| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 37.8 | Very low | 35.1 | Very low | 243 Ų | 243 | 160.5 Ų | 160.5 | 100% | 1.197 | 82% | 0.823 | S | S | * | * | 0 | 116.6 | 0 | -73.5 | -174.9 | -155.5 | 0 | 0 | 107.8 | |||||
| 2 | L | 27.5 | Very low | 34.6 | Very low | 176 Ų | 176 | 154.8 Ų | 154.8 | 92% | 0.921 | 82% | 0.818 | S | S | * | * | trans | -82.9 | 127.4 | 172.2 | -80.5 | 142.7 | 0 | 0 | 0 | 108 | ||||
| 3 | V | 34 | Very low | 34.5 | Very low | 145 Ų | 145 | 153.9 Ų | 153.9 | 88% | 0.879 | 82% | 0.822 | S | S | * | * | trans | -127.6 | 111.8 | 156.4 | -179.1 | 0 | 0 | 0 | 0 | 107 | ||||
| 4 | Q | 33.9 | Very low | 34.9 | Very low | 174 Ų | 174 | 151.8 Ų | 151.8 | 81% | 0.813 | 82% | 0.817 | S | S | * | * | trans | -73.5 | 129.1 | -174.5 | -178.4 | 173.7 | -3 | 0 | 0 | 110.1 | ||||
| 5 | N | 35.1 | Very low | 34.5 | Very low | 142 Ų | 142 | 145.9 Ų | 145.9 | 76% | 0.759 | 81% | 0.807 | S | S | * | * | trans | -116.6 | 116.4 | 165.3 | -158 | -33.9 | 0 | 0 | 0 | 108.5 | A7 | N5-A7 VanDerWaalsContact C-N 3.34Å; N5-A7 PolarHBondContact O-N 3.5Å; N5-A7 VanDerWaalsContact O-N 3.14Å | ||
| 6 | P | 38.7 | Very low | 34.5 | Very low | 118 Ų | 118 | 147.6 Ų | 147.6 | 77% | 0.766 | 81% | 0.814 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.6 | 29.9 | -159.4 | 33.4 | -37.6 | 0 | 0 | 0 | 116.2 | ||
| 7 | A | 41.9 | Very low | 34 | Very low | 80 Ų | 80 | 151.1 Ų | 151.1 | 66% | 0.661 | 81% | 0.814 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111 | -7 | -168.5 | 0 | 0 | 0 | 0 | 0 | 117.3 | N5 | N5-A7 VanDerWaalsContact C-N 3.34Å; N5-A7 PolarHBondContact O-N 3.5Å; N5-A7 VanDerWaalsContact O-N 3.14Å |
| 8 | L | 35.3 | Very low | 34 | Very low | 136 Ų | 136 | 149.2 Ų | 149.2 | 71% | 0.712 | 81% | 0.813 | S | S | * | * | trans | -141.8 | 120.7 | -177.6 | -70.2 | 170.7 | 0 | 0 | 0 | 112.5 | W10 | L8-W10 HydrophobicContact CB-CE3 4.33Å; L8-W10 HydrophobicContact CB-CH2 4.11Å; L8-W10 HydrophobicContact CB-CZ3 3.65Å; L8-W10 HydrophobicContact CD1-CZ3 4.41Å | ||
| 9 | Q | 36.3 | Very low | 34.1 | Very low | 167 Ų | 167 | 146.4 Ų | 146.4 | 78% | 0.78 | 80% | 0.802 | S | S | * | * | trans | -69.2 | 127.7 | 168.7 | -75 | -177.5 | -20.8 | 0 | 0 | 109.8 | F11 | Q9-F11 HydrophobicContact CB-CE2 4.27Š| ||
| 10 | W | 32.8 | Very low | 34.1 | Very low | 207 Ų | 207 | 145 Ų | 145 | 78% | 0.784 | 80% | 0.804 | S | S | * | * | trans | -82.1 | 132.3 | 166.9 | -59.5 | 157.1 | 0 | 0 | 0 | 110.3 | L8 | L8-W10 HydrophobicContact CB-CE3 4.33Å; L8-W10 HydrophobicContact CB-CH2 4.11Å; L8-W10 HydrophobicContact CB-CZ3 3.65Å; L8-W10 HydrophobicContact CD1-CZ3 4.41Å | ||
| 11 | F | 32.6 | Very low | 34 | Very low | 178 Ų | 178 | 143.6 Ų | 143.6 | 78% | 0.781 | 80% | 0.804 | S | S | * | * | trans | -127.6 | 106.4 | 145.9 | -58.6 | -75.3 | 0 | 0 | 0 | 107.2 | Q9 | Q9-F11 HydrophobicContact CB-CE2 4.27Š| ||
| 12 | A | 29.5 | Very low | 33.8 | Very low | 92 Ų | 92 | 138.1 Ų | 138.1 | 76% | 0.76 | 79% | 0.789 | S | S | * | * | trans | -81.6 | 130.9 | 163.4 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 13 | V | 33.6 | Very low | 34.1 | Very low | 143 Ų | 143 | 136.3 Ų | 136.3 | 87% | 0.867 | 79% | 0.786 | S | S | * | * | trans | -121.1 | 111 | 160.8 | -179 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 14 | T | 39.9 | Very low | 34.2 | Very low | 124 Ų | 124 | 139.1 Ų | 139.1 | 76% | 0.761 | 79% | 0.79 | S | S | * | * | trans | -77.1 | 145.2 | 174.9 | 42.1 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 15 | G | 29.4 | Very low | 34 | Very low | 64 Ų | 64 | 136 Ų | 136 | 66% | 0.66 | 79% | 0.787 | S | S | * | * | trans | 64.9 | 149.2 | 153.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 16 | D | 33.9 | Very low | 33.8 | Very low | 172 Ų | 172 | 133.6 Ų | 133.6 | 92% | 0.92 | 79% | 0.787 | S | S | * | * | cis | -153.2 | 153.6 | 12.7 | -78.9 | -47.2 | 0 | 0 | 0 | 109.6 | ||||
| 17 | Y | 26.4 | Very low | 33.6 | Very low | 208 Ų | 208 | 136.5 Ų | 136.5 | 82% | 0.816 | 79% | 0.79 | S | S | * | * | trans | -97.7 | 130.9 | 175.1 | -179.2 | -85.6 | 0 | 0 | 0 | 108.7 | ||||
| 18 | C | 32.7 | Very low | 33.1 | Very low | 117 Ų | 117 | 138.5 Ų | 138.5 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | -179.7 | 138.7 | 129.3 | -136.5 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 19 | P | 37.6 | Very low | 33.1 | Very low | 95 Ų | 95 | 141 Ų | 141 | 62% | 0.617 | 80% | 0.802 | S | S | * | * | trans | -98 | 160.6 | -179.7 | 37.7 | -31 | 0 | 0 | 0 | 113.2 | ||||
| 20 | S | 34.1 | Very low | 32.8 | Very low | 119 Ų | 119 | 141.4 Ų | 141.4 | 83% | 0.832 | 80% | 0.804 | S | S | * | * | trans | -150 | 107.8 | 165.6 | -76.2 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 21 | S | 30.9 | Very low | 32.8 | Very low | 116 Ų | 116 | 141.2 Ų | 141.2 | 81% | 0.811 | 81% | 0.809 | S | S | * | * | trans | 17.4 | 131.2 | 136.1 | -41.9 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 22 | S | 34.9 | Very low | 32.7 | Very low | 127 Ų | 127 | 136.4 Ų | 136.4 | 89% | 0.888 | 80% | 0.802 | S | S | * | * | trans | -166.2 | 113.8 | 136.3 | -80.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 23 | T | 33.6 | Very low | 33 | Very low | 139 Ų | 139 | 140.9 Ų | 140.9 | 85% | 0.853 | 81% | 0.807 | S | S | * | * | trans | -76.8 | 147.3 | 166.4 | 38.5 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 24 | Q | 35.3 | Very low | 33 | Very low | 203 Ų | 203 | 137.2 Ų | 137.2 | 95% | 0.949 | 79% | 0.792 | S | S | * | * | trans | -155.4 | 157.7 | 148.1 | -116.2 | -179 | 35.4 | 0 | 0 | 113.2 | ||||
| 25 | S | 29.7 | Very low | 32.7 | Very low | 110 Ų | 110 | 141.8 Ų | 141.8 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | trans | -127.2 | 157 | -155.4 | 121.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 26 | A | 31.6 | Very low | 32.8 | Very low | 90 Ų | 90 | 141.8 Ų | 141.8 | 74% | 0.744 | 80% | 0.802 | S | S | * | * | trans | 79.3 | 149.1 | 152.4 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 27 | Q | 33.1 | Very low | 32.8 | Very low | 180 Ų | 180 | 141.8 Ų | 141.8 | 84% | 0.841 | 80% | 0.801 | S | S | * | * | trans | 110.1 | 95.7 | 142.9 | -147.3 | 165.9 | 14.8 | 0 | 0 | 116.8 | ||||
| 28 | T | 32.1 | Very low | 32.9 | Very low | 122 Ų | 122 | 136.6 Ų | 136.6 | 75% | 0.748 | 80% | 0.795 | S | S | * | * | 79.8 | 121.6 | 90 | -44.7 | 0 | 0 | 0 | 0 | 115 | |||||
| 29 | Q | 35.8 | Very low | 32.8 | Very low | 188 Ų | 188 | 136.7 Ų | 136.7 | 88% | 0.879 | 79% | 0.792 | S | S | * | * | 169.4 | 141.5 | 117.7 | -87 | -167 | 6.6 | 0 | 0 | 115.1 | |||||
| 30 | H | 29.1 | Very low | 32.8 | Very low | 175 Ų | 175 | 137.6 Ų | 137.6 | 81% | 0.81 | 80% | 0.798 | S | S | * | * | trans | -72.2 | 157.2 | 176.6 | -95 | -117.3 | 0 | 0 | 0 | 113.5 | ||||
| 31 | F | 33.8 | Very low | 32.8 | Very low | 203 Ų | 203 | 138.9 Ų | 138.9 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | trans | -152.8 | 130.9 | 134.7 | -121 | -86.8 | 0 | 0 | 0 | 110.7 | ||||
| 32 | A | 29.4 | Very low | 32.9 | Very low | 77 Ų | 77 | 144.5 Ų | 144.5 | 64% | 0.636 | 80% | 0.797 | S | S | * | * | trans | -120.2 | 142.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 33 | Q | 36.9 | Very low | 32.6 | Very low | 187 Ų | 187 | 150.4 Ų | 150.4 | 87% | 0.874 | 80% | 0.8 | S | S | * | * | trans | 170.9 | 151.6 | 154.1 | -100 | 168.6 | -4.4 | 0 | 0 | 108.2 | ||||
| 34 | A | 32.9 | Very low | 32.4 | Very low | 66 Ų | 66 | 147.9 Ų | 147.9 | 55% | 0.545 | 79% | 0.793 | S | S | . | * | cis | 176.2 | 140.7 | -30.9 | 0 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 35 | F | 33.5 | Very low | 32.4 | Very low | 219 Ų | 219 | 146.1 Ų | 146.1 | 96% | 0.961 | 79% | 0.789 | S | S | * | * | trans | 62.6 | 145.5 | 167.2 | -54 | -82.8 | 0 | 0 | 0 | 117 | ||||
| 36 | G | 31 | Very low | 32.4 | Very low | 64 Ų | 64 | 146.1 Ų | 146.1 | 66% | 0.66 | 79% | 0.789 | S | S | * | * | cis | 165.8 | 152.7 | 6.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 37 | L | 34.3 | Very low | 32.7 | Very low | 173 Ų | 173 | 146.8 Ų | 146.8 | 91% | 0.906 | 79% | 0.786 | S | S | * | * | trans | 82.1 | 117.5 | 152 | -54.3 | 173.2 | 0 | 0 | 0 | 121.6 | ||||
| 38 | S | 28 | Very low | 32.9 | Very low | 99 Ų | 99 | 146.5 Ų | 146.5 | 69% | 0.692 | 78% | 0.782 | S | S | * | * | trans | -23.2 | 152.9 | 150.5 | 51.5 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 39 | V | 32.3 | Very low | 33.1 | Very low | 119 Ų | 119 | 148.9 Ų | 148.9 | 72% | 0.721 | 78% | 0.784 | S | S | * | * | 171.5 | 138.1 | 112.7 | 160.2 | 0 | 0 | 0 | 0 | 111.3 | I41 | V39-I41 HydrophobicContact CG1-CD1 4.09Š| |||
| 40 | P | 36.7 | Very low | 33 | Very low | 114 Ų | 114 | 145.5 Ų | 145.5 | 74% | 0.74 | 78% | 0.782 | S | S | * | * | trans | -104.8 | 156.8 | 173.8 | 38.2 | -29.8 | 0 | 0 | 0 | 112.5 | ||||
| 41 | I | 33.7 | Very low | 33.1 | Very low | 145 Ų | 145 | 144.7 Ų | 144.7 | 74% | 0.744 | 78% | 0.782 | S | S | * | * | trans | -165.8 | 127.4 | 168.4 | -102 | 142.7 | 0 | 0 | 0 | 115.8 | V39 | V39-I41 HydrophobicContact CG1-CD1 4.09Š| ||
| 42 | R | 33.9 | Very low | 33.1 | Very low | 235 Ų | 235 | 141.8 Ų | 141.8 | 89% | 0.887 | 78% | 0.781 | S | S | * | * | trans | 80.2 | 138.8 | 136.4 | -70.8 | -176.2 | -178.6 | -160.5 | 0.7 | 126.7 | ||||
| 43 | R | 27.3 | Very low | 33.1 | Very low | 251 Ų | 251 | 147 Ų | 147 | 95% | 0.947 | 79% | 0.792 | S | S | * | * | trans | -82.8 | 159.4 | 172.2 | -64.5 | 173.6 | 169.2 | 165.8 | -4.3 | 113.7 | ||||
| 44 | A | 31.1 | Very low | 32.8 | Very low | 85 Ų | 85 | 142.4 Ų | 142.4 | 70% | 0.702 | 78% | 0.781 | S | S | * | * | trans | -166.1 | 113.6 | 145.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 45 | L | 34 | Very low | 32.7 | Very low | 167 Ų | 167 | 146.5 Ų | 146.5 | 87% | 0.874 | 79% | 0.794 | S | S | * | * | 93.5 | 89.6 | 92.6 | -79.1 | 159.6 | 0 | 0 | 0 | 116.1 | |||||
| 46 | S | 30.4 | Very low | 32.6 | Very low | 109 Ų | 109 | 144.7 Ų | 144.7 | 76% | 0.762 | 79% | 0.786 | S | S | * | * | 46.8 | 170.5 | 116 | -135.3 | 0 | 0 | 0 | 0 | 123.4 | |||||
| 47 | P | 37.3 | Very low | 32.5 | Very low | 105 Ų | 105 | 148.1 Ų | 148.1 | 68% | 0.682 | 79% | 0.794 | S | S | * | * | -138.3 | 179.8 | -78.6 | 44 | -26.9 | 0 | 0 | 0 | 114.5 | |||||
| 48 | K | 38.1 | Very low | 32.5 | Very low | 173 Ų | 173 | 147 Ų | 147 | 75% | 0.752 | 79% | 0.788 | S | S | * | * | trans | 164.1 | 131 | 130.6 | -94.9 | 179.8 | 176.1 | 172 | 0 | 116.3 | ||||
| 49 | Q | 36.3 | Very low | 32.5 | Very low | 172 Ų | 172 | 151.8 Ų | 151.8 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | 69.9 | 140.5 | 139.7 | -62.5 | 172.4 | -6.2 | 0 | 0 | 118.8 | ||||
| 50 | S | 33.9 | Very low | 32.9 | Very low | 118 Ų | 118 | 151.9 Ų | 151.9 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | cis | -165 | 161.2 | 22.9 | 148 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 51 | L | 31.1 | Very low | 32.7 | Very low | 157 Ų | 157 | 153.3 Ų | 153.3 | 82% | 0.822 | 81% | 0.807 | S | S | * | * | trans | -73.1 | 158.8 | -169.7 | -76.6 | 126.4 | 0 | 0 | 0 | 117.3 | ||||
| 52 | T | 32.7 | Very low | 32.6 | Very low | 142 Ų | 142 | 149.7 Ų | 149.7 | 87% | 0.871 | 81% | 0.805 | S | S | * | * | 178.4 | 129 | 115.9 | 29 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 53 | H | 30.9 | Very low | 32.7 | Very low | 186 Ų | 186 | 150.7 Ų | 150.7 | 86% | 0.861 | 81% | 0.809 | S | S | * | * | trans | -121.6 | 146.6 | 176.3 | -98.4 | -90.4 | 0 | 0 | 0 | 109.9 | ||||
| 54 | S | 28.6 | Very low | 32.7 | Very low | 92 Ų | 92 | 143.5 Ų | 143.5 | 64% | 0.643 | 80% | 0.797 | S | S | * | * | trans | -131.8 | 124.3 | 165.4 | 170.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 55 | N | 31.7 | Very low | 33.1 | Very low | 152 Ų | 152 | 145.6 Ų | 145.6 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | trans | -107.8 | 140 | 167.9 | -84.3 | -45.5 | 0 | 0 | 0 | 108 | ||||
| 56 | F | 31.5 | Very low | 33.2 | Very low | 181 Ų | 181 | 143.6 Ų | 143.6 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | trans | -119.7 | 118.9 | 167.9 | -92.5 | -86.2 | 0 | 0 | 0 | 110.2 | ||||
| 57 | T | 29.4 | Very low | 33.5 | Very low | 136 Ų | 136 | 144.2 Ų | 144.2 | 83% | 0.834 | 79% | 0.786 | S | S | * | * | trans | -133 | 127.8 | 156.9 | 26.2 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 58 | L | 33 | Very low | 33.4 | Very low | 148 Ų | 148 | 147.3 Ų | 147.3 | 78% | 0.775 | 79% | 0.791 | S | S | * | * | trans | -151.6 | 104.2 | 170.6 | -102.8 | 154.3 | 0 | 0 | 0 | 109.5 | ||||
