2 | 164.7 | 176.1 | 0 | 0 | 0 | 0 | 106.6 | H240 S251 Q257 | H240-V253 PolarHBondContact CD2-O 3.27Å; H240-V253 PolarHBondContact NE2-O 3.32Å; H240-V253 VanDerWaalsContact NE2-O 3.08Å; S251-V253 PolarHBondContact O-N 2.94Å; V253-Q257 HydrophobicContact CG1-CB 3.53Å | ||
| 254 | S | 88.8 | Confident | 83.4 | Confident | 55 Ų | 55 | 80.9 Ų | 80.9 | 39% | 0.385 | 44% | 0.435 | S | S | . | . | trans | -63.3 | 149.9 | -174.8 | 73.7 | 0 | 0 | 0 | 0 | 110.9 | S252 S256 Q257 C258 | S252-S254 PolarHBondContact O-N 2.87Å; S254-S256 PolarHBondContact O-N 3.45Å; S254-S256 VanDerWaalsContact O-N 3.08Å; S254-Q257 WeakPolarHBondContact O-CA 3.45Å; S254-Q257 WeakPolarHBondContact O-CB 3.44Å; S254-Q257 PolarHBondContact O-N 2.9Å; S254-Q257 WeakPolarHBondContact OG-CG 3.34Å; S254-Q257 PolarHBondContact OG-N 3.35Å; S254-C258 PolarHBondContact O-N 3.32Å | ||
| 255 | F | 90.4 | Very high | 83.9 | Confident | 90 Ų | 90 | 78 Ų | 78 | 40% | 0.395 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -49.7 | -40.4 | 177.9 | 170.4 | -108.1 | 0 | 0 | 0 | 112.1 | S237 H240 L241 C258 V259 | S237-F255 WeakPolarHBondContact O-CD2 3.32Å; S237-F255 WeakPolarHBondContact O-CE2 3.37Å; H240-F255 HydrophobicContact CB-CB 4.23Å; H240-F255 HydrophobicContact CB-CD2 4.29Å; L241-F255 HydrophobicContact CB-CD2 4.06Å; L241-F255 HydrophobicContact CB-CE2 3.76Å; L241-F255 HydrophobicContact CB-CZ 4.46Å; L241-F255 HydrophobicContact CD1-CE2 4.24Å; L241-F255 HydrophobicContact CD1-CZ 4.14Å; L241-F255 HydrophobicContact CD2-CE2 4.44Å; L241-F255 HydrophobicContact CG-CE2 4.37Å; F255-C258 WeakPolarHBondContact O-CB 3.4Å; F255-C258 PolarHBondContact O-N 3.39Å; F255-V259 HydrophobicContact CD1-CG2 4.46Å; F255-V259 HydrophobicContact CD2-CG2 4.11Å; F255-V259 HydrophobicContact CE1-CG2 3.98Å; F255-V259 HydrophobicContact CE2-CG2 3.57Å; F255-V259 HydrophobicContact CZ-CG2 3.5Å; F255-V259 WeakPolarHBondContact O-CG2 3.4Å; F255-V259 PolarHBondContact O-N 2.89Å |
| 256 | S | 93.8 | Very high | 84.8 | Confident | 85 Ų | 85 | 75.4 Ų | 75.4 | 59% | 0.594 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -55.1 | -51.1 | 172.8 | 178.8 | 0 | 0 | 0 | 0 | 112.8 | S254 C258 V259 E260 | S254-S256 PolarHBondContact O-N 3.45Å; S254-S256 VanDerWaalsContact O-N 3.08Å; S256-C258 VanDerWaalsContact C-N 3.31Å; S256-C258 PolarHBondContact O-N 2.93Å; S256-V259 PolarHBondContact O-N 3.17Å; S256-E260 WeakPolarHBondContact O-CB 3.48Å; S256-E260 PolarHBondContact O-N 3.36Å |
| 257 | Q | 93.3 | Very high | 85.6 | Confident | 95 Ų | 95 | 72.8 Ų | 72.8 | 44% | 0.444 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -62.3 | -38.2 | 177.5 | -71.7 | 168 | -18.4 | 0 | 0 | 111.9 | V253 S254 E260 Q261 | V253-Q257 HydrophobicContact CG1-CB 3.53Å; S254-Q257 WeakPolarHBondContact O-CA 3.45Å; S254-Q257 WeakPolarHBondContact O-CB 3.44Å; S254-Q257 PolarHBondContact O-N 2.9Å; S254-Q257 WeakPolarHBondContact OG-CG 3.34Å; S254-Q257 PolarHBondContact OG-N 3.35Å; Q257-E260 PolarHBondContact O-N 3.02Å; Q257-Q261 WeakPolarHBondContact O-CB 3.47Å; Q257-Q261 WeakPolarHBondContact O-CG 3.27Å; Q257-Q261 PolarHBondContact O-N 2.96Å |
| 258 | C | 93 | Very high | 86.8 | Confident | 2 Ų | 2 | 74.5 Ų | 74.5 | 1% | 0.014 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -64 | -48.4 | 178 | -134.7 | 0 | 0 | 0 | 0 | 111.8 | L236 S237 S254 F255 S256 E260 Q261 C262 | L236-C258 VanDerWaalsContact C-SG 3.59Å; L236-C258 VanDerWaalsContact CB-SG 3.57Å; S237-C258 VanDerWaalsContact OG-C 3.32Å; S237-C258 PolarHBondContact OG-O 3.44Å; S254-C258 PolarHBondContact O-N 3.32Å; F255-C258 WeakPolarHBondContact O-CB 3.4Å; F255-C258 PolarHBondContact O-N 3.39Å; S256-C258 VanDerWaalsContact C-N 3.31Å; S256-C258 PolarHBondContact O-N 2.93Å; C258-E260 VanDerWaalsContact C-N 3.29Å; C258-E260 PolarHBondContact O-N 3.4Å; C258-Q261 PolarHBondContact O-N 3.38Å; C258-C262 PolarHBondContact O-N 3.49Å |
| 259 | V | 95.3 | Very high | 87.8 | Confident | 56 Ų | 56 | 70.7 Ų | 70.7 | 34% | 0.339 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -61.1 | -39.2 | 174.8 | 171.7 | 0 | 0 | 0 | 0 | 111.3 | F255 S256 C262 T263 | F255-V259 HydrophobicContact CD1-CG2 4.46Å; F255-V259 HydrophobicContact CD2-CG2 4.11Å; F255-V259 HydrophobicContact CE1-CG2 3.98Å; F255-V259 HydrophobicContact CE2-CG2 3.57Å; F255-V259 HydrophobicContact CZ-CG2 3.5Å; F255-V259 WeakPolarHBondContact O-CG2 3.4Å; F255-V259 PolarHBondContact O-N 2.89Å; S256-V259 PolarHBondContact O-N 3.17Å; V259-C262 PolarHBondContact O-N 3.1Å; V259-T263 WeakPolarHBondContact O-CB 3.49Å; V259-T263 PolarHBondContact O-N 3.32Å; V259-T263 PolarHBondContact O-OG1 3.29Å |
| 260 | E | 96.2 | Very high | 88 | Confident | 99 Ų | 99 | 66 Ų | 66 | 46% | 0.463 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -68.1 | -39.1 | 177.7 | -159.9 | -158.7 | -176.3 | 0 | 0 | 111.8 | S256 Q257 C258 T263 R264 | S256-E260 WeakPolarHBondContact O-CB 3.48Å; S256-E260 PolarHBondContact O-N 3.36Å; Q257-E260 PolarHBondContact O-N 3.02Å; C258-E260 VanDerWaalsContact C-N 3.29Å; C258-E260 PolarHBondContact O-N 3.4Å; E260-T263 PolarHBondContact O-N 2.87Å; E260-R264 VanDerWaalsContact CD-NH2 3.27Å; E260-R264 WeakPolarHBondContact O-CB 3.35Å; E260-R264 WeakPolarHBondContact O-CG 3.16Å; E260-R264 PolarHBondContact O-N 3.05Å; E260-R264 PolarHBondContact O-NE 3.08Å; E260-R264 IonicContact OE1-CZ 3.99Å; E260-R264 IonicContact OE1-NH1 3.73Å; E260-R264 PolarHBondContact OE1-NH1 3.31Å; E260-R264 IonicContact OE2-CZ 3.78Å; E260-R264 IonicContact OE2-NH1 2.75Å; E260-R264 PolarHBondContact OE2-NH1 3.46Å; E260-R264 IonicContact OE2-NH2 3.68Å; E260-R264 PolarHBondContact OE2-NH2 3.37Å |