| 59 | F | 29 | Very low | 33.4 | Very low | 200 Ų | 200 | 144.5 Ų | 144.5 | 88% | 0.877 | 79% | 0.793 | S | S | * | * | trans | -84.4 | 154.6 | 146.6 | -81.6 | -86.7 | 0 | 0 | 0 | 108 | ||||
| 60 | P | 41.2 | Very low | 33.4 | Very low | 122 Ų | 122 | 145.7 Ų | 145.7 | 79% | 0.792 | 79% | 0.79 | S | S | * | * | trans | -129.3 | 133.2 | 147.6 | 31.7 | -17.2 | 0 | 0 | 0 | 112.5 | ||||
| 61 | T | 32.6 | Very low | 33.7 | Very low | 144 Ų | 144 | 146.1 Ų | 146.1 | 88% | 0.883 | 78% | 0.779 | S | S | * | * | trans | -93.2 | 135.2 | 170.4 | -33.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 62 | G | 29.9 | Very low | 34 | Very low | 68 Ų | 68 | 145.6 Ų | 145.6 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | trans | 93.7 | 117.4 | 143 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 63 | R | 36 | Very low | 34.2 | Very low | 257 Ų | 257 | 145.8 Ų | 145.8 | 97% | 0.97 | 77% | 0.767 | S | S | * | * | -170.6 | 130.1 | 115.1 | -101.4 | 176.6 | 176.8 | -165.9 | -1.6 | 111.8 | |||||
| 64 | S | 28.4 | Very low | 34.5 | Very low | 100 Ų | 100 | 142.9 Ų | 142.9 | 70% | 0.699 | 77% | 0.768 | S | S | * | * | trans | -61.1 | 152.2 | 165.7 | 178.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 65 | V | 38.2 | Very low | 35 | Very low | 128 Ų | 128 | 144.2 Ų | 144.2 | 78% | 0.776 | 78% | 0.777 | S | S | * | * | -178.2 | 117.7 | 118.2 | 176.9 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 66 | D | 37.6 | Very low | 35.2 | Very low | 125 Ų | 125 | 140.1 Ų | 140.1 | 67% | 0.668 | 77% | 0.771 | S | S | * | * | trans | 34.6 | 138.5 | 143.4 | -68.1 | -63.1 | 0 | 0 | 0 | 126.8 | ||||
| 67 | N | 36 | Very low | 35.6 | Very low | 123 Ų | 123 | 138 Ų | 138 | 66% | 0.658 | 77% | 0.768 | S | S | * | * | 98.3 | 108.3 | 129.4 | -81.7 | -29.8 | 0 | 0 | 0 | 122.3 | |||||
| 68 | Q | 35.6 | Very low | 36.2 | Very low | 170 Ų | 170 | 139.4 Ų | 139.4 | 79% | 0.794 | 77% | 0.765 | S | S | * | * | 72.8 | 119.2 | 126.6 | -71 | -178.3 | 38.6 | 0 | 0 | 120.8 | |||||
| 69 | S | 37.4 | Very low | 36.1 | Very low | 114 Ų | 114 | 138.1 Ų | 138.1 | 80% | 0.797 | 77% | 0.767 | S | S | * | * | 135.8 | 144 | 118.4 | -167.4 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 70 | R | 37.2 | Very low | 36.6 | Very low | 196 Ų | 196 | 134.3 Ų | 134.3 | 74% | 0.74 | 77% | 0.765 | S | S | * | * | cis | 177.7 | 152.5 | -21.3 | -162.7 | 178.5 | 170.2 | -170.8 | -6.5 | 103.3 | ||||
| 71 | H | 40.3 | Very low | 36.1 | Very low | 128 Ų | 128 | 135.6 Ų | 135.6 | 59% | 0.593 | 77% | 0.765 | S | S | * | * | trans | 78.6 | 142.3 | 162.3 | -57.3 | -62.5 | 0 | 0 | 0 | 118 | ||||
| 72 | Q | 37.9 | Very low | 36.2 | Very low | 145 Ų | 145 | 135.7 Ų | 135.7 | 68% | 0.678 | 76% | 0.759 | S | S | * | * | cis | -167.5 | 145.8 | 0.5 | -112.6 | 179.8 | 64.7 | 0 | 0 | 109.6 | ||||
| 73 | L | 36.9 | Very low | 36.4 | Very low | 147 Ų | 147 | 139.6 Ų | 139.6 | 77% | 0.77 | 76% | 0.762 | S | S | * | * | trans | 61.2 | 122.8 | 140.5 | -57.6 | 171.3 | 0 | 0 | 0 | 121.8 | ||||
| 74 | S | 36.6 | Very low | 36.2 | Very low | 124 Ų | 124 | 133.5 Ų | 133.5 | 87% | 0.867 | 75% | 0.753 | S | S | * | * | -178.4 | 150.9 | 94 | -162.3 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 75 | S | 37.9 | Very low | 36.6 | Very low | 120 Ų | 120 | 134 Ų | 134 | 84% | 0.839 | 75% | 0.754 | S | S | * | * | trans | -91.3 | 164.9 | -153.7 | -63.5 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 76 | G | 36.5 | Very low | 36.3 | Very low | 67 Ų | 67 | 133.5 Ų | 133.5 | 69% | 0.691 | 75% | 0.751 | S | S | * | * | trans | 117.2 | 130.9 | 150.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 77 | D | 40.2 | Very low | 36.2 | Very low | 135 Ų | 135 | 135.1 Ų | 135.1 | 72% | 0.722 | 76% | 0.759 | S | S | * | * | cis | -174.2 | 155.9 | -0.4 | -137.2 | -28.5 | 0 | 0 | 0 | 107.5 | ||||
| 78 | H | 41.6 | Very low | 36.2 | Very low | 167 Ų | 167 | 134.5 Ų | 134.5 | 77% | 0.773 | 76% | 0.759 | S | S | * | * | trans | 91.8 | 117.7 | 159.4 | -42 | -36 | 0 | 0 | 0 | 121.8 | ||||
| 79 | C | 31.5 | Very low | 35.9 | Very low | 121 Ų | 121 | 132.6 Ų | 132.6 | 82% | 0.818 | 76% | 0.759 | S | S | * | * | trans | -77.1 | 148.2 | -176.3 | -51.8 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 80 | S | 38.8 | Very low | 35.8 | Very low | 120 Ų | 120 | 134.3 Ų | 134.3 | 84% | 0.839 | 76% | 0.756 | S | S | * | * | -173.3 | 120.3 | 115 | 21 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 81 | N | 31.8 | Very low | 35.6 | Very low | 149 Ų | 149 | 130.4 Ų | 130.4 | 80% | 0.797 | 76% | 0.756 | S | S | * | * | trans | -57.8 | 155 | 172.7 | -58.4 | -53.7 | 0 | 0 | 0 | 110.5 | ||||
| 82 | I | 33.2 | Very low | 35.5 | Very low | 145 Ų | 145 | 135.9 Ų | 135.9 | 74% | 0.744 | 77% | 0.772 | S | S | * | * | -178.3 | 123.1 | 73.4 | -80 | -175.9 | 0 | 0 | 0 | 109.7 | |||||
| 83 | I | 35 | Very low | 35.3 | Very low | 150 Ų | 150 | 137.4 Ų | 137.4 | 77% | 0.769 | 78% | 0.778 | S | S | * | * | trans | 71.2 | 109.5 | 141.9 | -53.6 | 169.4 | 0 | 0 | 0 | 121.1 | ||||
| 84 | T | 31.2 | Very low | 35.1 | Very low | 129 Ų | 129 | 135.2 Ų | 135.2 | 79% | 0.791 | 78% | 0.776 | S | S | * | * | trans | -116.9 | 130.8 | 154.6 | -31.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 85 | P | 36.7 | Very low | 35.1 | Very low | 110 Ų | 110 | 141.4 Ų | 141.4 | 71% | 0.714 | 78% | 0.78 | S | S | * | * | trans | -88.2 | 111.1 | 163 | 30.6 | -26.4 | 0 | 0 | 0 | 109.9 | ||||
| 86 | V | 31.8 | Very low | 34.9 | Very low | 118 Ų | 118 | 140.3 Ų | 140.3 | 72% | 0.715 | 77% | 0.772 | S | S | * | * | trans | -77 | 121.8 | 160.8 | 178.6 | 0 | 0 | 0 | 0 | 107.2 | V88 | V86-V88 HydrophobicContact CG1-CG2 3.74Š| ||
| 87 | I | 35.5 | Very low | 35 | Very low | 160 Ų | 160 | 144.8 Ų | 144.8 | 82% | 0.821 | 78% | 0.78 | S | S | * | * | trans | -97.4 | 106.5 | 167.9 | -62.2 | 179.5 | 0 | 0 | 0 | 107.9 | ||||
| 88 | V | 36.3 | Very low | 34.9 | Very low | 109 Ų | 109 | 141.4 Ų | 141.4 | 66% | 0.661 | 78% | 0.777 | S | S | * | * | trans | -89.4 | 127.8 | 171 | 178.6 | 0 | 0 | 0 | 0 | 108.7 | V86 | V86-V88 HydrophobicContact CG1-CG2 3.74Š| ||
| 89 | T | 30.6 | Very low | 34.6 | Very low | 131 Ų | 131 | 140.9 Ų | 140.9 | 80% | 0.804 | 78% | 0.78 | S | S | * | * | trans | -69.4 | 132.9 | 173.4 | -44 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 90 | M | 34.5 | Very low | 35.2 | Very low | 150 Ų | 150 | 142.6 Ų | 142.6 | 74% | 0.739 | 78% | 0.776 | S | S | * | * | trans | -128 | 126.7 | 170.2 | -77.7 | -66.9 | -62.7 | 0 | 0 | 110.1 | ||||
| 91 | P | 33.4 | Very low | 35 | Very low | 113 Ų | 113 | 143.3 Ų | 143.3 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | trans | -88.9 | 139.1 | 167.9 | 33.6 | -26.9 | 0 | 0 | 0 | 109.6 | ||||
| 92 | R | 37.4 | Very low | 35.4 | Very low | 244 Ų | 244 | 142.4 Ų | 142.4 | 92% | 0.921 | 76% | 0.764 | S | S | * | * | trans | -131.5 | 140.3 | 168.6 | -94.5 | -171.5 | 173.4 | 175.2 | -0.8 | 112.7 | ||||
| 93 | H | 34.4 | Very low | 35.6 | Very low | 176 Ų | 176 | 142.9 Ų | 142.9 | 82% | 0.815 | 77% | 0.768 | S | S | * | * | trans | -78.8 | 149.5 | -166.1 | -87.6 | -78.4 | 0 | 0 | 0 | 115.8 | ||||
| 94 | S | 32.3 | Very low | 35.6 | Very low | 102 Ų | 102 | 142.5 Ų | 142.5 | 71% | 0.713 | 77% | 0.767 | S | S | * | * | trans | 61.4 | 125.7 | 131.1 | -54.2 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 95 | R | 37.5 | Very low | 35.8 | Very low | 254 Ų | 254 | 142.1 Ų | 142.1 | 96% | 0.958 | 77% | 0.767 | S | S | * | * | -158.8 | 145 | 124.2 | -111.9 | 175.2 | 164.8 | -165.1 | -6.3 | 113.1 | |||||
| 96 | S | 33.5 | Very low | 35.4 | Very low | 96 Ų | 96 | 141.4 Ų | 141.4 | 67% | 0.671 | 76% | 0.76 | S | S | * | * | trans | -88.6 | 158.9 | -169 | 57.3 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 97 | N | 38.3 | Very low | 35.2 | Very low | 161 Ų | 161 | 145 Ų | 145 | 86% | 0.861 | 77% | 0.767 | S | S | * | * | 168.2 | 141.4 | 115.4 | -97.1 | 2.4 | 0 | 0 | 0 | 114.2 | |||||
| 98 | G | 38.5 | Very low | 35 | Very low | 64 Ų | 64 | 142.8 Ų | 142.8 | 66% | 0.66 | 76% | 0.761 | S | S | * | * | trans | 102 | 95.8 | 149.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 99 | N | 33.9 | Very low | 34.8 | Very low | 156 Ų | 156 | 144.8 Ų | 144.8 | 83% | 0.834 | 76% | 0.763 | S | S | * | * | 64.1 | 121.8 | 90.8 | -84.3 | -3.7 | 0 | 0 | 0 | 111.6 | |||||
| 100 | Q | 43.6 | Very low | 34.8 | Very low | 158 Ų | 158 | 144.3 Ų | 144.3 | 74% | 0.738 | 76% | 0.762 | S | S | * | * | cis | -161.4 | 150.6 | 33.3 | -66 | -174.4 | -25.4 | 0 | 0 | 110.2 | ||||
| 101 | D | 36.5 | Very low | 34.6 | Very low | 134 Ų | 134 | 144.3 Ų | 144.3 | 72% | 0.717 | 76% | 0.764 | S | S | * | * | trans | 54 | 136.8 | 132 | -70.9 | -48.5 | 0 | 0 | 0 | 119.9 | ||||
| 102 | I | 39.8 | Very low | 34.6 | Very low | 130 Ų | 130 | 142.4 Ų | 142.4 | 67% | 0.667 | 77% | 0.765 | S | S | * | * | cis | -172.5 | 151.5 | 24.7 | -104.6 | 155.6 | 0 | 0 | 0 | 107.5 | ||||
| 103 | D | 36.8 | Very low | 34.4 | Very low | 155 Ų | 155 | 137.2 Ų | 137.2 | 83% | 0.829 | 76% | 0.763 | S | S | * | * | trans | 78.4 | 115.8 | 157.9 | -69 | -30.1 | 0 | 0 | 0 | 124.3 | ||||
| 104 | L | 34.4 | Very low | 34.2 | Very low | 142 Ų | 142 | 136.7 Ų | 136.7 | 74% | 0.743 | 76% | 0.764 | S | S | * | * | trans | -87 | 158.8 | 160.6 | -102.4 | 106.7 | 0 | 0 | 0 | 110.5 | V106 | L104-V106 HydrophobicContact CD2-CG2 3.69Š| ||
| 105 | P | 36.1 | Very low | 34 | Very low | 122 Ų | 122 | 135.8 Ų | 135.8 | 79% | 0.792 | 76% | 0.763 | S | S | * | * | -140.9 | 129.2 | 87.1 | 29.8 | -10.4 | 0 | 0 | 0 | 113.3 | |||||
| 106 | V | 28.1 | Very low | 33.7 | Very low | 95 Ų | 95 | 130.3 Ų | 130.3 | 58% | 0.576 | 76% | 0.758 | S | S | * | * | 44.1 | 112.4 | 99.6 | -177.9 | 0 | 0 | 0 | 0 | 114.3 | L104 | L104-V106 HydrophobicContact CD2-CG2 3.69Š| |||
| 107 | F | 28.5 | Very low | 33.4 | Very low | 193 Ų | 193 | 129 Ų | 129 | 85% | 0.846 | 76% | 0.76 | S | S | * | * | trans | 179.1 | 97 | 130.2 | -107.3 | -82.4 | 0 | 0 | 0 | 109.1 | ||||
| 108 | T | 29.9 | Very low | 33.1 | Very low | 113 Ų | 113 | 126.7 Ų | 126.7 | 69% | 0.693 | 76% | 0.755 | S | S | * | * | 76.7 | 104.7 | 95.2 | -42.3 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 109 | E | 32.3 | Very low | 32.7 | Very low | 151 Ų | 151 | 133.3 Ų | 133.3 | 71% | 0.706 | 77% | 0.766 | S | S | * | * | trans | -64.1 | 162.1 | 160.6 | -145.8 | -156.9 | -145.7 | 0 | 0 | 110.8 | ||||
| 110 | P | 31.4 | Very low | 32.9 | Very low | 121 Ų | 121 | 136 Ų | 136 | 79% | 0.786 | 76% | 0.764 | S | S | * | * | -152.8 | 157.4 | 105.5 | 35.5 | -16.2 | 0 | 0 | 0 | 117.9 | |||||
| 111 | L | 29.2 | Very low | 32.3 | Very low | 151 Ų | 151 | 135.1 Ų | 135.1 | 79% | 0.791 | 77% | 0.765 | S | S | * | * | trans | -44.8 | 144.9 | 161.5 | -69.6 | 145.2 | 0 | 0 | 0 | 118.3 | ||||
| 112 | G | 34.2 | Very low | 32.1 | Very low | 72 Ų | 72 | 134.2 Ų | 134.2 | 74% | 0.742 | 78% | 0.775 | S | S | * | * | trans | 75.3 | 156.6 | 137.8 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 113 | P | 33.9 | Very low | 31.8 | Very low | 135 Ų | 135 | 132.6 Ų | 132.6 | 88% | 0.877 | 78% | 0.776 | S | S | * | * | -146.1 | 174.7 | 62 | 36.7 | -15.7 | 0 | 0 | 0 | 117.3 | |||||
| 114 | I | 28.4 | Very low | 31.4 | Very low | 165 Ų | 165 | 129.5 Ų | 129.5 | 85% | 0.846 | 77% | 0.772 | S | S | * | * | trans | -87.4 | 162.2 | 179.6 | -58 | 158.1 | 0 | 0 | 0 | 110.6 | ||||
| 115 | A | 29.9 | Very low | 31.3 | Very low | 83 Ų | 83 | 131.4 Ų | 131.4 | 69% | 0.686 | 78% | 0.782 | S | S | * | * | trans | 77.8 | 143.3 | 161.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 116 | T | 31.1 | Very low | 31.2 | Very low | 139 Ų | 139 | 131.2 Ų | 131.2 | 85% | 0.853 | 78% | 0.783 | S | S | * | * | cis | -165.3 | 147.4 | 26.1 | 2.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 117 | G | 25.7 | Very low | 31.4 | Very low | 70 Ų | 70 | 131 Ų | 131 | 72% | 0.722 | 79% | 0.792 | S | S | * | * | trans | 46.4 | 116.2 | 144.8 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 118 | C | 32.7 | Very low | 31.7 | Very low | 111 Ų | 111 | 129.4 Ų | 129.4 | 75% | 0.75 | 79% | 0.792 | S | S | * | * | trans | -151.2 | 107.5 | 139.6 | -92.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 119 | K | 31 | Very low | 31.7 | Very low | 204 Ų | 204 | 129.7 Ų | 129.7 | 89% | 0.887 | 80% | 0.797 | S | S | * | * | trans | -57.8 | 130 | 149.9 | -74.7 | 175.8 | 171.5 | -180 | 0 | 107.6 | ||||
| 120 | R | 37.4 | Very low | 31.8 | Very low | 212 Ų | 212 | 128.5 Ų | 128.5 | 80% | 0.8 | 80% | 0.8 | S | S | * | * | trans | -165.5 | 104.7 | 149.9 | -116.5 | 173.1 | -92.3 | 156.9 | -8 | 110.6 | ||||