| 261 | Q | 94.8 | Very high | 88.1 | Confident | 76 Ų | 76 | 68.6 Ų | 68.6 | 36% | 0.355 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.7 | -43.9 | 170.9 | -74.7 | 177.9 | -7.2 | 0 | 0 | 112.2 | Q257 C258 T263 R264 T265 | Q257-Q261 WeakPolarHBondContact O-CB 3.47Å; Q257-Q261 WeakPolarHBondContact O-CG 3.27Å; Q257-Q261 PolarHBondContact O-N 2.96Å; C258-Q261 PolarHBondContact O-N 3.38Å; Q261-T263 VanDerWaalsContact C-N 3.34Å; Q261-T263 PolarHBondContact O-N 2.91Å; Q261-R264 PolarHBondContact O-N 2.87Å; Q261-T265 WeakPolarHBondContact O-CB 3.37Å; Q261-T265 PolarHBondContact O-N 3.4Å; Q261-T265 PolarHBondContact O-OG1 3Å |
| 262 | C | 96.1 | Very high | 87.8 | Confident | 13 Ų | 13 | 69.3 Ų | 69.3 | 9% | 0.088 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -60.2 | -44.4 | 174.4 | -169.8 | 0 | 0 | 0 | 0 | 111.5 | N233 C258 V259 T265 L266 | N233-C262 HydrophobicContact CB-CB 3.83Å; C258-C262 PolarHBondContact O-N 3.49Å; V259-C262 PolarHBondContact O-N 3.1Å; C262-T265 PolarHBondContact O-N 2.92Å; C262-L266 PolarHBondContact O-N 3.09Å |
| 263 | T | 96 | Very high | 87.3 | Confident | 60 Ų | 60 | 72.5 Ų | 72.5 | 37% | 0.368 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -64.3 | -46.5 | 178.6 | -58.9 | 0 | 0 | 0 | 0 | 112 | V259 E260 Q261 T265 L266 Q267 | V259-T263 WeakPolarHBondContact O-CB 3.49Å; V259-T263 PolarHBondContact O-N 3.32Å; V259-T263 PolarHBondContact O-OG1 3.29Å; E260-T263 PolarHBondContact O-N 2.87Å; Q261-T263 VanDerWaalsContact C-N 3.34Å; Q261-T263 PolarHBondContact O-N 2.91Å; T263-T265 VanDerWaalsContact C-N 3.31Å; T263-T265 PolarHBondContact O-N 3.17Å; T263-L266 PolarHBondContact O-N 3.08Å; T263-Q267 WeakPolarHBondContact O-CG 3.49Å; T263-Q267 PolarHBondContact O-N 3.02Å |
| 264 | R | 95.9 | Very high | 86.1 | Confident | 114 Ų | 114 | 79 Ų | 79 | 43% | 0.43 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -57.4 | -43.5 | 174 | -79.2 | -179 | -76.4 | -120.1 | -4.9 | 111.9 | E260 Q261 Q267 A268 | E260-R264 VanDerWaalsContact CD-NH2 3.27Å; E260-R264 WeakPolarHBondContact O-CB 3.35Å; E260-R264 WeakPolarHBondContact O-CG 3.16Å; E260-R264 PolarHBondContact O-N 3.05Å; E260-R264 PolarHBondContact O-NE 3.08Å; E260-R264 IonicContact OE1-CZ 3.99Å; E260-R264 IonicContact OE1-NH1 3.73Å; E260-R264 PolarHBondContact OE1-NH1 3.31Å; E260-R264 IonicContact OE2-CZ 3.78Å; E260-R264 IonicContact OE2-NH1 2.75Å; E260-R264 PolarHBondContact OE2-NH1 3.46Å; E260-R264 IonicContact OE2-NH2 3.68Å; E260-R264 PolarHBondContact OE2-NH2 3.37Å; Q261-R264 PolarHBondContact O-N 2.87Å; R264-Q267 PolarHBondContact O-N 3.45Å; R264-A268 WeakPolarHBondContact O-CB 3.46Å; R264-A268 PolarHBondContact O-N 3.11Å |
| 265 | T | 95.1 | Very high | 84.6 | Confident | 28 Ų | 28 | 87.3 Ų | 87.3 | 17% | 0.172 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -61.5 | -46.3 | 178 | -58.5 | 0 | 0 | 0 | 0 | 111.5 | R229 I230 Q261 C262 T263 Q267 A268 E269 | R229-T265 HydrophobicContact CB-CG2 3.91Å; I230-T265 HydrophobicContact CG1-CG2 3.82Å; Q261-T265 WeakPolarHBondContact O-CB 3.37Å; Q261-T265 PolarHBondContact O-N 3.4Å; Q261-T265 PolarHBondContact O-OG1 3Å; C262-T265 PolarHBondContact O-N 2.92Å; T263-T265 VanDerWaalsContact C-N 3.31Å; T263-T265 PolarHBondContact O-N 3.17Å; T265-Q267 PolarHBondContact O-N 3.32Å; T265-A268 PolarHBondContact O-N 3.02Å; T265-E269 WeakPolarHBondContact O-CG 3.04Å; T265-E269 PolarHBondContact O-N 2.68Å; T265-E269 VanDerWaalsContact O-N 3.13Å |