| 121 | D | 31.8 | Very low | 32 | Very low | 140 Ų | 140 | 129.9 Ų | 129.9 | 75% | 0.749 | 80% | 0.799 | S | S | * | * | trans | 6.4 | 111 | 145 | -49.7 | -61.7 | 0 | 0 | 0 | 116.5 | S123 | D121-S123 VanDerWaalsContact C-N 3.29Å; D121-S123 PolarHBondContact O-N 3.31Å | ||
| 122 | A | 32.1 | Very low | 32.5 | Very low | 114 Ų | 114 | 127.5 Ų | 127.5 | 94% | 0.942 | 79% | 0.793 | S | S | * | * | trans | -90.5 | 75.9 | 150.3 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 123 | S | 32.1 | Very low | 32.7 | Very low | 96 Ų | 96 | 129.7 Ų | 129.7 | 67% | 0.671 | 79% | 0.794 | S | S | * | * | trans | -74.8 | 131.9 | 164.2 | -78.1 | 0 | 0 | 0 | 0 | 110.2 | D121 | D121-S123 VanDerWaalsContact C-N 3.29Å; D121-S123 PolarHBondContact O-N 3.31Å | ||
| 124 | A | 29 | Very low | 32.9 | Very low | 91 Ų | 91 | 131.2 Ų | 131.2 | 75% | 0.752 | 79% | 0.793 | S | S | * | * | trans | 53.5 | 91.5 | 134.9 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 125 | L | 32.9 | Very low | 33.3 | Very low | 182 Ų | 182 | 129.8 Ų | 129.8 | 95% | 0.953 | 79% | 0.793 | S | S | * | * | trans | -145.4 | 121.9 | 140.9 | -66.7 | 171.3 | 0 | 0 | 0 | 103.5 | ||||
| 126 | S | 32.9 | Very low | 33.6 | Very low | 117 Ų | 117 | 131.7 Ų | 131.7 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | cis | -160.8 | 132.9 | 37.4 | 174.7 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 127 | A | 32.4 | Very low | 33.9 | Very low | 92 Ų | 92 | 131.6 Ų | 131.6 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | trans | -74.4 | 121.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 128 | N | 34.3 | Very low | 34.5 | Very low | 159 Ų | 159 | 131.9 Ų | 131.9 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | trans | -176.7 | 90.1 | 144 | -115.8 | -6.1 | 0 | 0 | 0 | 109.9 | ||||
| 129 | C | 31.9 | Very low | 34.8 | Very low | 118 Ų | 118 | 134.1 Ų | 134.1 | 80% | 0.797 | 80% | 0.796 | S | S | * | * | trans | -151.5 | 97.8 | 157.8 | -178.3 | 0 | 0 | 0 | 0 | 107.3 | I131 | C129-I131 PolarHBondContact O-N 3.42Š| ||
| 130 | T | 33.2 | Very low | 35.2 | Very low | 126 Ų | 126 | 132.8 Ų | 132.8 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 116.3 | 176.3 | -56.5 | 0 | 0 | 0 | 0 | 109.7 | ||
| 131 | I | 35.5 | Very low | 35.2 | Very low | 150 Ų | 150 | 127.3 Ų | 127.3 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -85.9 | 122.8 | 167.6 | -59 | 172.7 | 0 | 0 | 0 | 107 | C129 | C129-I131 PolarHBondContact O-N 3.42Š|
| 132 | P | 40.5 | Very low | 35.4 | Very low | 101 Ų | 101 | 128.8 Ų | 128.8 | 66% | 0.656 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 145.5 | 173.6 | 28.4 | -31.8 | 0 | 0 | 0 | 111.2 | ||
| 133 | P | 38.9 | Very low | 35.6 | Very low | 119 Ų | 119 | 130.4 Ų | 130.4 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 141.9 | -172.1 | 30.6 | -33.7 | 0 | 0 | 0 | 112.4 | T135 | P133-T135 PolarHBondContact O-N 3.5Š|
| 134 | I | 36.4 | Very low | 35.8 | Very low | 166 Ų | 166 | 131.6 Ų | 131.6 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 124.1 | 174.3 | -33.9 | 169.6 | 0 | 0 | 0 | 108 | ||
| 135 | T | 37.5 | Very low | 36.1 | Very low | 136 Ų | 136 | 134.6 Ų | 134.6 | 83% | 0.834 | 80% | 0.803 | S | S | * | * | trans | -111.5 | 105.1 | 167.1 | -15 | 0 | 0 | 0 | 0 | 109.1 | P133 | P133-T135 PolarHBondContact O-N 3.5Š| ||
| 136 | T | 36.9 | Very low | 36.1 | Very low | 123 Ų | 123 | 133.7 Ų | 133.7 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | trans | -49 | 136.7 | 163 | -56.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 137 | T | 37.4 | Very low | 36.3 | Very low | 136 Ų | 136 | 136.4 Ų | 136.4 | 83% | 0.834 | 80% | 0.798 | S | S | * | * | trans | -169.7 | 136.8 | 136.1 | -64.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 138 | A | 36.7 | Very low | 36.5 | Very low | 77 Ų | 77 | 138.2 Ų | 138.2 | 64% | 0.636 | 80% | 0.804 | S | S | * | * | trans | 82.3 | 89.5 | 159.4 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 139 | N | 38.8 | Very low | 36.7 | Very low | 158 Ų | 158 | 135.4 Ų | 135.4 | 85% | 0.845 | 79% | 0.793 | S | S | * | * | 46.3 | 90.7 | 119.1 | -58.9 | -13.1 | 0 | 0 | 0 | 119.6 | |||||
| 140 | I | 41.1 | Very low | 37.2 | Very low | 176 Ų | 176 | 136.9 Ų | 136.9 | 90% | 0.903 | 79% | 0.792 | S | S | * | * | trans | -148.2 | 141.2 | 138.7 | -53.5 | -176.2 | 0 | 0 | 0 | 108.8 | ||||
| 141 | A | 37 | Very low | 37.3 | Very low | 96 Ų | 96 | 141.1 Ų | 141.1 | 79% | 0.793 | 80% | 0.795 | S | S | * | * | trans | -71 | 153.4 | -168.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 142 | L | 35.8 | Very low | 37.5 | Very low | 171 Ų | 171 | 141 Ų | 141 | 90% | 0.895 | 80% | 0.795 | S | S | * | * | trans | -41.2 | 124.9 | 174.8 | -132.5 | 76.3 | 0 | 0 | 0 | 114.9 | ||||
| 143 | D | 36.4 | Very low | 37.9 | Very low | 149 Ų | 149 | 141.3 Ų | 141.3 | 80% | 0.797 | 80% | 0.797 | S | S | * | * | trans | -154.6 | 101.7 | 143.6 | -136.5 | -24.2 | 0 | 0 | 0 | 112.4 | ||||
| 144 | T | 36.4 | Very low | 39 | Very low | 120 Ų | 120 | 141.5 Ų | 141.5 | 74% | 0.736 | 80% | 0.798 | S | S | * | * | trans | 29.1 | 88.5 | 137.1 | -19.6 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 145 | N | 35.8 | Very low | 40.5 | Very low | 155 Ų | 155 | 143 Ų | 143 | 83% | 0.829 | 80% | 0.799 | S | S | * | * | trans | -178.7 | 110.8 | 130.8 | -124.4 | -60.1 | 0 | 0 | 0 | 112.1 | Q147 | N145-Q147 PolarHBondContact O-N 3.35Š| ||
| 146 | D | 31.8 | Very low | 42.1 | Very low | 162 Ų | 162 | 139.5 Ų | 139.5 | 87% | 0.866 | 78% | 0.778 | S | S | * | * | trans | -77.5 | 114.5 | 170.4 | -74.8 | -52.7 | 0 | 0 | 0 | 111.3 | ||||
| 147 | Q | 37.7 | Very low | 44.1 | Very low | 174 Ų | 174 | 141.5 Ų | 141.5 | 81% | 0.813 | 78% | 0.776 | S | S | * | * | trans | -140.3 | 91.8 | 152.8 | -108 | -174.1 | 20.7 | 0 | 0 | 110.5 | N145 T149 | N145-Q147 PolarHBondContact O-N 3.35Å; Q147-T149 PolarHBondContact O-N 2.97Å; Q147-T149 PolarHBondContact O-OG1 3.1Å | ||
| 148 | C | 35.9 | Very low | 45.7 | Very low | 131 Ų | 131 | 140 Ų | 140 | 89% | 0.885 | 76% | 0.76 | S | S | * | * | trans | -64.7 | 98.1 | 166.9 | -156.9 | 0 | 0 | 0 | 0 | 108.4 | I150 | C148-I150 PolarHBondContact O-N 3.38Š| ||
| 149 | T | 38.1 | Very low | 47.5 | Very low | 100 Ų | 100 | 140.1 Ų | 140.1 | 61% | 0.613 | 76% | 0.756 | S | S | * | * | trans | -84.2 | 107.1 | -178.6 | -52.1 | 0 | 0 | 0 | 0 | 108.7 | Q147 Y151 | Q147-T149 PolarHBondContact O-N 2.97Å; Q147-T149 PolarHBondContact O-OG1 3.1Å; T149-Y151 PolarHBondContact O-N 3.14Å; T149-Y151 VanDerWaalsContact O-N 3.1Å | ||
| 150 | I | 43.6 | Very low | 49.2 | Very low | 149 Ų | 149 | 138.4 Ų | 138.4 | 76% | 0.764 | 74% | 0.743 | S | S | * | * | trans | -66.9 | 106.7 | 174.2 | -58.6 | 173.8 | 0 | 0 | 0 | 108.3 | C148 L152 | C148-I150 PolarHBondContact O-N 3.38Å; I150-L152 PolarHBondContact O-N 3.07Å; I150-L152 VanDerWaalsContact O-N 3.07Å | ||
| 151 | Y | 36.1 | Very low | 50.8 | Low | 215 Ų | 215 | 135.1 Ų | 135.1 | 84% | 0.843 | 72% | 0.719 | S | S | * | * | trans | -68.2 | 101.4 | 172.1 | -87.6 | -96.3 | 0 | 0 | 0 | 109.8 | T149 | T149-Y151 PolarHBondContact O-N 3.14Å; T149-Y151 VanDerWaalsContact O-N 3.1Å | ||
| 152 | L | 39.5 | Very low | 52.6 | Low | 148 Ų | 148 | 135.1 Ų | 135.1 | 78% | 0.775 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 136.8 | 166.9 | -78.7 | 152.2 | 0 | 0 | 0 | 109.2 | I150 | I150-L152 PolarHBondContact O-N 3.07Å; I150-L152 VanDerWaalsContact O-N 3.07Å |
| 153 | P | 48 | Very low | 54.6 | Low | 107 Ų | 107 | 131.6 Ų | 131.6 | 70% | 0.695 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 143.4 | 174.5 | 23.8 | -32 | 0 | 0 | 0 | 110 | K155 | P153-K155 PolarHBondContact O-N 3.37Š|
| 154 | P | 62.4 | Low | 56.4 | Low | 122 Ų | 122 | 130.7 Ų | 130.7 | 79% | 0.792 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 133.6 | -179.9 | 20 | -30.1 | 0 | 0 | 0 | 109.9 | P156 | P154-P156 VanDerWaalsContact O-N 3.15Š|
| 155 | K | 67.4 | Low | 58.3 | Low | 199 Ų | 199 | 128.4 Ų | 128.4 | 87% | 0.865 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -54 | 124.1 | 177.6 | -70 | 179.1 | -179.1 | 170.5 | 0 | 108 | P153 K157 | P153-K155 PolarHBondContact O-N 3.37Å; K155-K157 PolarHBondContact O-N 2.85Å |
| 156 | P | 72 | Confident | 60.3 | Low | 62 Ų | 62 | 126.5 Ų | 126.5 | 40% | 0.403 | 64% | 0.643 | S | S | . | * | P | Polyproline II helix | trans | -55.1 | 139.9 | 179.5 | 19.3 | -30.2 | 0 | 0 | 0 | 109.5 | P154 E160 R161 | P154-P156 VanDerWaalsContact O-N 3.15Å; P156-E160 HydrophobicContact CB-CB 4.15Å; P156-E160 HydrophobicContact CB-CG 4.19Å; P156-E160 WeakPolarHBondContact CB-OE2 3.47Å; P156-R161 HydrophobicContact CB-CG 4.17Å; P156-R161 HydrophobicContact CG-CG 3.77Å |
| 157 | K | 79.1 | Confident | 62.5 | Low | 165 Ų | 165 | 126.4 Ų | 126.4 | 72% | 0.717 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 149.9 | 175.7 | -69.2 | 179.2 | 179.4 | 176 | 0 | 108.9 | K155 S159 E160 R161 | K155-K157 PolarHBondContact O-N 2.85Å; K157-S159 PolarHBondContact O-N 3.44Å; K157-S159 VanDerWaalsContact O-N 3.09Å; K157-E160 WeakPolarHBondContact O-CB 3.34Å; K157-E160 PolarHBondContact O-N 3.2Å; K157-R161 PolarHBondContact O-N 3.12Å; K157-R161 VanDerWaalsContact O-N 3.08Å |
| 158 | E | 69.4 | Low | 64.4 | Low | 104 Ų | 104 | 125.4 Ų | 125.4 | 49% | 0.486 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -49.7 | -40.1 | 178.8 | -175.2 | 67 | -133.8 | 0 | 0 | 111.5 | E160 R161 M162 | E158-E160 VanDerWaalsContact C-N 3.32Å; E158-E160 PolarHBondContact O-N 2.83Å; E158-R161 PolarHBondContact O-N 2.59Å; E158-R161 IonicContact OE1-CZ 3.02Å; E158-R161 IonicContact OE1-NH1 3.58Å; E158-R161 IonicContact OE1-NH2 2.78Å; E158-R161 PolarHBondContact OE1-NH2 3.32Å; E158-R161 IonicContact OE2-CZ 2.76Å; E158-R161 VanDerWaalsContact OE2-CZ 3.28Å; E158-R161 IonicContact OE2-NH1 2.61Å; E158-R161 PolarHBondContact OE2-NH1 3.25Å; E158-R161 IonicContact OE2-NH2 3.35Å; E158-R161 PolarHBondContact OE2-NH2 2.93Å; E158-M162 HydrophobicContact CG-CG 4.21Å; E158-M162 WeakPolarHBondContact O-CB 3.46Å; E158-M162 VanDerWaalsContact O-CG 3.24Å; E158-M162 WeakPolarHBondContact O-CG 3.36Å; E158-M162 PolarHBondContact O-N 2.92Å |
| 159 | S | 74.5 | Confident | 66.4 | Low | 80 Ų | 80 | 121.5 Ų | 121.5 | 56% | 0.559 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -57.7 | -40.9 | 176.6 | 56.8 | 0 | 0 | 0 | 0 | 113.4 | K157 M162 M163 | K157-S159 PolarHBondContact O-N 3.44Å; K157-S159 VanDerWaalsContact O-N 3.09Å; S159-M162 PolarHBondContact O-N 2.93Å; S159-M163 WeakPolarHBondContact O-CB 3.45Å; S159-M163 VanDerWaalsContact O-CG 3.27Å; S159-M163 WeakPolarHBondContact O-CG 3.24Å; S159-M163 PolarHBondContact O-N 3.18Å |
| 160 | E | 75.8 | Confident | 68 | Low | 122 Ų | 122 | 122.1 Ų | 122.1 | 57% | 0.57 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -74.3 | -38.8 | 179.8 | -172.4 | 174.3 | -165 | 0 | 0 | 111.3 | P156 K157 E158 M162 M163 H164 | P156-E160 HydrophobicContact CB-CB 4.15Å; P156-E160 HydrophobicContact CB-CG 4.19Å; P156-E160 WeakPolarHBondContact CB-OE2 3.47Å; K157-E160 WeakPolarHBondContact O-CB 3.34Å; K157-E160 PolarHBondContact O-N 3.2Å; E158-E160 VanDerWaalsContact C-N 3.32Å; E158-E160 PolarHBondContact O-N 2.83Å; E160-M162 VanDerWaalsContact C-N 3.34Å; E160-M162 PolarHBondContact O-N 3.05Å; E160-M163 PolarHBondContact O-N 2.9Å; E160-H164 WeakPolarHBondContact O-CB 3.35Å; E160-H164 PolarHBondContact O-N 3.08Å |
| 161 | R | 74.2 | Confident | 69.5 | Low | 106 Ų | 106 | 122.4 Ų | 122.4 | 40% | 0.4 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -60.1 | -44.4 | 170.4 | -78.3 | -178.9 | 35.8 | -116 | -28.4 | 111.8 | P156 K157 E158 H164 I165 | P156-R161 HydrophobicContact CB-CG 4.17Å; P156-R161 HydrophobicContact CG-CG 3.77Å; K157-R161 PolarHBondContact O-N 3.12Å; K157-R161 VanDerWaalsContact O-N 3.08Å; E158-R161 PolarHBondContact O-N 2.59Å; E158-R161 IonicContact OE1-CZ 3.02Å; E158-R161 IonicContact OE1-NH1 3.58Å; E158-R161 IonicContact OE1-NH2 2.78Å; E158-R161 PolarHBondContact OE1-NH2 3.32Å; E158-R161 IonicContact OE2-CZ 2.76Å; E158-R161 VanDerWaalsContact OE2-CZ 3.28Å; E158-R161 IonicContact OE2-NH1 2.61Å; E158-R161 PolarHBondContact OE2-NH1 3.25Å; E158-R161 IonicContact OE2-NH2 3.35Å; E158-R161 PolarHBondContact OE2-NH2 2.93Å; R161-H164 PolarHBondContact O-N 3.27Å; R161-I165 WeakPolarHBondContact O-CD1 3.27Å; R161-I165 VanDerWaalsContact O-CG1 3.24Å; R161-I165 WeakPolarHBondContact O-CG1 3.24Å; R161-I165 PolarHBondContact O-N 3.49Å |