| 266 | L | 94.2 | Very high | 82.7 | Confident | 19 Ų | 19 | 91.4 Ų | 91.4 | 10% | 0.099 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -63.5 | -40.1 | 177.6 | 179.1 | 59.8 | 0 | 0 | 0 | 112.5 | Y216 I230 C262 T263 G270 | Y216-L266 HydrophobicContact CD1-CD2 4.38Å; Y216-L266 HydrophobicContact CD2-CD1 4.25Å; Y216-L266 HydrophobicContact CD2-CD2 4.36Å; Y216-L266 HydrophobicContact CD2-CG 4.09Å; Y216-L266 HydrophobicContact CE1-CD2 4.07Å; Y216-L266 HydrophobicContact CE1-CG 4.48Å; Y216-L266 HydrophobicContact CE2-CD1 4.19Å; Y216-L266 HydrophobicContact CE2-CD2 4.07Å; Y216-L266 HydrophobicContact CE2-CG 3.62Å; I230-L266 HydrophobicContact CD1-CD1 3.99Å; C262-L266 PolarHBondContact O-N 3.09Å; T263-L266 PolarHBondContact O-N 3.08Å; L266-G270 PolarHBondContact O-N 3.18Å |
| 267 | Q | 93.1 | Very high | 80.8 | Confident | 97 Ų | 97 | 93.9 Ų | 93.9 | 45% | 0.453 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.2 | -43.7 | 175.4 | -72.9 | 179.3 | 15.5 | 0 | 0 | 112.5 | Y216 T263 R264 T265 R271 | Y216-Q267 WeakPolarHBondContact OH-CG 3.31Å; T263-Q267 WeakPolarHBondContact O-CG 3.49Å; T263-Q267 PolarHBondContact O-N 3.02Å; R264-Q267 PolarHBondContact O-N 3.45Å; T265-Q267 PolarHBondContact O-N 3.32Å; Q267-R271 WeakPolarHBondContact O-CG 3.48Å; Q267-R271 PolarHBondContact O-N 3.09Å |
| 268 | A | 91.4 | Very high | 78.7 | Confident | 63 Ų | 63 | 99.8 Ų | 99.8 | 52% | 0.521 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.4 | -50.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | R264 T265 G270 R271 | R264-A268 WeakPolarHBondContact O-CB 3.46Å; R264-A268 PolarHBondContact O-N 3.11Å; T265-A268 PolarHBondContact O-N 3.02Å; A268-G270 PolarHBondContact O-N 3.22Å; A268-R271 PolarHBondContact O-N 3.22Å |
| 269 | E | 88.4 | Confident | 76.5 | Confident | 38 Ų | 38 | 107.6 Ų | 107.6 | 18% | 0.178 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -71 | -29.4 | -178.5 | -63 | -68.4 | 168.3 | 0 | 0 | 112.4 | A226 R229 T265 | A226-E269 HydrophobicContact CB-CB 3.79Å; A226-E269 HydrophobicContact CB-CG 3.65Å; A226-E269 WeakPolarHBondContact CB-OE2 3.47Å; R229-E269 WeakPolarHBondContact CD-OE1 3.31Å; R229-E269 IonicContact CZ-OE1 2.8Å; R229-E269 IonicContact NH1-OE1 3Å; R229-E269 PolarHBondContact NH1-OE1 3.18Å; T265-E269 WeakPolarHBondContact O-CG 3.04Å; T265-E269 PolarHBondContact O-N 2.68Å; T265-E269 VanDerWaalsContact O-N 3.13Å |
| 270 | G | 75.8 | Confident | 74.6 | Confident | 32 Ų | 32 | 112 Ų | 112 | 33% | 0.33 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -69.4 | -27.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | L266 A268 | L266-G270 PolarHBondContact O-N 3.18Å; A268-G270 PolarHBondContact O-N 3.22Å |
| 271 | R | 66 | Low | 72.1 | Confident | 202 Ų | 202 | 112.1 Ų | 112.1 | 76% | 0.762 | 55% | 0.545 | S | S | * | . | G | 310 helix | trans | -80.8 | -12.6 | -174.1 | -81.9 | 178.2 | 149.6 | -136.6 | -2.4 | 115.4 | Q267 A268 K273 K274 | Q267-R271 WeakPolarHBondContact O-CG 3.48Å; Q267-R271 PolarHBondContact O-N 3.09Å; A268-R271 PolarHBondContact O-N 3.22Å; R271-K273 PolarHBondContact O-N 3.32Å; R271-K274 PolarHBondContact O-N 2.96Å; R271-K274 VanDerWaalsContact O-N 3.15Å |
| 272 | S | 58.8 | Low | 69.7 | Low | 90 Ų | 90 | 117 Ų | 117 | 63% | 0.629 | 57% | 0.565 | S | S | * | * | G | 310 helix | trans | -56.6 | -16.4 | -171.6 | -61.7 | 0 | 0 | 0 | 0 | 116.1 | ||
| 273 | K | 57.5 | Low | 67.2 | Low | 158 Ų | 158 | 122 Ų | 122 | 69% | 0.687 | 60% | 0.597 | S | S | * | * | G | 310 helix | trans | -89.1 | -16.6 | 179.8 | -67.9 | -176.5 | 179.8 | 175.6 | 0 | 115.6 | R271 R275 | R271-K273 PolarHBondContact O-N 3.32Å; K273-R275 VanDerWaalsContact C-N 3.33Å; K273-R275 PolarHBondContact O-N 3.23Å |
| 274 | K | 53.3 | Low | 65.1 | Low | 187 Ų | 187 | 124.2 Ų | 124.2 | 81% | 0.813 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | 0.2 | -170.3 | -160 | 160.1 | -177.9 | 172.2 | 0 | 115.2 | R271 | R271-K274 PolarHBondContact O-N 2.96Å; R271-K274 VanDerWaalsContact O-N 3.15Å |
| 275 | R | 57.3 | Low | 62.6 | Low | 229 Ų | 229 | 126 Ų | 126 | 86% | 0.864 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.3 | -3.1 | -175.9 | -71.1 | -175.4 | 71 | 146.4 | -1.3 | 116.4 | K273 | K273-R275 VanDerWaalsContact C-N 3.33Å; K273-R275 PolarHBondContact O-N 3.23Å |
| 276 | K | 51.8 | Low | 60.1 | Low | 177 Ų | 177 | 132.4 Ų | 132.4 | 77% | 0.77 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -97.4 | -1.3 | -173.2 | -159.3 | 55.8 | 174.7 | 176.8 | 0 | 116 | ||
| 277 | V | 53 | Low | 58.1 | Low | 136 Ų | 136 | 136.3 Ų | 136.3 | 82% | 0.824 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -120.6 | 41.1 | -176.9 | -159.6 | 0 | 0 | 0 | 0 | 112.6 | ||
| 278 | R | 49.1 | Very low | 56 | Low | 219 Ų | 219 | 137.3 Ų | 137.3 | 83% | 0.826 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -143.9 | 16 | 173.2 | -72.3 | -164.1 | 174.3 | -166.3 | -3.6 | 114.5 | ||
| 279 | Q | 48 | Very low | 54.1 | Low | 167 Ų | 167 | 141.8 Ų | 141.8 | 78% | 0.78 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -136.3 | 23.9 | -172.5 | -83.3 | -75.9 | -49.1 | 0 | 0 | 112.8 | ||
| 280 | L | 54.6 | Low | 52.4 | Low | 148 Ų | 148 | 149.3 Ų | 149.3 | 78% | 0.775 | 76% | 0.758 | S | S | * | * | trans | -134 | 15.9 | 173.8 | -73 | 176.3 | 0 | 0 | 0 | 113.1 | F282 | L280-F282 PolarHBondContact O-N 3.06Š| ||