| 162 | M | 75.8 | Confident | 71.1 | Confident | 97 Ų | 97 | 115 Ų | 115 | 48% | 0.478 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65.8 | -40.5 | 178.9 | -71.2 | -57 | -65.6 | 0 | 0 | 111.5 | E158 S159 E160 H164 I165 Q166 | E158-M162 HydrophobicContact CG-CG 4.21Å; E158-M162 WeakPolarHBondContact O-CB 3.46Å; E158-M162 VanDerWaalsContact O-CG 3.24Å; E158-M162 WeakPolarHBondContact O-CG 3.36Å; E158-M162 PolarHBondContact O-N 2.92Å; S159-M162 PolarHBondContact O-N 2.93Å; E160-M162 VanDerWaalsContact C-N 3.34Å; E160-M162 PolarHBondContact O-N 3.05Å; M162-H164 PolarHBondContact O-N 2.89Å; M162-I165 PolarHBondContact O-N 3.28Å; M162-I165 HydrophobicContact SD-CD1 4.13Å; M162-Q166 WeakPolarHBondContact O-CB 3.48Å; M162-Q166 PolarHBondContact O-N 2.88Å |
| 163 | M | 76.3 | Confident | 72.5 | Confident | 96 Ų | 96 | 113.3 Ų | 113.3 | 47% | 0.473 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -62.2 | -40.8 | 172.4 | -75.6 | -64.8 | -65.1 | 0 | 0 | 112.4 | S159 E160 Q166 R167 | S159-M163 WeakPolarHBondContact O-CB 3.45Å; S159-M163 VanDerWaalsContact O-CG 3.27Å; S159-M163 WeakPolarHBondContact O-CG 3.24Å; S159-M163 PolarHBondContact O-N 3.18Å; E160-M163 PolarHBondContact O-N 2.9Å; M163-Q166 PolarHBondContact O-N 3.19Å; M163-R167 WeakPolarHBondContact O-CG 3.5Å; M163-R167 PolarHBondContact O-N 3.41Å |
| 164 | H | 74.9 | Confident | 72.8 | Confident | 131 Ų | 131 | 116.5 Ų | 116.5 | 61% | 0.606 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -64.2 | -45 | 175.4 | -176 | 87.8 | 0 | 0 | 0 | 111.7 | E160 R161 M162 Q166 R167 W168 | E160-H164 WeakPolarHBondContact O-CB 3.35Å; E160-H164 PolarHBondContact O-N 3.08Å; R161-H164 PolarHBondContact O-N 3.27Å; M162-H164 PolarHBondContact O-N 2.89Å; H164-Q166 VanDerWaalsContact C-N 3.32Å; H164-Q166 PolarHBondContact O-N 3.35Å; H164-R167 PolarHBondContact O-N 3.09Å; H164-W168 WeakPolarHBondContact O-CB 3.32Å; H164-W168 PolarHBondContact O-N 2.9Å |
| 165 | I | 75.1 | Confident | 72 | Confident | 71 Ų | 71 | 115.3 Ų | 115.3 | 36% | 0.364 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.5 | -44.1 | 175.3 | -68.1 | 162.5 | 0 | 0 | 0 | 110.1 | R161 M162 W168 V169 | R161-I165 WeakPolarHBondContact O-CD1 3.27Å; R161-I165 VanDerWaalsContact O-CG1 3.24Å; R161-I165 WeakPolarHBondContact O-CG1 3.24Å; R161-I165 PolarHBondContact O-N 3.49Å; M162-I165 PolarHBondContact O-N 3.28Å; M162-I165 HydrophobicContact SD-CD1 4.13Å; I165-W168 PolarHBondContact O-N 2.86Å; I165-V169 HydrophobicContact CG2-CG2 4.12Å; I165-V169 WeakPolarHBondContact O-CB 3.49Å; I165-V169 VanDerWaalsContact O-CG2 3.24Å; I165-V169 WeakPolarHBondContact O-CG2 3.38Å; I165-V169 PolarHBondContact O-N 3.37Å |
| 166 | Q | 77.7 | Confident | 71.1 | Confident | 116 Ų | 116 | 113.3 Ų | 113.3 | 54% | 0.542 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.9 | -42.4 | -179.6 | -166.3 | 162.2 | 19.9 | 0 | 0 | 112 | M162 M163 H164 N170 | M162-Q166 WeakPolarHBondContact O-CB 3.48Å; M162-Q166 PolarHBondContact O-N 2.88Å; M163-Q166 PolarHBondContact O-N 3.19Å; H164-Q166 VanDerWaalsContact C-N 3.32Å; H164-Q166 PolarHBondContact O-N 3.35Å; Q166-N170 WeakPolarHBondContact O-CB 3.43Å; Q166-N170 PolarHBondContact O-N 2.95Å; Q166-N170 PolarHBondContact O-ND2 3.49Å |
| 167 | R | 79 | Confident | 69.9 | Low | 159 Ų | 159 | 116.8 Ų | 116.8 | 60% | 0.6 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -59.8 | -47.7 | 170.8 | -72.4 | 177.1 | -177 | 177.2 | 1.6 | 111.2 | M163 H164 V169 N170 H171 | M163-R167 WeakPolarHBondContact O-CG 3.5Å; M163-R167 PolarHBondContact O-N 3.41Å; H164-R167 PolarHBondContact O-N 3.09Å; R167-V169 PolarHBondContact O-N 3.47Å; R167-N170 PolarHBondContact O-N 2.88Å; R167-H171 PolarHBondContact O-CD2 3.03Å; R167-H171 PolarHBondContact O-N 3.34Å |
| 168 | W | 78 | Confident | 68.1 | Low | 154 Ų | 154 | 114.5 Ų | 114.5 | 58% | 0.583 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -59.6 | -47.6 | 179.8 | 178.2 | 69.6 | 0 | 0 | 0 | 112.4 | H164 I165 N170 H171 L172 | H164-W168 WeakPolarHBondContact O-CB 3.32Å; H164-W168 PolarHBondContact O-N 2.9Å; I165-W168 PolarHBondContact O-N 2.86Å; W168-N170 VanDerWaalsContact C-N 3.31Å; W168-N170 PolarHBondContact O-N 3.38Å; W168-H171 PolarHBondContact O-N 3.46Å; W168-H171 VanDerWaalsContact O-N 3.13Å; W168-L172 HydrophobicContact CH2-CD1 4.47Å; W168-L172 HydrophobicContact CZ2-CD2 4.11Å; W168-L172 HydrophobicContact CZ3-CD1 4.47Å; W168-L172 PolarHBondContact O-N 2.94Å |
| 169 | V | 76.7 | Confident | 66.9 | Low | 49 Ų | 49 | 114.9 Ų | 114.9 | 30% | 0.297 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.4 | -38.8 | 177 | 172.5 | 0 | 0 | 0 | 0 | 111.5 | I165 R167 H171 L172 W174 | I165-V169 HydrophobicContact CG2-CG2 4.12Å; I165-V169 WeakPolarHBondContact O-CB 3.49Å; I165-V169 VanDerWaalsContact O-CG2 3.24Å; I165-V169 WeakPolarHBondContact O-CG2 3.38Å; I165-V169 PolarHBondContact O-N 3.37Å; R167-V169 PolarHBondContact O-N 3.47Å; V169-H171 VanDerWaalsContact C-N 3.3Å; V169-H171 PolarHBondContact O-N 3.22Å; V169-L172 WeakPolarHBondContact O-CB 3.48Å; V169-L172 PolarHBondContact O-N 3.24Å; V169-W174 HydrophobicContact CG1-CZ2 3.81Å; V169-W174 PolarHBondContact O-NE1 3.38Å; V169-W174 VanDerWaalsContact O-NE1 3.1Å |
| 170 | N | 72.9 | Confident | 65.2 | Low | 113 Ų | 113 | 114.6 Ų | 114.6 | 60% | 0.604 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -69.9 | -25.6 | 176.8 | -70.7 | -15.5 | 0 | 0 | 0 | 113.3 | Q166 R167 W168 | Q166-N170 WeakPolarHBondContact O-CB 3.43Å; Q166-N170 PolarHBondContact O-N 2.95Å; Q166-N170 PolarHBondContact O-ND2 3.49Å; R167-N170 PolarHBondContact O-N 2.88Å; W168-N170 VanDerWaalsContact C-N 3.31Å; W168-N170 PolarHBondContact O-N 3.38Å |
| 171 | H | 73.8 | Confident | 63.7 | Low | 154 Ų | 154 | 112.4 Ų | 112.4 | 71% | 0.713 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.2 | -1.5 | 176.8 | -66.9 | -55.1 | 0 | 0 | 0 | 113.7 | R167 W168 V169 | R167-H171 PolarHBondContact O-CD2 3.03Å; R167-H171 PolarHBondContact O-N 3.34Å; W168-H171 PolarHBondContact O-N 3.46Å; W168-H171 VanDerWaalsContact O-N 3.13Å; V169-H171 VanDerWaalsContact C-N 3.3Å; V169-H171 PolarHBondContact O-N 3.22Å |
| 172 | L | 71.2 | Confident | 62.4 | Low | 60 Ų | 60 | 113.2 Ų | 113.2 | 31% | 0.314 | 58% | 0.583 | S | S | . | * | S | Bend | trans | -64.9 | 133 | 171.9 | -72.2 | 169.2 | 0 | 0 | 0 | 109.1 | W168 V169 W174 | W168-L172 HydrophobicContact CH2-CD1 4.47Å; W168-L172 HydrophobicContact CZ2-CD2 4.11Å; W168-L172 HydrophobicContact CZ3-CD1 4.47Å; W168-L172 PolarHBondContact O-N 2.94Å; V169-L172 WeakPolarHBondContact O-CB 3.48Å; V169-L172 PolarHBondContact O-N 3.24Å; L172-W174 HydrophobicContact CB-CZ2 4.46Å; L172-W174 HydrophobicContact CD1-CZ2 4.32Å; L172-W174 PolarHBondContact O-N 3.03Å; L172-W174 PolarHBondContact O-NE1 3.48Å |
| 173 | P | 68.7 | Low | 61.3 | Low | 112 Ų | 112 | 112.4 Ų | 112.4 | 73% | 0.727 | 59% | 0.587 | S | S | * | * | trans | -69.5 | 95.2 | 174 | 28.1 | -32.3 | 0 | 0 | 0 | 108.5 | N175 | P173-N175 PolarHBondContact O-N 3.27Š| ||
| 174 | W | 54.8 | Low | 59.8 | Low | 174 Ų | 174 | 110.5 Ų | 110.5 | 66% | 0.659 | 59% | 0.592 | S | S | * | * | trans | -70.3 | 23.5 | 175.3 | -63.2 | 100.1 | 0 | 0 | 0 | 113.5 | V169 L172 L176 | V169-W174 HydrophobicContact CG1-CZ2 3.81Å; V169-W174 PolarHBondContact O-NE1 3.38Å; V169-W174 VanDerWaalsContact O-NE1 3.1Å; L172-W174 HydrophobicContact CB-CZ2 4.46Å; L172-W174 HydrophobicContact CD1-CZ2 4.32Å; L172-W174 PolarHBondContact O-N 3.03Å; L172-W174 PolarHBondContact O-NE1 3.48Å; W174-L176 PolarHBondContact O-N 2.82Å; W174-L176 VanDerWaalsContact O-N 3.11Å | ||
| 175 | N | 45.6 | Very low | 58.4 | Low | 97 Ų | 97 | 113.1 Ų | 113.1 | 52% | 0.519 | 60% | 0.597 | S | S | . | * | trans | -80.4 | 98.1 | 177.8 | -129.4 | -34.7 | 0 | 0 | 0 | 107.8 | P173 N177 N178 | P173-N175 PolarHBondContact O-N 3.27Å; N175-N177 PolarHBondContact O-N 3.18Å; N175-N178 PolarHBondContact O-N 3.13Å | ||
| 176 | L | 48.3 | Very low | 56.8 | Low | 157 Ų | 157 | 115 Ų | 115 | 82% | 0.822 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53 | -13.7 | 175.2 | -85 | 91.5 | 0 | 0 | 0 | 113.2 | W174 | W174-L176 PolarHBondContact O-N 2.82Å; W174-L176 VanDerWaalsContact O-N 3.11Å |
| 177 | N | 47.1 | Very low | 55.3 | Low | 136 Ų | 136 | 115.3 Ų | 115.3 | 73% | 0.727 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.8 | -5.2 | 179.5 | -63.5 | -19.1 | 0 | 0 | 0 | 114.7 | N175 | N175-N177 PolarHBondContact O-N 3.18Š|
| 178 | N | 40.8 | Very low | 53.6 | Low | 116 Ų | 116 | 113.1 Ų | 113.1 | 62% | 0.62 | 62% | 0.619 | S | S | * | * | trans | -115.6 | 29.6 | -175.3 | -83.3 | 6.7 | 0 | 0 | 0 | 114.5 | N175 C180 | N175-N178 PolarHBondContact O-N 3.13Å; N178-C180 PolarHBondContact O-N 3.41Å | ||
| 179 | V | 43.5 | Very low | 52 | Low | 113 Ų | 113 | 111.1 Ų | 111.1 | 69% | 0.685 | 63% | 0.626 | S | S | * | * | trans | -77.1 | 72.5 | 167.5 | -168.3 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 180 | C | 38.8 | Very low | 50.4 | Low | 73 Ų | 73 | 117.5 Ų | 117.5 | 49% | 0.493 | 65% | 0.646 | S | S | . | * | B | Isolated β-bridge | trans | -73.4 | 128.5 | 164.2 | -66.3 | 0 | 0 | 0 | 0 | 107.7 | N178 | N178-C180 PolarHBondContact O-N 3.41Å |
| 181 | D | 43.9 | Very low | 48.9 | Very low | 77 Ų | 77 | 117.6 Ų | 117.6 | 41% | 0.412 | 65% | 0.652 | S | S | . | * | trans | -63.3 | 168.1 | 164.7 | 59.1 | 21.5 | 0 | 0 | 0 | 110.2 | S183 G184 R185 | D181-S183 PolarHBondContact O-N 3.34Å; D181-S183 WeakPolarHBondContact OD1-CA 3.41Å; D181-S183 WeakPolarHBondContact OD1-CB 3.14Å; D181-S183 PolarHBondContact OD1-N 3.45Å; D181-S183 PolarHBondContact OD1-OG 2.89Å; D181-S183 PolarHBondContact OD2-OG 2.88Å; D181-S183 VanDerWaalsContact OD2-OG 3.12Å; D181-G184 PolarHBondContact O-N 3.46Å; D181-G184 PolarHBondContact OD1-N 2.88Å; D181-R185 PolarHBondContact OD1-N 3.21Å | ||
| 182 | A | 48.4 | Very low | 47.3 | Very low | 122 Ų | 122 | 117.2 Ų | 117.2 | 100% | 1.008 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.4 | -1.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 183 | S | 52.1 | Low | 45.8 | Very low | 81 Ų | 81 | 119.4 Ų | 119.4 | 57% | 0.566 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.2 | 1.3 | 174.9 | 85.8 | 0 | 0 | 0 | 0 | 113.9 | D181 R185 | D181-S183 PolarHBondContact O-N 3.34Å; D181-S183 WeakPolarHBondContact OD1-CA 3.41Å; D181-S183 WeakPolarHBondContact OD1-CB 3.14Å; D181-S183 PolarHBondContact OD1-N 3.45Å; D181-S183 PolarHBondContact OD1-OG 2.89Å; D181-S183 PolarHBondContact OD2-OG 2.88Å; D181-S183 VanDerWaalsContact OD2-OG 3.12Å; S183-R185 PolarHBondContact O-N 3.1Å |
| 184 | G | 45.1 | Very low | 44.2 | Very low | 56 Ų | 56 | 120.7 Ų | 120.7 | 58% | 0.577 | 68% | 0.678 | S | S | * | * | trans | 68.2 | 15.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | D181 | D181-G184 PolarHBondContact O-N 3.46Å; D181-G184 PolarHBondContact OD1-N 2.88Å | ||
| 185 | R | 43.9 | Very low | 43.3 | Very low | 186 Ų | 186 | 123 Ų | 123 | 70% | 0.702 | 69% | 0.686 | S | S | * | * | trans | -88.4 | 128.4 | 177.6 | -79.4 | -172.3 | 174.7 | -165.5 | -0.2 | 110.4 | D181 S183 H187 | D181-R185 PolarHBondContact OD1-N 3.21Å; S183-R185 PolarHBondContact O-N 3.1Å; R185-H187 PolarHBondContact O-N 3.01Å; R185-H187 VanDerWaalsContact O-N 3.16Å | ||
| 186 | P | 42.3 | Very low | 42.7 | Very low | 109 Ų | 109 | 123.2 Ų | 123.2 | 71% | 0.708 | 70% | 0.695 | S | S | * | * | B | Isolated β-bridge | trans | -66.7 | 114.9 | 172.1 | 26.2 | -30.4 | 0 | 0 | 0 | 108.5 | V188 | P186-V188 PolarHBondContact O-N 3.16Å |
| 187 | H | 45.4 | Very low | 41.9 | Very low | 124 Ų | 124 | 123.1 Ų | 123.1 | 57% | 0.574 | 69% | 0.69 | S | S | * | * | trans | -74.3 | 108.4 | 173.9 | -153.8 | -74.2 | 0 | 0 | 0 | 107.9 | R185 Y190 | R185-H187 PolarHBondContact O-N 3.01Å; R185-H187 VanDerWaalsContact O-N 3.16Å; H187-Y190 AromaticContact CE1-CD2 3.51Å; H187-Y190 AromaticContact CE1-CE2 3.67Å | ||
| 188 | V | 43.7 | Very low | 41.6 | Very low | 113 Ų | 113 | 124.4 Ų | 124.4 | 69% | 0.685 | 70% | 0.695 | S | S | * | * | trans | -55.1 | 128.6 | 165.9 | -175.7 | 0 | 0 | 0 | 0 | 106.7 | P186 Y190 | P186-V188 PolarHBondContact O-N 3.16Å; V188-Y190 PolarHBondContact O-N 2.88Å | ||
| 189 | P | 45.7 | Very low | 41.4 | Very low | 112 Ų | 112 | 124.5 Ų | 124.5 | 73% | 0.727 | 70% | 0.696 | S | S | * | * | trans | -65.5 | 108.8 | 178.3 | 25.2 | -29.5 | 0 | 0 | 0 | 106.8 | ||||
| 190 | Y | 41.5 | Very low | 41 | Very low | 183 Ų | 183 | 125 Ų | 125 | 72% | 0.718 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -57 | 134.7 | 166.6 | -81.5 | -97.7 | 0 | 0 | 0 | 107.2 | H187 V188 I192 | H187-Y190 AromaticContact CE1-CD2 3.51Å; H187-Y190 AromaticContact CE1-CE2 3.67Å; V188-Y190 PolarHBondContact O-N 2.88Å; Y190-I192 PolarHBondContact O-N 3.18Å |
| 191 | P | 42.2 | Very low | 41 | Very low | 114 Ų | 114 | 129.1 Ų | 129.1 | 74% | 0.74 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 120.7 | 177.6 | 25.4 | -31.1 | 0 | 0 | 0 | 107.1 | P193 | P191-P193 VanDerWaalsContact O-CD 3.22Å; P191-P193 WeakPolarHBondContact O-CD 3.43Å |
| 192 | I | 40.8 | Very low | 40.8 | Very low | 147 Ų | 147 | 136.8 Ų | 136.8 | 75% | 0.754 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 118.3 | 170.6 | -60.8 | 171.2 | 0 | 0 | 0 | 105.6 | Y190 V194 | Y190-I192 PolarHBondContact O-N 3.18Å; I192-V194 PolarHBondContact O-N 2.89Å |
| 193 | P | 39.4 | Very low | 40.3 | Very low | 106 Ų | 106 | 139.1 Ų | 139.1 | 69% | 0.688 | 73% | 0.725 | S | S | * | * | trans | -62.4 | 109.3 | 171.2 | -15.6 | 29.1 | 0 | 0 | 0 | 105.8 | P191 R195 | P191-P193 VanDerWaalsContact O-CD 3.22Å; P191-P193 WeakPolarHBondContact O-CD 3.43Å; P193-R195 PolarHBondContact O-N 3.15Å | ||
| 194 | V | 34.6 | Very low | 39.8 | Very low | 139 Ų | 139 | 143.8 Ų | 143.8 | 84% | 0.842 | 74% | 0.742 | S | S | * | * | trans | -59.9 | 86.7 | 166.1 | -175 | 0 | 0 | 0 | 0 | 105.3 | I192 S196 | I192-V194 PolarHBondContact O-N 2.89Å; V194-S196 PolarHBondContact O-N 3.26Å; V194-S196 VanDerWaalsContact O-N 3.13Å | ||
| 195 | R | 36.5 | Very low | 40 | Very low | 223 Ų | 223 | 146.6 Ų | 146.6 | 84% | 0.842 | 75% | 0.749 | S | S | * | * | trans | -71.8 | 107.2 | 170.7 | -87.1 | -167.7 | 172.2 | -157.9 | -2 | 106.4 | P193 | P193-R195 PolarHBondContact O-N 3.15Š| ||
| 196 | S | 32.3 | Very low | 40.1 | Very low | 100 Ų | 100 | 140.9 Ų | 140.9 | 70% | 0.699 | 74% | 0.736 | S | S | * | * | trans | -39.2 | 128.4 | 165 | 26.2 | 0 | 0 | 0 | 0 | 112.1 | V194 I198 | V194-S196 PolarHBondContact O-N 3.26Å; V194-S196 VanDerWaalsContact O-N 3.13Å; S196-I198 PolarHBondContact O-N 3.45Å | ||
| 197 | H | 32.3 | Very low | 40.2 | Very low | 156 Ų | 156 | 139.9 Ų | 139.9 | 72% | 0.722 | 73% | 0.729 | S | S | * | * | trans | 30.7 | 88.5 | 140.2 | -149.3 | -42.4 | 0 | 0 | 0 | 115.6 | D199 | H197-D199 PolarHBondContact ND1-N 3.43Š| ||
| 198 | I | 39.4 | Very low | 39.9 | Very low | 162 Ų | 162 | 140.3 Ų | 140.3 | 83% | 0.831 | 74% | 0.743 | S | S | * | * | trans | -112.3 | 81.6 | 148.4 | -56.7 | 169.8 | 0 | 0 | 0 | 101.9 | S196 | S196-I198 PolarHBondContact O-N 3.45Š| ||
| 199 | D | 37 | Very low | 40.2 | Very low | 119 Ų | 119 | 138.7 Ų | 138.7 | 64% | 0.636 | 75% | 0.749 | S | S | * | * | 62.6 | 122.7 | 88.8 | -147.7 | -13.3 | 0 | 0 | 0 | 110.3 | H197 | H197-D199 PolarHBondContact ND1-N 3.43Š| |||
| 200 | D | 36.2 | Very low | 40.1 | Very low | 124 Ų | 124 | 142.7 Ų | 142.7 | 66% | 0.663 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -58.7 | 168.6 | -160.2 | -69.6 | -92.5 | 0 | 0 | 0 | 113.9 | ||
| 201 | D | 39 | Very low | 40.2 | Very low | 159 Ų | 159 | 139 Ų | 139 | 85% | 0.85 | 75% | 0.746 | S | S | * | * | trans | 101.7 | 21.2 | 165.9 | -52.7 | -32.1 | 0 | 0 | 0 | 121.2 | ||||
| 202 | R | 37.9 | Very low | 40.4 | Very low | 237 Ų | 237 | 139 Ų | 139 | 89% | 0.894 | 73% | 0.732 | S | S | * | * | trans | -132.8 | 98.5 | 170.5 | -88.7 | -176.7 | 165.8 | 155.9 | -2.7 | 116.8 | ||||
| 203 | E | 39.2 | Very low | 40.5 | Very low | 172 Ų | 172 | 138.2 Ų | 138.2 | 80% | 0.804 | 73% | 0.729 | S | S | * | * | 76.9 | 79.7 | 125.4 | -141.3 | 167.7 | -163.8 | 0 | 0 | 117.6 | T205 | E203-T205 PolarHBondContact O-N 3.04Š| |||
| 204 | L | 42.1 | Very low | 41.1 | Very low | 178 Ų | 178 | 139.5 Ų | 139.5 | 93% | 0.932 | 74% | 0.735 | S | S | * | * | trans | -74.1 | 76.6 | 169.1 | -74.5 | 158.5 | 0 | 0 | 0 | 111.5 | ||||
| 205 | T | 49.1 | Very low | 41.9 | Very low | 116 Ų | 116 | 142 Ų | 142 | 71% | 0.712 | 73% | 0.729 | S | S | * | * | trans | -149.2 | 113 | 155.6 | -42.9 | 0 | 0 | 0 | 0 | 110.6 | E203 | E203-T205 PolarHBondContact O-N 3.04Š| ||
| 206 | P | 45.4 | Very low | 42.9 | Very low | 66 Ų | 66 | 137.2 Ų | 137.2 | 43% | 0.429 | 72% | 0.719 | S | S | . | * | P | Polyproline II helix | trans | -70.1 | 141.6 | 173.1 | -17.4 | 32.9 | 0 | 0 | 0 | 110.6 | Y212 | P206-Y212 HydrophobicContact CB-CE1 4.43Å; P206-Y212 HydrophobicContact CG-CE1 3.84Å; P206-Y212 VanDerWaalsContact CG-OH 3.25Å; P206-Y212 WeakPolarHBondContact CG-OH 3.34Å |
| 207 | P | 44 | Very low | 44 | Very low | 87 Ų | 87 | 138.2 Ų | 138.2 | 57% | 0.565 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 150.8 | 178.5 | 24.1 | -32.1 | 0 | 0 | 0 | 112.3 | G209 | P207-G209 PolarHBondContact O-N 2.91Š|
| 208 | P | 40.6 | Very low | 45.2 | Very low | 133 Ų | 133 | 133 Ų | 133 | 86% | 0.864 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.4 | 127.2 | -177.7 | -18 | 29.7 | 0 | 0 | 0 | 111.4 | ||
| 209 | G | 48.2 | Very low | 46.7 | Very low | 79 Ų | 79 | 128.6 Ų | 128.6 | 81% | 0.814 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 107.9 | 2.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | P207 | P207-G209 PolarHBondContact O-N 2.91Š|
| 210 | R | 44.7 | Very low | 48.2 | Very low | 197 Ų | 197 | 127.9 Ų | 127.9 | 74% | 0.743 | 68% | 0.681 | S | S | * | * | trans | -92.1 | 102.6 | 169.5 | -138.4 | 174.3 | -173.8 | 175 | -0.1 | 109.5 | Y212 | R210-Y212 PolarHBondContact O-N 3.26Å; R210-Y212 VanDerWaalsContact O-N 3.17Å | ||
| 211 | T | 43.9 | Very low | 49.8 | Very low | 104 Ų | 104 | 129.7 Ų | 129.7 | 64% | 0.638 | 69% | 0.686 | S | S | * | * | trans | -55.1 | 115.6 | 175.7 | 43.3 | 0 | 0 | 0 | 0 | 110.7 | L213 | T211-L213 PolarHBondContact O-N 3.09Š| ||
| 212 | Y | 45.4 | Very low | 50.8 | Low | 114 Ų | 114 | 125.9 Ų | 125.9 | 45% | 0.447 | 66% | 0.663 | S | S | . | * | G | 310 helix | trans | -61.6 | 8.8 | 179 | -69.5 | -94.9 | 0 | 0 | 0 | 115.3 | P206 R210 T214 F218 | P206-Y212 HydrophobicContact CB-CE1 4.43Å; P206-Y212 HydrophobicContact CG-CE1 3.84Å; P206-Y212 VanDerWaalsContact CG-OH 3.25Å; P206-Y212 WeakPolarHBondContact CG-OH 3.34Å; R210-Y212 PolarHBondContact O-N 3.26Å; R210-Y212 VanDerWaalsContact O-N 3.17Å; Y212-T214 VanDerWaalsContact C-N 3.29Å; Y212-T214 PolarHBondContact O-N 3.48Å; Y212-F218 WeakPolarHBondContact O-CZ 3.24Å |
| 213 | L | 44 | Very low | 51.9 | Low | 132 Ų | 132 | 119.5 Ų | 119.5 | 69% | 0.691 | 64% | 0.643 | S | S | * | * | G | 310 helix | trans | -76.7 | -10.7 | -174.1 | -71.3 | 167.8 | 0 | 0 | 0 | 114.1 | T211 | T211-L213 PolarHBondContact O-N 3.09Š|
| 214 | T | 51.9 | Low | 53.1 | Low | 132 Ų | 132 | 117.8 Ų | 117.8 | 81% | 0.81 | 64% | 0.635 | S | S | * | * | G | 310 helix | trans | -94.7 | 7.6 | -176.8 | 52.7 | 0 | 0 | 0 | 0 | 114.5 | Y212 | Y212-T214 VanDerWaalsContact C-N 3.29Å; Y212-T214 PolarHBondContact O-N 3.48Å |
| 215 | R | 50.2 | Low | 53.9 | Low | 192 Ų | 192 | 111.3 Ų | 111.3 | 73% | 0.725 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -125.9 | 28.6 | -173 | -119.5 | -167.9 | 179.8 | -146.3 | 0.3 | 114.8 | ||
| 216 | L | 58.3 | Low | 54.2 | Low | 122 Ų | 122 | 109.4 Ų | 109.4 | 64% | 0.639 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 141.4 | 175.3 | -71 | 164.7 | 0 | 0 | 0 | 111.3 | F218 | L216-F218 HydrophobicContact CD2-CD2 3.72Å; L216-F218 HydrophobicContact CD2-CE2 3.67Å |
| 217 | P | 54.4 | Low | 54.9 | Low | 121 Ų | 121 | 110.8 Ų | 110.8 | 79% | 0.786 | 60% | 0.598 | S | S | * | * | S | Bend | cis | -87.8 | 142 | 1.1 | 33.5 | -31.4 | 0 | 0 | 0 | 113.1 | ||
| 218 | F | 58.3 | Low | 55.6 | Low | 48 Ų | 48 | 116.6 Ų | 116.6 | 21% | 0.211 | 61% | 0.609 | C | S | . | * | P | Polyproline II helix | trans | -66 | 146 | 172.3 | -66 | -70.2 | 0 | 0 | 0 | 111.5 | Y212 L216 E222 Q223 M226 | Y212-F218 WeakPolarHBondContact O-CZ 3.24Å; L216-F218 HydrophobicContact CD2-CD2 3.72Å; L216-F218 HydrophobicContact CD2-CE2 3.67Å; F218-E222 HydrophobicContact CB-CB 4.32Å; F218-E222 HydrophobicContact CD1-CB 4.32Å; F218-Q223 HydrophobicContact CB-CG 3.93Å; F218-M226 HydrophobicContact CE2-SD 4.42Å; F218-M226 HydrophobicContact CZ-SD 4.43Å |
| 219 | T | 70.9 | Confident | 56.1 | Low | 68 Ų | 68 | 118.1 Ų | 118.1 | 42% | 0.417 | 60% | 0.602 | S | S | . | * | P | Polyproline II helix | trans | -70.8 | 156.7 | 167.8 | 70.7 | 0 | 0 | 0 | 0 | 110.7 | E221 E222 Q223 | T219-E221 PolarHBondContact O-N 3.03Å; T219-E222 PolarHBondContact N-OE2 2.81Å; T219-E222 PolarHBondContact O-N 3.35Å; T219-E222 VanDerWaalsContact O-N 3.16Å; T219-E222 WeakPolarHBondContact OG1-CB 3.41Å; T219-E222 VanDerWaalsContact OG1-CG 3.25Å; T219-E222 WeakPolarHBondContact OG1-CG 3.34Å; T219-E222 PolarHBondContact OG1-N 2.88Å; T219-E222 PolarHBondContact OG1-OE2 3.16Å; T219-Q223 PolarHBondContact O-N 3.33Å |
| 220 | P | 67.9 | Low | 56 | Low | 104 Ų | 104 | 120.5 Ų | 120.5 | 68% | 0.675 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -54.8 | -33.1 | 175.5 | -26 | 34.5 | 0 | 0 | 0 | 113.2 | Q224 | P220-Q224 PolarHBondContact O-N 3.06Å; P220-Q224 VanDerWaalsContact O-N 3.16Å |
| 221 | E | 71.6 | Confident | 55.9 | Low | 162 Ų | 162 | 115.2 Ų | 115.2 | 76% | 0.757 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -73.7 | -39.4 | -179.8 | -153.5 | 157.9 | -156.1 | 0 | 0 | 111.7 | T219 Q224 A225 | T219-E221 PolarHBondContact O-N 3.03Å; E221-Q224 PolarHBondContact O-N 3.16Å; E221-A225 PolarHBondContact O-N 2.61Å |
| 222 | E | 59.7 | Low | 55.9 | Low | 79 Ų | 79 | 114.2 Ų | 114.2 | 37% | 0.369 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66.5 | -36.4 | 172.9 | -73.6 | 173.5 | 150.8 | 0 | 0 | 112.2 | F218 T219 Q224 A225 M226 | F218-E222 HydrophobicContact CB-CB 4.32Å; F218-E222 HydrophobicContact CD1-CB 4.32Å; T219-E222 PolarHBondContact N-OE2 2.81Å; T219-E222 PolarHBondContact O-N 3.35Å; T219-E222 VanDerWaalsContact O-N 3.16Å; T219-E222 WeakPolarHBondContact OG1-CB 3.41Å; T219-E222 VanDerWaalsContact OG1-CG 3.25Å; T219-E222 WeakPolarHBondContact OG1-CG 3.34Å; T219-E222 PolarHBondContact OG1-N 2.88Å; T219-E222 PolarHBondContact OG1-OE2 3.16Å; E222-Q224 VanDerWaalsContact C-N 3.32Å; E222-Q224 PolarHBondContact O-N 3.47Å; E222-A225 PolarHBondContact O-N 3.36Å; E222-M226 WeakPolarHBondContact O-CB 3.25Å; E222-M226 PolarHBondContact O-N 3.24Å |
| 223 | Q | 60.9 | Low | 55.6 | Low | 103 Ų | 103 | 116.3 Ų | 116.3 | 48% | 0.481 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -62.8 | -40.6 | 172.6 | -75.5 | -176.9 | -8.7 | 0 | 0 | 111.7 | F218 T219 M226 V227 | F218-Q223 HydrophobicContact CB-CG 3.93Å; T219-Q223 PolarHBondContact O-N 3.33Å; Q223-M226 WeakPolarHBondContact O-CB 3.49Å; Q223-M226 PolarHBondContact O-N 2.76Å; Q223-V227 WeakPolarHBondContact O-CG2 3.19Å; Q223-V227 PolarHBondContact O-N 2.85Å |
| 224 | Q | 64.3 | Low | 55.5 | Low | 137 Ų | 137 | 115.9 Ų | 115.9 | 64% | 0.64 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -70.1 | -35.7 | -179.4 | -146 | 143.5 | 31.5 | 0 | 0 | 112 | P220 E221 E222 R228 | P220-Q224 PolarHBondContact O-N 3.06Å; P220-Q224 VanDerWaalsContact O-N 3.16Å; E221-Q224 PolarHBondContact O-N 3.16Å; E222-Q224 VanDerWaalsContact C-N 3.32Å; E222-Q224 PolarHBondContact O-N 3.47Å; Q224-R228 PolarHBondContact O-N 3.31Å |
| 225 | A | 59.6 | Low | 54.7 | Low | 41 Ų | 41 | 114.3 Ų | 114.3 | 34% | 0.339 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -63.6 | -44.9 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | E221 E222 V227 R228 F229 | E221-A225 PolarHBondContact O-N 2.61Å; E222-A225 PolarHBondContact O-N 3.36Å; A225-V227 VanDerWaalsContact C-N 3.31Å; A225-V227 PolarHBondContact O-N 3.37Å; A225-R228 PolarHBondContact O-N 3.11Å; A225-R228 VanDerWaalsContact O-N 3.07Å; A225-F229 HydrophobicContact CB-CD2 4.39Å; A225-F229 HydrophobicContact CB-CE2 4.43Å; A225-F229 WeakPolarHBondContact O-CD2 3.31Å; A225-F229 PolarHBondContact O-N 2.94Å |
| 226 | M | 54.7 | Low | 54.1 | Low | 77 Ų | 77 | 113.3 Ų | 113.3 | 38% | 0.379 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -60.4 | -39.7 | 178.6 | -167.4 | 173.4 | 60.5 | 0 | 0 | 112 | F218 E222 Q223 R228 F229 F230 | F218-M226 HydrophobicContact CE2-SD 4.42Å; F218-M226 HydrophobicContact CZ-SD 4.43Å; E222-M226 WeakPolarHBondContact O-CB 3.25Å; E222-M226 PolarHBondContact O-N 3.24Å; Q223-M226 WeakPolarHBondContact O-CB 3.49Å; Q223-M226 PolarHBondContact O-N 2.76Å; M226-R228 VanDerWaalsContact C-N 3.34Å; M226-R228 PolarHBondContact O-N 2.82Å; M226-F229 PolarHBondContact O-N 3.46Å; M226-F230 HydrophobicContact CG-CD2 3.89Å; M226-F230 HydrophobicContact CG-CE2 4.45Å; M226-F230 WeakPolarHBondContact O-CB 3.16Å; M226-F230 WeakPolarHBondContact O-CD2 3.35Å; M226-F230 PolarHBondContact O-N 3.18Å |