| 281 | S | 44.3 | Very low | 51.2 | Low | 102 Ų | 102 | 159.1 Ų | 159.1 | 71% | 0.713 | 79% | 0.785 | S | S | * | * | trans | -92.1 | 81.2 | 166.1 | 55.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 282 | F | 44.5 | Very low | 50.3 | Low | 177 Ų | 177 | 156.9 Ų | 156.9 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | trans | -66.5 | 127.5 | 163.3 | -81.2 | -89.7 | 0 | 0 | 0 | 108.4 | L280 A284 | L280-F282 PolarHBondContact O-N 3.06Å; F282-A284 PolarHBondContact O-N 3.26Å; F282-A284 VanDerWaalsContact O-N 3.16Å | ||
| 283 | P | 43.3 | Very low | 50.2 | Low | 118 Ų | 118 | 163.5 Ų | 163.5 | 77% | 0.766 | 81% | 0.813 | S | S | * | * | trans | -70.3 | 110.2 | 170.9 | 28.3 | -31.5 | 0 | 0 | 0 | 108.8 | N285 | P283-N285 PolarHBondContact O-N 3.26Š| ||
| 284 | A | 51.7 | Low | 49.8 | Very low | 108 Ų | 108 | 163.8 Ų | 163.8 | 89% | 0.893 | 82% | 0.819 | S | S | * | * | trans | -71.5 | 95.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | F282 | F282-A284 PolarHBondContact O-N 3.26Å; F282-A284 VanDerWaalsContact O-N 3.16Å | ||
| 285 | N | 42.7 | Very low | 49.6 | Very low | 151 Ų | 151 | 162.6 Ų | 162.6 | 81% | 0.807 | 82% | 0.82 | S | S | * | * | trans | -143.4 | 95.7 | 172 | -153.8 | -5.4 | 0 | 0 | 0 | 109.3 | P283 | P283-N285 PolarHBondContact O-N 3.26Š| ||
| 286 | H | 42.4 | Very low | 49.2 | Very low | 163 Ų | 163 | 158.9 Ų | 158.9 | 76% | 0.755 | 82% | 0.817 | S | S | * | * | trans | -121.9 | 111.2 | 172 | -165.2 | -59.7 | 0 | 0 | 0 | 108 | ||||
| 287 | P | 53.1 | Low | 49 | Very low | 100 Ų | 100 | 157.8 Ų | 157.8 | 65% | 0.649 | 82% | 0.82 | S | S | * | * | trans | -71.1 | 159.2 | 176.8 | 29.6 | -33.4 | 0 | 0 | 0 | 111.3 | ||||
| 288 | S | 49.4 | Very low | 48.8 | Very low | 118 Ų | 118 | 159.2 Ų | 159.2 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | trans | -59.3 | 131.1 | -171.6 | -46 | 0 | 0 | 0 | 0 | 114 | ||||
| 289 | L | 51.3 | Low | 48.7 | Very low | 157 Ų | 157 | 155.2 Ų | 155.2 | 82% | 0.822 | 82% | 0.819 | S | S | * | * | trans | -113.2 | 110.7 | 157.9 | -93.4 | 165.4 | 0 | 0 | 0 | 109.4 | R291 | L289-R291 PolarHBondContact O-N 3.14Š| ||
| 290 | K | 52 | Low | 48.8 | Very low | 197 Ų | 197 | 154.4 Ų | 154.4 | 86% | 0.857 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 119.3 | 176.4 | -60.1 | 173.2 | -179.9 | 179 | 0 | 108.6 | ||
| 291 | R | 50.3 | Low | 48.4 | Very low | 238 Ų | 238 | 154.8 Ų | 154.8 | 90% | 0.898 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 118.4 | 162.9 | -176.6 | 167.4 | -73.7 | 164.2 | -2.4 | 108.4 | L289 | L289-R291 PolarHBondContact O-N 3.14Š|
| 292 | I | 46.8 | Very low | 48.7 | Very low | 154 Ų | 154 | 159.3 Ų | 159.3 | 79% | 0.79 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -58 | 135.3 | 173.1 | -65.1 | 157 | 0 | 0 | 0 | 109.6 | ||
| 293 | I | 56.6 | Low | 49.1 | Very low | 230 Ų | 230 | 157.6 Ų | 157.6 | 100% | 1.179 | 84% | 0.84 | S | S | * | * | trans | -125.5 | 0 | 147.3 | -55 | 179.8 | 0 | 0 | 0 | 104.6 |
Retrieved 293 of 293 residues in 199.2 ms
(Link to these results)