| 227 | V | 59.5 | Low | 53 | Low | 94 Ų | 94 | 115.6 Ų | 115.6 | 57% | 0.57 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.7 | -32.3 | 175.2 | 172.8 | 0 | 0 | 0 | 0 | 112.5 | Q223 A225 | Q223-V227 WeakPolarHBondContact O-CG2 3.19Å; Q223-V227 PolarHBondContact O-N 2.85Å; A225-V227 VanDerWaalsContact C-N 3.31Å; A225-V227 PolarHBondContact O-N 3.37Å |
| 228 | R | 59.7 | Low | 51.9 | Low | 210 Ų | 210 | 121.1 Ų | 121.1 | 79% | 0.792 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -74 | -40.4 | 175.9 | -76.3 | -170.8 | -172.4 | -173.9 | 5.2 | 113.2 | Q224 A225 M226 | Q224-R228 PolarHBondContact O-N 3.31Å; A225-R228 PolarHBondContact O-N 3.11Å; A225-R228 VanDerWaalsContact O-N 3.07Å; M226-R228 VanDerWaalsContact C-N 3.34Å; M226-R228 PolarHBondContact O-N 2.82Å |
| 229 | F | 49.4 | Very low | 50.8 | Low | 164 Ų | 164 | 125.9 Ų | 125.9 | 72% | 0.719 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -87.1 | -21.3 | -176 | -70.4 | -69.5 | 0 | 0 | 0 | 113.5 | A225 M226 P231 | A225-F229 HydrophobicContact CB-CD2 4.39Å; A225-F229 HydrophobicContact CB-CE2 4.43Å; A225-F229 WeakPolarHBondContact O-CD2 3.31Å; A225-F229 PolarHBondContact O-N 2.94Å; M226-F229 PolarHBondContact O-N 3.46Å; F229-P231 WeakPolarHBondContact O-CD 3.24Å |
| 230 | F | 47.1 | Very low | 49 | Very low | 129 Ų | 129 | 131.3 Ų | 131.3 | 57% | 0.566 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -119.9 | 78.9 | 174.4 | -60.5 | -85.1 | 0 | 0 | 0 | 109.3 | M226 S232 | M226-F230 HydrophobicContact CG-CD2 3.89Å; M226-F230 HydrophobicContact CG-CE2 4.45Å; M226-F230 WeakPolarHBondContact O-CB 3.16Å; M226-F230 WeakPolarHBondContact O-CD2 3.35Å; M226-F230 PolarHBondContact O-N 3.18Å; F230-S232 PolarHBondContact O-N 3.25Å; F230-S232 VanDerWaalsContact O-N 3.1Å |
| 231 | P | 43.4 | Very low | 47.6 | Very low | 87 Ų | 87 | 134.7 Ų | 134.7 | 57% | 0.565 | 65% | 0.653 | S | S | * | * | trans | -57.6 | 122.1 | 173 | 22.9 | -29.9 | 0 | 0 | 0 | 108.5 | F229 H233 | F229-P231 WeakPolarHBondContact O-CD 3.24Å; P231-H233 PolarHBondContact O-N 3.33Å | ||
| 232 | S | 42.5 | Very low | 45.6 | Very low | 83 Ų | 83 | 135 Ų | 135 | 58% | 0.58 | 65% | 0.654 | S | S | * | * | trans | -57.7 | 91 | -171.1 | -38.6 | 0 | 0 | 0 | 0 | 112.3 | F230 | F230-S232 PolarHBondContact O-N 3.25Å; F230-S232 VanDerWaalsContact O-N 3.1Å | ||
| 233 | H | 39.7 | Very low | 44.6 | Very low | 157 Ų | 157 | 137.4 Ų | 137.4 | 73% | 0.727 | 68% | 0.675 | S | S | * | * | trans | -90.5 | 12.4 | 155.5 | -58.9 | -60.4 | 0 | 0 | 0 | 111.6 | P231 S235 | P231-H233 PolarHBondContact O-N 3.33Å; H233-S235 PolarHBondContact O-N 3.29Å; H233-S235 VanDerWaalsContact O-N 3.14Å | ||
| 234 | T | 41.1 | Very low | 43.2 | Very low | 124 Ų | 124 | 140.7 Ų | 140.7 | 76% | 0.761 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | 44.2 | 177.2 | 50.6 | 0 | 0 | 0 | 0 | 112.4 | ||
| 235 | S | 35.8 | Very low | 41.8 | Very low | 98 Ų | 98 | 138.5 Ų | 138.5 | 69% | 0.685 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.8 | -3.4 | 162.5 | 50.8 | 0 | 0 | 0 | 0 | 112.6 | H233 | H233-S235 PolarHBondContact O-N 3.29Å; H233-S235 VanDerWaalsContact O-N 3.14Å |
| 236 | Q | 37.8 | Very low | 40.7 | Very low | 172 Ų | 172 | 142.7 Ų | 142.7 | 80% | 0.804 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -96.7 | -3.9 | -177 | -67.9 | -101.7 | -29.7 | 0 | 0 | 114.4 | ||
| 237 | F | 34.3 | Very low | 39.8 | Very low | 169 Ų | 169 | 145 Ų | 145 | 74% | 0.741 | 74% | 0.738 | S | S | * | * | trans | -112.9 | 34.9 | 176.9 | -73.7 | -79.8 | 0 | 0 | 0 | 113.1 | H239 | F237-H239 PolarHBondContact O-N 3.32Š| ||
| 238 | R | 31.5 | Very low | 38.8 | Very low | 237 Ų | 237 | 148 Ų | 148 | 89% | 0.894 | 75% | 0.75 | S | S | * | * | trans | -75 | 75.1 | 169 | -160.2 | 176.6 | -169.9 | 151.7 | 1.5 | 108.8 | Q240 | R238-Q240 PolarHBondContact O-N 3.44Š| ||
| 239 | H | 36.5 | Very low | 37.8 | Very low | 149 Ų | 149 | 143.1 Ų | 143.1 | 69% | 0.69 | 75% | 0.746 | S | S | * | * | trans | -66.1 | 125.9 | 166.7 | -84.9 | -62.9 | 0 | 0 | 0 | 109.2 | F237 H241 | F237-H239 PolarHBondContact O-N 3.32Å; H239-H241 PolarHBondContact O-N 3.01Å; H239-H241 VanDerWaalsContact O-N 3.08Å | ||
| 240 | Q | 33.2 | Very low | 37.2 | Very low | 181 Ų | 181 | 143.4 Ų | 143.4 | 85% | 0.846 | 75% | 0.749 | S | S | * | * | trans | -48 | 105.3 | 173.3 | -65.6 | 167.5 | -46.8 | 0 | 0 | 111.1 | R238 | R238-Q240 PolarHBondContact O-N 3.44Š| ||
| 241 | H | 37.6 | Very low | 36.8 | Very low | 175 Ų | 175 | 142.3 Ų | 142.3 | 81% | 0.81 | 76% | 0.755 | S | S | * | * | trans | -121.9 | 87.3 | 151.5 | -77.4 | -71.4 | 0 | 0 | 0 | 107.6 | H239 T243 | H239-H241 PolarHBondContact O-N 3.01Å; H239-H241 VanDerWaalsContact O-N 3.08Å; H241-T243 PolarHBondContact O-N 3.22Å | ||
| 242 | Q | 30.5 | Very low | 36.4 | Very low | 168 Ų | 168 | 147.3 Ų | 147.3 | 79% | 0.785 | 76% | 0.763 | S | S | * | * | trans | -71.7 | 102.5 | 165.4 | -171.1 | 170.8 | 24.6 | 0 | 0 | 107.1 | ||||
| 243 | T | 37.2 | Very low | 36.2 | Very low | 130 Ų | 130 | 151.8 Ų | 151.8 | 80% | 0.798 | 77% | 0.768 | S | S | * | * | trans | -121 | 107.4 | 159.2 | 41.1 | 0 | 0 | 0 | 0 | 107.7 | H241 A245 | H241-T243 PolarHBondContact O-N 3.22Å; T243-A245 PolarHBondContact O-N 2.87Å | ||
| 244 | H | 32.3 | Very low | 36.2 | Very low | 172 Ų | 172 | 151.7 Ų | 151.7 | 80% | 0.796 | 77% | 0.768 | S | S | * | * | trans | -46.7 | 125.3 | 171.1 | -77.9 | -97.6 | 0 | 0 | 0 | 112 | ||||
| 245 | A | 34.1 | Very low | 35.9 | Very low | 91 Ų | 91 | 150.8 Ų | 150.8 | 75% | 0.752 | 76% | 0.762 | S | S | * | * | trans | -157.7 | 91.3 | 155.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | T243 | T243-A245 PolarHBondContact O-N 2.87Š| ||
| 246 | V | 37.3 | Very low | 36 | Very low | 129 Ų | 129 | 156 Ų | 156 | 78% | 0.782 | 77% | 0.773 | S | S | * | * | trans | 48.5 | 119.4 | 141.4 | -166.8 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 247 | P | 36.1 | Very low | 35.9 | Very low | 127 Ų | 127 | 152.6 Ų | 152.6 | 83% | 0.825 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -90.2 | 126.6 | 163.7 | 33.5 | -24.3 | 0 | 0 | 0 | 110.6 | ||
| 248 | D | 36.9 | Very low | 36.1 | Very low | 157 Ų | 157 | 150.5 Ų | 150.5 | 84% | 0.84 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -103.3 | 137.8 | 173 | -145.8 | 16 | 0 | 0 | 0 | 110.4 | ||
| 249 | P | 39.7 | Very low | 36.5 | Very low | 107 Ų | 107 | 147 Ų | 147 | 70% | 0.695 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -95.5 | 142.9 | -168.3 | 35.5 | -28.5 | 0 | 0 | 0 | 114.5 | ||
| 250 | Q | 35.9 | Very low | 36.3 | Very low | 170 Ų | 170 | 145.9 Ų | 145.9 | 79% | 0.794 | 76% | 0.763 | S | S | * | * | trans | 3.6 | 154.1 | 148.1 | -74.3 | -74.2 | -47.2 | 0 | 0 | 119.3 | ||||
| 251 | P | 39.4 | Very low | 36.4 | Very low | 105 Ų | 105 | 142.8 Ų | 142.8 | 68% | 0.682 | 76% | 0.758 | S | S | * | * | -162.8 | 168.7 | 57.9 | 41.9 | -18.6 | 0 | 0 | 0 | 121.7 | |||||
| 252 | R | 34.7 | Very low | 36.5 | Very low | 193 Ų | 193 | 141.5 Ų | 141.5 | 73% | 0.728 | 76% | 0.758 | S | S | * | * | trans | 69.4 | 134.6 | 154.6 | -73.7 | -179.2 | -173.9 | 178.5 | 3.2 | 117.6 | ||||
| 253 | Y | 38.1 | Very low | 36.8 | Very low | 176 Ų | 176 | 139.8 Ų | 139.8 | 69% | 0.69 | 75% | 0.75 | S | S | * | * | -168 | 149.9 | 63.9 | -84.7 | -80.5 | 0 | 0 | 0 | 114.4 | |||||
| 254 | H | 40.4 | Very low | 36.7 | Very low | 156 Ų | 156 | 140.9 Ų | 140.9 | 72% | 0.722 | 75% | 0.746 | S | S | * | * | trans | 70.2 | 100.4 | 153.6 | -57.3 | -49.3 | 0 | 0 | 0 | 120.8 | ||||
| 255 | T | 35.6 | Very low | 37 | Very low | 105 Ų | 105 | 138.1 Ų | 138.1 | 64% | 0.644 | 74% | 0.741 | S | S | * | * | 75.8 | 107.4 | 81.8 | -55.7 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 256 | F | 37 | Very low | 37.2 | Very low | 208 Ų | 208 | 138.4 Ų | 138.4 | 91% | 0.912 | 74% | 0.737 | S | S | * | * | -171.8 | 120.7 | 126.6 | -83 | -63.9 | 0 | 0 | 0 | 109.6 | |||||
| 257 | P | 36.5 | Very low | 37.2 | Very low | 99 Ų | 99 | 140 Ų | 140 | 64% | 0.643 | 74% | 0.742 | S | S | * | * | trans | -102.6 | 148.5 | 172.2 | 35.4 | -26.4 | 0 | 0 | 0 | 111.5 | ||||
| 258 | N | 38 | Very low | 37.2 | Very low | 125 Ų | 125 | 141.5 Ų | 141.5 | 67% | 0.668 | 74% | 0.743 | S | S | * | * | 150.4 | 140.4 | 126.1 | -89.9 | -32.7 | 0 | 0 | 0 | 117.2 | |||||
| 259 | H | 38.7 | Very low | 37.3 | Very low | 164 Ų | 164 | 143 Ų | 143 | 76% | 0.759 | 74% | 0.744 | S | S | * | * | trans | 75.7 | 128.7 | 151.6 | -50.5 | -33.9 | 0 | 0 | 0 | 117.3 | ||||
| 260 | C | 32.9 | Very low | 37.2 | Very low | 125 Ų | 125 | 145.7 Ų | 145.7 | 85% | 0.845 | 75% | 0.748 | S | S | * | * | cis | -156.7 | 152.3 | 25.6 | -82.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 261 | P | 36.5 | Very low | 37.2 | Very low | 116 Ų | 116 | 147.7 Ų | 147.7 | 75% | 0.753 | 75% | 0.754 | S | S | * | * | trans | -114.1 | 138.8 | 155 | 35.9 | -23.9 | 0 | 0 | 0 | 111.9 | ||||
| 262 | N | 37.9 | Very low | 36.7 | Very low | 149 Ų | 149 | 147.7 Ų | 147.7 | 80% | 0.797 | 76% | 0.757 | S | S | * | * | trans | 158.9 | 144.2 | 163.8 | -93.5 | -19.1 | 0 | 0 | 0 | 107.7 | ||||
| 263 | Q | 38.3 | Very low | 36.7 | Very low | 132 Ų | 132 | 144 Ų | 144 | 62% | 0.617 | 76% | 0.761 | S | S | * | * | cis | -172.8 | 152.7 | 22.9 | -118.9 | 177.7 | 106.6 | 0 | 0 | 108.3 | ||||
| 264 | Q | 35.3 | Very low | 36.6 | Very low | 153 Ų | 153 | 140.7 Ų | 140.7 | 72% | 0.715 | 76% | 0.763 | S | S | * | * | trans | 60 | 143.8 | 140.2 | -70.5 | 171.2 | -23.4 | 0 | 0 | 119.5 | ||||
| 265 | T | 37.7 | Very low | 36.5 | Very low | 113 Ų | 113 | 141.8 Ų | 141.8 | 69% | 0.693 | 77% | 0.768 | S | S | * | * | cis | -173.2 | 149.4 | 12.8 | 14.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 266 | S | 37.8 | Very low | 36.3 | Very low | 97 Ų | 97 | 148.4 Ų | 148.4 | 68% | 0.678 | 78% | 0.781 | S | S | * | * | trans | 48.9 | 118 | 142.7 | -53 | 0 | 0 | 0 | 0 | 122 | ||||
| 267 | N | 38.4 | Very low | 36.1 | Very low | 164 Ų | 164 | 143.9 Ų | 143.9 | 88% | 0.877 | 77% | 0.773 | S | S | * | * | -177.4 | 116.7 | 105.4 | -87.2 | -19.8 | 0 | 0 | 0 | 112.4 | |||||
| 268 | N | 35.2 | Very low | 36 | Very low | 158 Ų | 158 | 144.4 Ų | 144.4 | 85% | 0.845 | 78% | 0.779 | S | S | * | * | trans | -72.7 | 135.8 | 163.7 | -90.4 | -40.4 | 0 | 0 | 0 | 109.8 | ||||
| 269 | H | 38.5 | Very low | 35.8 | Very low | 188 Ų | 188 | 146.4 Ų | 146.4 | 87% | 0.87 | 79% | 0.785 | S | S | * | * | trans | -145.9 | 114.3 | 142.5 | -111.3 | -47.9 | 0 | 0 | 0 | 110.9 | ||||
| 270 | Q | 38.3 | Very low | 35.5 | Very low | 164 Ų | 164 | 147.5 Ų | 147.5 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | trans | -61.6 | 138.1 | 168.5 | -69.5 | 167.7 | -36.7 | 0 | 0 | 111.2 | ||||
| 271 | F | 36.4 | Very low | 35.5 | Very low | 212 Ų | 212 | 146.5 Ų | 146.5 | 93% | 0.93 | 79% | 0.791 | S | S | * | * | trans | -136.2 | 105.7 | 138 | -90.5 | -79.6 | 0 | 0 | 0 | 108 | ||||
| 272 | S | 28.6 | Very low | 35.1 | Very low | 105 Ų | 105 | 146.2 Ų | 146.2 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | trans | -100.6 | 153.9 | 163.1 | -74.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 273 | S | 34.5 | Very low | 34.6 | Very low | 116 Ų | 116 | 146.1 Ų | 146.1 | 81% | 0.811 | 79% | 0.79 | S | S | * | * | trans | 126.5 | 101.6 | 147.2 | -51.4 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 274 | S | 36.6 | Very low | 34.2 | Very low | 106 Ų | 106 | 146.7 Ų | 146.7 | 74% | 0.741 | 80% | 0.802 | S | S | * | * | 166.6 | 101.6 | 120.1 | -98.8 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 275 | Q | 37.9 | Very low | 33.8 | Very low | 179 Ų | 179 | 148.8 Ų | 148.8 | 84% | 0.836 | 81% | 0.809 | S | S | * | * | 78.5 | 96.8 | 99.2 | -77.4 | -171.6 | 6.7 | 0 | 0 | 114.7 | |||||
| 276 | R | 31.2 | Very low | 33.8 | Very low | 243 Ų | 243 | 149 Ų | 149 | 92% | 0.917 | 81% | 0.812 | S | S | * | * | -179.9 | 120.2 | 114.5 | -101.1 | -173.6 | 174.3 | 179.2 | -0.8 | 111.8 | |||||
| 277 | P | 33.4 | Very low | 33.5 | Very low | 113 Ų | 113 | 149.4 Ų | 149.4 | 73% | 0.734 | 82% | 0.815 | S | S | * | * | trans | -111.1 | 177.9 | 154.5 | 36.2 | -24 | 0 | 0 | 0 | 111.5 | ||||
| 278 | S | 34.5 | Very low | 33.1 | Very low | 111 Ų | 111 | 148.3 Ų | 148.3 | 78% | 0.776 | 81% | 0.814 | S | S | * | * | trans | 82 | 130.8 | 171.8 | -55.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 279 | Q | 34.3 | Very low | 33 | Very low | 167 Ų | 167 | 151.1 Ų | 151.1 | 78% | 0.78 | 81% | 0.813 | S | S | * | * | cis | -152.4 | 136.3 | 28.5 | -95.5 | 146.2 | 9.3 | 0 | 0 | 107.2 | ||||
| 280 | E | 31.9 | Very low | 32.6 | Very low | 186 Ų | 186 | 149 Ų | 149 | 87% | 0.869 | 81% | 0.808 | S | S | * | * | 41.4 | 100.2 | 93.1 | -68.2 | -177.1 | 140.7 | 0 | 0 | 114.7 | |||||
| 281 | A | 31.6 | Very low | 32.2 | Very low | 104 Ų | 104 | 148.8 Ų | 148.8 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | trans | -170.5 | 136.7 | 136.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 282 | C | 29 | Very low | 32.1 | Very low | 110 Ų | 110 | 143.5 Ų | 143.5 | 74% | 0.743 | 80% | 0.798 | S | S | * | * | trans | -64.6 | 153 | -174.1 | -61.8 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 283 | N | 27.7 | Very low | 32.2 | Very low | 147 Ų | 147 | 146.7 Ų | 146.7 | 79% | 0.786 | 80% | 0.801 | S | S | * | * | trans | 50.3 | 135.9 | 135.7 | -57.3 | -17.6 | 0 | 0 | 0 | 120.2 | ||||
| 284 | V | 30.4 | Very low | 32.2 | Very low | 145 Ų | 145 | 151 Ų | 151 | 88% | 0.879 | 80% | 0.801 | S | S | * | * | 164.8 | 111.1 | 122 | 163.3 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 285 | F | 26.5 | Very low | 32 | Very low | 197 Ų | 197 | 151.3 Ų | 151.3 | 86% | 0.864 | 80% | 0.798 | S | S | * | * | trans | -70.7 | -174.4 | 161.9 | -83.9 | -91.2 | 0 | 0 | 0 | 110.6 | ||||
| 286 | P | 36.6 | Very low | 31.7 | Very low | 117 Ų | 117 | 149.7 Ų | 149.7 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | -123.8 | 166.2 | -54.6 | 32.4 | -16 | 0 | 0 | 0 | 110.8 | |||||
| 287 | S | 31 | Very low | 31.7 | Very low | 106 Ų | 106 | 145.9 Ų | 145.9 | 74% | 0.741 | 79% | 0.787 | S | S | * | * | trans | -133.4 | 114.3 | 171.6 | -163.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 288 | V | 30.5 | Very low | 31.7 | Very low | 141 Ų | 141 | 146.9 Ų | 146.9 | 86% | 0.855 | 79% | 0.787 | S | S | * | * | trans | -66.4 | 119.4 | 165.4 | 177.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 289 | R | 33.6 | Very low | 31.8 | Very low | 216 Ų | 216 | 149.1 Ų | 149.1 | 82% | 0.815 | 79% | 0.79 | S | S | * | * | trans | -157.6 | 115.8 | 161.1 | -109.4 | 167.7 | -167.1 | -168 | 3.8 | 111.5 | ||||
| 290 | N | 30.8 | Very low | 31.8 | Very low | 144 Ų | 144 | 153 Ų | 153 | 77% | 0.77 | 80% | 0.798 | S | S | * | * | trans | 54.5 | 119.6 | 148 | -75.5 | -54.6 | 0 | 0 | 0 | 119.8 | P292 | N290-P292 VanDerWaalsContact O-CD 3.25Å; N290-P292 WeakPolarHBondContact O-CD 3.45Å | ||
| 291 | I | 28.4 | Very low | 32.1 | Very low | 160 Ų | 160 | 153.6 Ų | 153.6 | 82% | 0.821 | 80% | 0.797 | S | S | * | * | trans | -50.6 | 129.7 | 153.2 | -60.2 | 161.7 | 0 | 0 | 0 | 109.3 | ||||
| 292 | P | 34.6 | Very low | 32.1 | Very low | 101 Ų | 101 | 160.8 Ų | 160.8 | 66% | 0.656 | 80% | 0.802 | S | S | * | * | trans | -119.5 | 113.7 | 149.5 | 11.2 | 11.7 | 0 | 0 | 0 | 109.1 | N290 Y294 | N290-P292 VanDerWaalsContact O-CD 3.25Å; N290-P292 WeakPolarHBondContact O-CD 3.45Å; P292-Y294 VanDerWaalsContact C-N 3.27Å; P292-Y294 HydrophobicContact CB-CD2 4.33Å; P292-Y294 PolarHBondContact O-N 2.95Å | ||
| 293 | E | 32.2 | Very low | 32.2 | Very low | 172 Ų | 172 | 158.7 Ų | 158.7 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -57.2 | 93.9 | 151 | -80.8 | 176.3 | 142.8 | 0 | 0 | 107.8 | ||||
| 294 | Y | 33.7 | Very low | 32.7 | Very low | 207 Ų | 207 | 159.5 Ų | 159.5 | 81% | 0.812 | 80% | 0.798 | S | S | * | * | trans | -140.7 | 98.3 | 165.2 | -96.4 | -84.3 | 0 | 0 | 0 | 110.8 | P292 N296 | P292-Y294 VanDerWaalsContact C-N 3.27Å; P292-Y294 HydrophobicContact CB-CD2 4.33Å; P292-Y294 PolarHBondContact O-N 2.95Å; Y294-N296 PolarHBondContact O-N 3.12Å | ||
| 295 | V | 31.7 | Very low | 32.8 | Very low | 112 Ų | 112 | 160.8 Ų | 160.8 | 68% | 0.679 | 80% | 0.795 | S | S | * | * | trans | -2.1 | 109.4 | 143.7 | -170.1 | 0 | 0 | 0 | 0 | 114.4 | E297 | V295-E297 HydrophobicContact CG1-CB 3.92Å; V295-E297 HydrophobicContact CG1-CG 3.55Å | ||
| 296 | N | 31.3 | Very low | 33.3 | Very low | 144 Ų | 144 | 158.9 Ų | 158.9 | 77% | 0.77 | 79% | 0.794 | S | S | * | * | trans | -108.7 | 77.4 | 155.6 | -166.6 | -8.7 | 0 | 0 | 0 | 108.7 | Y294 N298 | Y294-N296 PolarHBondContact O-N 3.12Å; N296-N298 VanDerWaalsContact C-N 3.29Å; N296-N298 PolarHBondContact O-N 3.31Å; N296-N298 PolarHBondContact OD1-N 3.12Å | ||
| 297 | E | 31.9 | Very low | 33.6 | Very low | 163 Ų | 163 | 160.5 Ų | 160.5 | 76% | 0.762 | 79% | 0.794 | S | S | * | * | trans | -81.3 | 72.4 | 165.1 | -80.7 | -178.7 | 152.2 | 0 | 0 | 108.9 | V295 | V295-E297 HydrophobicContact CG1-CB 3.92Å; V295-E297 HydrophobicContact CG1-CG 3.55Å | ||
| 298 | N | 34.2 | Very low | 33.9 | Very low | 134 Ų | 134 | 157.4 Ų | 157.4 | 72% | 0.717 | 78% | 0.779 | S | S | * | * | trans | -159.3 | 79.8 | 166.5 | -88.5 | -36.9 | 0 | 0 | 0 | 110.7 | N296 | N296-N298 VanDerWaalsContact C-N 3.29Å; N296-N298 PolarHBondContact O-N 3.31Å; N296-N298 PolarHBondContact OD1-N 3.12Å | ||
| 299 | N | 35.9 | Very low | 34.4 | Very low | 158 Ų | 158 | 154 Ų | 154 | 85% | 0.845 | 77% | 0.773 | S | S | * | * | trans | -166.1 | 78.6 | 142.6 | -97.7 | -46.8 | 0 | 0 | 0 | 109.7 | K301 | N299-K301 PolarHBondContact O-N 3.2Š| ||
| 300 | R | 34.5 | Very low | 35.3 | Very low | 250 Ų | 250 | 149.8 Ų | 149.8 | 94% | 0.943 | 78% | 0.776 | S | S | * | * | trans | -67.7 | 102.6 | 155 | -78.5 | -180 | 179.5 | 150.6 | 0.7 | 107.6 | ||||
| 301 | K | 37.4 | Very low | 37.1 | Very low | 197 Ų | 197 | 152.7 Ų | 152.7 | 86% | 0.857 | 78% | 0.776 | S | S | * | * | trans | -121.4 | 119.2 | 145.4 | -86.1 | -171.9 | 176.7 | -179.1 | 0 | 108.7 | N299 | N299-K301 PolarHBondContact O-N 3.2Š| ||
| 302 | R | 33.2 | Very low | 39.8 | Very low | 255 Ų | 255 | 152.6 Ų | 152.6 | 96% | 0.962 | 78% | 0.777 | S | S | * | * | trans | -46.2 | 137.5 | 171.4 | -67.7 | 175.3 | 177.9 | -159.3 | -1.4 | 110.1 | ||||
| 303 | G | 31.2 | Very low | 42.5 | Very low | 67 Ų | 67 | 149.7 Ų | 149.7 | 69% | 0.691 | 75% | 0.754 | S | S | * | * | trans | 153.2 | 95.4 | 165.3 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 304 | Q | 37.7 | Very low | 45.3 | Very low | 163 Ų | 163 | 143 Ų | 143 | 76% | 0.762 | 73% | 0.728 | S | S | * | * | trans | 72.5 | 95.2 | 130.7 | -147.3 | 163.1 | -1.5 | 0 | 0 | 117.9 | D306 | Q304-D306 PolarHBondContact O-N 2.87Š| ||
| 305 | E | 31.6 | Very low | 47.9 | Very low | 172 Ų | 172 | 137.5 Ų | 137.5 | 80% | 0.804 | 71% | 0.713 | S | S | * | * | 50.7 | 68.2 | 120.9 | -57.7 | 166.7 | -149.9 | 0 | 0 | 118.1 | |||||
| 306 | D | 37.3 | Very low | 50.8 | Low | 158 Ų | 158 | 137.2 Ų | 137.2 | 85% | 0.845 | 70% | 0.699 | S | S | * | * | trans | -119.1 | 93.5 | 159.7 | -95.5 | -36.5 | 0 | 0 | 0 | 110.4 | Q304 G308 | Q304-D306 PolarHBondContact O-N 2.87Å; D306-G308 PolarHBondContact O-N 3.43Å; D306-G308 VanDerWaalsContact O-N 3.13Å | ||
| 307 | I | 42.9 | Very low | 53.8 | Low | 151 Ų | 151 | 130.6 Ų | 130.6 | 77% | 0.774 | 66% | 0.664 | S | S | * | * | trans | -72.5 | 99 | 173.6 | -63.6 | 169.6 | 0 | 0 | 0 | 108.2 | ||||
| 308 | G | 36.6 | Very low | 56.7 | Low | 40 Ų | 40 | 122.9 Ų | 122.9 | 41% | 0.412 | 63% | 0.628 | S | S | . | * | S | Bend | trans | 82.5 | 99.8 | 154.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | D306 | D306-G308 PolarHBondContact O-N 3.43Å; D306-G308 VanDerWaalsContact O-N 3.13Å |
| 309 | G | 41 | Very low | 59.4 | Low | 71 Ų | 71 | 123.5 Ų | 123.5 | 73% | 0.732 | 62% | 0.62 | S | S | * | * | S | Bend | trans | -167.2 | -44.1 | 169.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||
| 310 | S | 52.5 | Low | 62.1 | Low | 127 Ų | 127 | 117.9 Ų | 117.9 | 89% | 0.888 | 59% | 0.59 | S | S | * | * | S | Bend | trans | -157.3 | 9.5 | -173.9 | -85 | 0 | 0 | 0 | 0 | 115.9 | L312 | S310-L312 PolarHBondContact O-N 3.25Š|
| 311 | R | 68.4 | Low | 64.9 | Low | 204 Ų | 204 | 106 Ų | 106 | 77% | 0.77 | 55% | 0.545 | S | S | * | . | trans | -75.5 | 125.7 | 175.6 | -159.2 | 171.5 | -173.4 | -141.3 | 0.1 | 109.2 | R361 | R311-R361 PolarHBondContact O-NH2 3.46Š| ||
| 312 | L | 86.5 | Confident | 67.4 | Low | 158 Ų | 158 | 96.8 Ų | 96.8 | 83% | 0.827 | 51% | 0.506 | S | S | * | . | trans | -44.5 | 144.4 | 166.5 | -66.5 | 172.3 | 0 | 0 | 0 | 109.6 | S310 A314 R361 | S310-L312 PolarHBondContact O-N 3.25Å; L312-A314 PolarHBondContact O-N 3.02Å; L312-R361 PolarHBondContact O-NH2 2.88Å | ||
| 313 | F | 90.3 | Very high | 70.1 | Confident | 41 Ų | 41 | 94.7 Ų | 94.7 | 18% | 0.18 | 50% | 0.497 | C | S | . | . | trans | -61.7 | 125.5 | 175.2 | -77.9 | -99.9 | 0 | 0 | 0 | 108.6 | E317 I321 R361 A365 V366 K369 | F313-E317 VanDerWaalsContact CA-OE2 3.3Å; F313-E317 WeakPolarHBondContact CA-OE2 3.35Å; F313-E317 HydrophobicContact CD1-CB 4.08Å; F313-I321 HydrophobicContact CD1-CD1 3.52Å; F313-I321 HydrophobicContact CE1-CD1 3.42Å; F313-I321 VanDerWaalsContact CE1-CD1 3.42Å; F313-I321 HydrophobicContact CZ-CD1 4.41Å; F313-R361 HydrophobicContact CD1-CG 4.34Å; F313-R361 HydrophobicContact CE1-CB 4.45Å; F313-R361 HydrophobicContact CE1-CG 3.74Å; F313-R361 HydrophobicContact CZ-CG 4.32Å; F313-A365 HydrophobicContact CZ-CB 4.18Å; F313-A365 WeakPolarHBondContact CZ-O 3.31Å; F313-V366 HydrophobicContact CE1-CG2 4.34Å; F313-K369 HydrophobicContact CB-CD 4.29Å; F313-K369 HydrophobicContact CD1-CB 4.49Å; F313-K369 HydrophobicContact CD1-CG 4.05Å; F313-K369 HydrophobicContact CD2-CB 4.04Å; F313-K369 HydrophobicContact CD2-CD 3.67Å; F313-K369 HydrophobicContact CD2-CG 3.85Å; F313-K369 HydrophobicContact CE1-CB 4.06Å; F313-K369 HydrophobicContact CE1-CG 4.11Å; F313-K369 HydrophobicContact CE2-CB 3.56Å; F313-K369 HydrophobicContact CE2-CD 4.12Å; F313-K369 HydrophobicContact CE2-CG 3.91Å; F313-K369 HydrophobicContact CG-CB 4.48Å; F313-K369 HydrophobicContact CG-CD 3.9Å; F313-K369 HydrophobicContact CG-CG 3.92Å; F313-K369 HydrophobicContact CZ-CB 3.57Å; F313-K369 HydrophobicContact CZ-CG 4.03Å | ||
| 314 | A | 90.8 | Very high | 73 | Confident | 30 Ų | 30 | 93.5 Ų | 93.5 | 25% | 0.248 | 48% | 0.475 | C | S | . | . | trans | -65.4 | 158.5 | 172.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | L312 W316 E317 T318 | L312-A314 PolarHBondContact O-N 3.02Å; A314-W316 VanDerWaalsContact C-N 3.27Å; A314-W316 HydrophobicContact CB-CG 4.49Å; A314-W316 PolarHBondContact O-N 3.43Å; A314-E317 HydrophobicContact CB-CG 4.13Å; A314-E317 PolarHBondContact N-OE2 2.9Å; A314-E317 WeakPolarHBondContact O-CB 3.49Å; A314-E317 PolarHBondContact O-N 2.78Å; A314-T318 PolarHBondContact O-N 2.64Å; A314-T318 PolarHBondContact O-OG1 2.96Å | ||
| 315 | D | 89.6 | Confident | 75.5 | Confident | 93 Ų | 93 | 85.7 Ų | 85.7 | 50% | 0.497 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.6 | -36.5 | -178.4 | -75.9 | -26.3 | 0 | 0 | 0 | 112.9 | E317 T318 R319 | D315-E317 VanDerWaalsContact C-N 3.32Å; D315-T318 PolarHBondContact O-N 3Å; D315-R319 WeakPolarHBondContact O-CB 3.24Å; D315-R319 WeakPolarHBondContact O-CG 3.33Å; D315-R319 PolarHBondContact O-N 2.7Å; D315-R319 PolarHBondContact O-NE 3.33Å |
| 316 | W | 92.7 | Very high | 78.1 | Confident | 106 Ų | 106 | 83.8 Ų | 83.8 | 40% | 0.402 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -66.8 | -35.2 | 175.8 | 74.6 | -97 | 0 | 0 | 0 | 111.7 | A314 L320 R356 L357 T360 | A314-W316 VanDerWaalsContact C-N 3.27Å; A314-W316 HydrophobicContact CB-CG 4.49Å; A314-W316 PolarHBondContact O-N 3.43Å; W316-L320 HydrophobicContact CE3-CD2 4.47Å; W316-L320 HydrophobicContact CZ3-CD2 4.05Å; W316-L320 WeakPolarHBondContact O-CB 3.4Å; W316-L320 PolarHBondContact O-N 3.01Å; W316-R356 HydrophobicContact CH2-CB 4.39Å; W316-R356 HydrophobicContact CZ3-CB 4.14Å; W316-L357 HydrophobicContact CZ3-CD2 4.41Å; W316-T360 HydrophobicContact CH2-CG2 4.25Å; W316-T360 HydrophobicContact CZ2-CG2 4.29Å |
| 317 | E | 93.9 | Very high | 80.3 | Confident | 5 Ų | 5 | 81.2 Ų | 81.2 | 2% | 0.023 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -67.4 | -43.4 | 175.3 | -62.5 | -179.3 | 127.9 | 0 | 0 | 110.3 | F313 A314 D315 L320 I321 L357 T360 R361 | F313-E317 VanDerWaalsContact CA-OE2 3.3Å; F313-E317 WeakPolarHBondContact CA-OE2 3.35Å; F313-E317 HydrophobicContact CD1-CB 4.08Å; A314-E317 HydrophobicContact CB-CG 4.13Å; A314-E317 PolarHBondContact N-OE2 2.9Å; A314-E317 WeakPolarHBondContact O-CB 3.49Å; A314-E317 PolarHBondContact O-N 2.78Å; D315-E317 VanDerWaalsContact C-N 3.32Å; E317-L320 PolarHBondContact O-N 2.79Å; E317-I321 VanDerWaalsContact O-CG1 3.26Å; E317-I321 WeakPolarHBondContact O-CG1 3.15Å; E317-I321 PolarHBondContact O-N 3.42Å; E317-L357 HydrophobicContact CB-CD2 3.81Å; E317-L357 HydrophobicContact CG-CD2 3.95Å; E317-T360 VanDerWaalsContact OE1-CB 3.28Å; E317-T360 WeakPolarHBondContact OE1-CB 3.4Å; E317-T360 PolarHBondContact OE1-OG1 3.41Å; E317-R361 VanDerWaalsContact CD-NE 3.32Å; E317-R361 IonicContact OE1-CZ 3.28Å; E317-R361 IonicContact OE1-NE 3.44Å; E317-R361 PolarHBondContact OE1-NE 2.91Å; E317-R361 IonicContact OE1-NH2 3.24Å; E317-R361 IonicContact OE2-CZ 3.41Å; E317-R361 VanDerWaalsContact OE2-CZ 3.29Å; E317-R361 IonicContact OE2-NE 2.94Å; E317-R361 PolarHBondContact OE2-NE 3.1Å; E317-R361 IonicContact OE2-NH2 3.51Å; E317-R361 PolarHBondContact OE2-NH2 2.9Å |
| 318 | T | 92.2 | Very high | 82.2 | Confident | 1 Ų | 1 | 74.9 Ų | 74.9 | 1% | 0.006 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -65.6 | -40.2 | 179.2 | -54.9 | 0 | 0 | 0 | 0 | 111.4 | A314 D315 I321 S322 K369 M373 Y382 | A314-T318 PolarHBondContact O-N 2.64Å; A314-T318 PolarHBondContact O-OG1 2.96Å; D315-T318 PolarHBondContact O-N 3Å; T318-I321 PolarHBondContact O-N 3.35Å; T318-S322 PolarHBondContact O-N 3.27Å; T318-S322 PolarHBondContact O-OG 3.22Å; T318-K369 WeakPolarHBondContact OG1-CE 3.49Å; T318-K369 PolarHBondContact OG1-NZ 3.12Å; T318-M373 HydrophobicContact CG2-CE 3.74Å; T318-M373 HydrophobicContact CG2-SD 3.89Å; T318-Y382 HydrophobicContact CG2-CD1 4.45Å; T318-Y382 HydrophobicContact CG2-CD2 3.68Å; T318-Y382 HydrophobicContact CG2-CE1 4.16Å; T318-Y382 HydrophobicContact CG2-CE2 3.36Å; T318-Y382 HydrophobicContact CG2-CG 4.21Å |
| 319 | R | 92 | Very high | 84.3 | Confident | 146 Ų | 146 | 73.4 Ų | 73.4 | 55% | 0.551 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -60.4 | -45.1 | 170.9 | -78.6 | -177.4 | -103.3 | -167.8 | -6.7 | 112 | D315 S322 R323 Y382 | D315-R319 WeakPolarHBondContact O-CB 3.24Å; D315-R319 WeakPolarHBondContact O-CG 3.33Å; D315-R319 PolarHBondContact O-N 2.7Å; D315-R319 PolarHBondContact O-NE 3.33Å; R319-S322 PolarHBondContact O-N 3.05Å; R319-R323 PolarHBondContact O-N 3.33Å; R319-Y382 HydrophobicContact CG-CD1 3.5Å; R319-Y382 HydrophobicContact CG-CE1 4.21Å; R319-Y382 HydrophobicContact CG-CG 4.35Å |
| 320 | L | 92.6 | Very high | 85.5 | Confident | 41 Ų | 41 | 76 Ų | 76 | 22% | 0.215 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -65.4 | -40.2 | 179.6 | -174.7 | 55.4 | 0 | 0 | 0 | 112 | W316 E317 R323 L324 R356 L357 | W316-L320 HydrophobicContact CE3-CD2 4.47Å; W316-L320 HydrophobicContact CZ3-CD2 4.05Å; W316-L320 WeakPolarHBondContact O-CB 3.4Å; W316-L320 PolarHBondContact O-N 3.01Å; E317-L320 PolarHBondContact O-N 2.79Å; L320-R323 PolarHBondContact O-N 3.08Å; L320-L324 HydrophobicContact CD1-CD1 4.02Å; L320-L324 HydrophobicContact CD1-CG 4.05Å; L320-L324 HydrophobicContact CG-CD1 3.87Å; L320-L324 HydrophobicContact CG-CG 4.36Å; L320-L324 WeakPolarHBondContact O-CB 3.37Å; L320-L324 WeakPolarHBondContact O-CG 3.33Å; L320-L324 PolarHBondContact O-N 2.96Å; L320-R356 HydrophobicContact CD2-CB 4.4Å; L320-L357 HydrophobicContact CD2-CD1 4.23Å; L320-L357 HydrophobicContact CD2-CD2 4.28Å; L320-L357 HydrophobicContact CD2-CG 3.75Å; L320-L357 HydrophobicContact CG-CD1 4.1Å; L320-L357 HydrophobicContact CG-CG 4.18Å |
| 321 | I | 92.7 | Very high | 85.7 | Confident | 0 Ų | 0 | 73.1 Ų | 73.1 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60.5 | -45.8 | 172.4 | -69.1 | 168 | 0 | 0 | 0 | 110.6 | F313 E317 T318 R323 L324 F325 F329 L357 V366 K369 I370 M373 | F313-I321 HydrophobicContact CD1-CD1 3.52Å; F313-I321 HydrophobicContact CE1-CD1 3.42Å; F313-I321 VanDerWaalsContact CE1-CD1 3.42Å; F313-I321 HydrophobicContact CZ-CD1 4.41Å; E317-I321 VanDerWaalsContact O-CG1 3.26Å; E317-I321 WeakPolarHBondContact O-CG1 3.15Å; E317-I321 PolarHBondContact O-N 3.42Å; T318-I321 PolarHBondContact O-N 3.35Å; I321-R323 VanDerWaalsContact C-N 3.27Å; I321-R323 PolarHBondContact O-N 2.88Å; I321-L324 PolarHBondContact O-N 2.89Å; I321-F325 HydrophobicContact CG2-CD2 4.16Å; I321-F325 WeakPolarHBondContact O-CB 3.42Å; I321-F325 WeakPolarHBondContact O-CD2 3.28Å; I321-F325 PolarHBondContact O-N 3.22Å; I321-F329 HydrophobicContact CG2-CZ 4.41Å; I321-L357 HydrophobicContact CG1-CD1 3.63Å; I321-V366 HydrophobicContact CD1-CG1 4.25Å; I321-V366 HydrophobicContact CG1-CG1 4.15Å; I321-K369 HydrophobicContact CD1-CB 4.36Å; I321-K369 HydrophobicContact CD1-CG 3.86Å; I321-I370 HydrophobicContact CG2-CD1 4.25Å; I321-I370 HydrophobicContact CG2-CG1 3.59Å; I321-M373 HydrophobicContact CG2-SD 4.32Å |
| 322 | S | 90.3 | Very high | 85 | Confident | 4 Ų | 4 | 69 Ų | 69 | 3% | 0.028 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -60.5 | -37.9 | 179.3 | -54.3 | 0 | 0 | 0 | 0 | 111.9 | T318 R319 K326 M373 Y382 | T318-S322 PolarHBondContact O-N 3.27Å; T318-S322 PolarHBondContact O-OG 3.22Å; R319-S322 PolarHBondContact O-N 3.05Å; S322-K326 WeakPolarHBondContact O-CA 3.21Å; S322-K326 PolarHBondContact O-N 2.99Å; S322-M373 WeakPolarHBondContact OG-CE 3.35Å; S322-Y382 VanDerWaalsContact OG-CB 3.28Å; S322-Y382 WeakPolarHBondContact OG-CB 3.12Å |
| 323 | R | 89.8 | Confident | 83.5 | Confident | 210 Ų | 210 | 64.2 Ų | 64.2 | 79% | 0.792 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -73.8 | -46.2 | 176.7 | -175 | 174.3 | -82 | 164.1 | -6.3 | 113.1 | R319 L320 I321 F325 | R319-R323 PolarHBondContact O-N 3.33Å; L320-R323 PolarHBondContact O-N 3.08Å; I321-R323 VanDerWaalsContact C-N 3.27Å; I321-R323 PolarHBondContact O-N 2.88Å; R323-F325 VanDerWaalsContact C-N 3.34Å; R323-F325 PolarHBondContact O-N 3.06Å |
| 324 | L | 91 | Very high | 81.8 | Confident | 42 Ų | 42 | 70.1 Ų | 70.1 | 22% | 0.22 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -68.7 | -31.7 | -177.4 | -74.1 | 171.6 | 0 | 0 | 0 | 113.4 | L320 I321 R351 L357 | L320-L324 HydrophobicContact CD1-CD1 4.02Å; L320-L324 HydrophobicContact CD1-CG 4.05Å; L320-L324 HydrophobicContact CG-CD1 3.87Å; L320-L324 HydrophobicContact CG-CG 4.36Å; L320-L324 WeakPolarHBondContact O-CB 3.37Å; L320-L324 WeakPolarHBondContact O-CG 3.33Å; L320-L324 PolarHBondContact O-N 2.96Å; I321-L324 PolarHBondContact O-N 2.89Å; L324-R351 PolarHBondContact O-NH1 3.19Å; L324-L357 HydrophobicContact CD1-CD1 3.91Å |
| 325 | F | 90.7 | Very high | 80.1 | Confident | 0 Ų | 0 | 74.8 Ų | 74.8 | 0% | 0 | 37% | 0.368 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -116 | 25.9 | -175 | -61.4 | -84.7 | 0 | 0 | 0 | 112 | I321 R323 E327 F328 F329 P343 V348 R351 I352 V366 I370 | I321-F325 HydrophobicContact CG2-CD2 4.16Å; I321-F325 WeakPolarHBondContact O-CB 3.42Å; I321-F325 WeakPolarHBondContact O-CD2 3.28Å; I321-F325 PolarHBondContact O-N 3.22Å; R323-F325 VanDerWaalsContact C-N 3.34Å; R323-F325 PolarHBondContact O-N 3.06Å; F325-E327 PolarHBondContact O-N 2.98Å; F325-E327 VanDerWaalsContact O-N 3.12Å; F325-F328 HydrophobicContact CB-CD2 3.96Å; F325-F328 AromaticContact CD1-CD2 3.8Å; F325-F328 HydrophobicContact CD1-CD2 3.8Å; F325-F328 HydrophobicContact CD1-CE2 4.03Å; F325-F328 HydrophobicContact CG-CD2 4.39Å; F325-F328 WeakPolarHBondContact O-CB 3.41Å; F325-F328 PolarHBondContact O-N 3.23Å; F325-F329 HydrophobicContact CB-CE2 4.05Å; F325-F329 WeakPolarHBondContact O-CD2 3.44Å; F325-P343 HydrophobicContact CD1-CB 4.2Å; F325-P343 HydrophobicContact CD1-CG 4.01Å; F325-P343 HydrophobicContact CE1-CB 4.25Å; F325-P343 HydrophobicContact CE1-CG 4.23Å; F325-V348 HydrophobicContact CE1-CB 4.35Å; F325-V348 HydrophobicContact CE1-CG2 3.88Å; F325-V348 HydrophobicContact CZ-CB 4.24Å; F325-V348 HydrophobicContact CZ-CG1 3.97Å; F325-V348 HydrophobicContact CZ-CG2 4.15Å; F325-R351 HydrophobicContact CE1-CB 4.19Å; F325-R351 HydrophobicContact CE1-CG 4.41Å; F325-R351 HydrophobicContact CZ-CB 3.9Å; F325-I352 HydrophobicContact CE2-CG2 4.44Å; F325-I352 HydrophobicContact CZ-CG2 4.33Å; F325-V366 HydrophobicContact CE2-CG1 3.85Å; F325-V366 HydrophobicContact CZ-CG1 4.28Å; F325-I370 HydrophobicContact CB-CD1 3.99Å; F325-I370 HydrophobicContact CD1-CD1 3.77Å; F325-I370 HydrophobicContact CD2-CD1 3.65Å; F325-I370 HydrophobicContact CE1-CD1 4.13Å; F325-I370 HydrophobicContact CE2-CD1 4.03Å; F325-I370 HydrophobicContact CG-CD1 3.51Å; F325-I370 HydrophobicContact CG-CG1 4.49Å; F325-I370 HydrophobicContact CZ-CD1 4.26Å |
| 326 | K | 86.6 | Confident | 78.2 | Confident | 132 Ų | 132 | 76.8 Ų | 76.8 | 57% | 0.574 | 38% | 0.379 | S | S | * | . | G | 310 helix | trans | -50 | -39.7 | -178.2 | -174.1 | 176.7 | 177.8 | 177.4 | 0 | 112.7 | S322 F328 F329 | S322-K326 WeakPolarHBondContact O-CA 3.21Å; S322-K326 PolarHBondContact O-N 2.99Å; K326-F328 VanDerWaalsContact C-N 3.26Å; K326-F328 PolarHBondContact O-N 2.79Å; K326-F329 PolarHBondContact O-N 3.45Å; K326-F329 VanDerWaalsContact O-N 3.12Å |
| 327 | E | 83.9 | Confident | 76.2 | Confident | 104 Ų | 104 | 75 Ų | 75 | 49% | 0.486 | 39% | 0.393 | S | S | . | . | G | 310 helix | trans | -63.7 | -25.1 | 178.2 | 69.7 | -165.9 | -127.6 | 0 | 0 | 114.2 | F325 F329 H330 R351 | F325-E327 PolarHBondContact O-N 2.98Å; F325-E327 VanDerWaalsContact O-N 3.12Å; E327-F329 VanDerWaalsContact C-N 3.3Å; E327-H330 PolarHBondContact O-CD2 3.48Å; E327-H330 PolarHBondContact O-NE2 3.44Å; E327-R351 IonicContact OE1-CZ 3.35Å; E327-R351 IonicContact OE1-NH1 3.33Å; E327-R351 IonicContact OE1-NH2 2.7Å; E327-R351 PolarHBondContact OE1-NH2 2.99Å; E327-R351 IonicContact OE2-CZ 3.47Å; E327-R351 IonicContact OE2-NH1 3.58Å; E327-R351 PolarHBondContact OE2-NH1 3.32Å; E327-R351 IonicContact OE2-NH2 2.64Å; E327-R351 PolarHBondContact OE2-NH2 3.35Å |
| 328 | F | 82.7 | Confident | 74.1 | Confident | 18 Ų | 18 | 80.3 Ų | 80.3 | 8% | 0.079 | 43% | 0.425 | C | S | . | . | G | 310 helix | trans | -84.8 | -9.6 | 177.5 | -64.5 | -77.9 | 0 | 0 | 0 | 112.5 | F325 K326 H330 T341 P343 E347 Q374 | F325-F328 HydrophobicContact CB-CD2 3.96Å; F325-F328 AromaticContact CD1-CD2 3.8Å; F325-F328 HydrophobicContact CD1-CD2 3.8Å; F325-F328 HydrophobicContact CD1-CE2 4.03Å; F325-F328 HydrophobicContact CG-CD2 4.39Å; F325-F328 WeakPolarHBondContact O-CB 3.41Å; F325-F328 PolarHBondContact O-N 3.23Å; K326-F328 VanDerWaalsContact C-N 3.26Å; K326-F328 PolarHBondContact O-N 2.79Å; F328-H330 PolarHBondContact O-N 3.23Å; F328-T341 WeakPolarHBondContact CD1-O 3.48Å; F328-P343 HydrophobicContact CD1-CB 4.05Å; F328-P343 HydrophobicContact CD1-CG 4.34Å; F328-P343 HydrophobicContact CD2-CB 4.02Å; F328-P343 HydrophobicContact CD2-CG 4.24Å; F328-P343 HydrophobicContact CE1-CB 3.76Å; F328-P343 HydrophobicContact CE2-CB 3.74Å; F328-P343 HydrophobicContact CE2-CG 4.45Å; F328-P343 HydrophobicContact CG-CB 4.17Å; F328-P343 HydrophobicContact CG-CG 4.19Å; F328-P343 HydrophobicContact CZ-CB 3.62Å; F328-E347 VanDerWaalsContact CZ-CD 3.47Å; F328-E347 WeakPolarHBondContact CZ-OE1 3.26Å; F328-E347 VanDerWaalsContact CZ-OE2 3.24Å; F328-E347 WeakPolarHBondContact CZ-OE2 3.46Å; F328-Q374 PolarHBondContact O-NE2 3.46Å |
| 329 | F | 80.1 | Confident | 72.3 | Confident | 9 Ų | 9 | 82.5 Ų | 82.5 | 4% | 0.039 | 44% | 0.44 | C | S | . | . | trans | -97.3 | 79.8 | 175.6 | -62.3 | -62.4 | 0 | 0 | 0 | 109.1 | I321 F325 K326 E327 I370 M373 Q374 W379 | I321-F329 HydrophobicContact CG2-CZ 4.41Å; F325-F329 HydrophobicContact CB-CE2 4.05Å; F325-F329 WeakPolarHBondContact O-CD2 3.44Å; K326-F329 PolarHBondContact O-N 3.45Å; K326-F329 VanDerWaalsContact O-N 3.12Å; E327-F329 VanDerWaalsContact C-N 3.3Å; F329-I370 HydrophobicContact CE1-CG2 4Å; F329-I370 HydrophobicContact CZ-CB 4.38Å; F329-I370 HydrophobicContact CZ-CG1 4.2Å; F329-I370 HydrophobicContact CZ-CG2 3.96Å; F329-M373 HydrophobicContact CE1-CB 3.88Å; F329-M373 HydrophobicContact CE1-CE 4.48Å; F329-M373 HydrophobicContact CZ-CB 4.37Å; F329-M373 HydrophobicContact CZ-CE 4.11Å; F329-M373 HydrophobicContact CZ-SD 4.35Å; F329-Q374 HydrophobicContact CD1-CG 3.97Å; F329-Q374 HydrophobicContact CE1-CG 4.04Å; F329-W379 HydrophobicContact CB-CD2 3.62Å; F329-W379 HydrophobicContact CB-CE3 3.73Å; F329-W379 HydrophobicContact CB-CG 4.02Å; F329-W379 HydrophobicContact CB-CH2 4.4Å; F329-W379 HydrophobicContact CB-CZ2 4.33Å; F329-W379 HydrophobicContact CB-CZ3 4.15Å; F329-W379 HydrophobicContact CD1-CB 3.58Å; F329-W379 AromaticContact CD1-CD1 3.45Å; F329-W379 VanDerWaalsContact CD1-CD1 3.45Å; F329-W379 AromaticContact CD1-CD2 3.92Å; F329-W379 HydrophobicContact CD1-CD2 3.92Å; F329-W379 AromaticContact CD1-CG 3.36Å; F329-W379 HydrophobicContact CD1-CG 3.36Å; F329-W379 HydrophobicContact CD2-CB 4.38Å; F329-W379 HydrophobicContact CE1-CB 3.75Å; F329-W379 AromaticContact CE1-CG 3.97Å; F329-W379 HydrophobicContact CE1-CG 3.97Å; F329-W379 HydrophobicContact CG-CB 3.92Å; F329-W379 AromaticContact CG-CD2 3.94Å; F329-W379 HydrophobicContact CG-CD2 3.94Å; F329-W379 HydrophobicContact CG-CE3 4.32Å; F329-W379 AromaticContact CG-CG 3.78Å; F329-W379 HydrophobicContact CG-CG 3.78Å; F329-W379 HydrophobicContact CZ-CB 4.23Å | ||
| 330 | H | 67 | Low | 70.9 | Confident | 125 Ų | 125 | 76.7 Ų | 76.7 | 58% | 0.579 | 43% | 0.425 | S | S | * | . | trans | -72.1 | 139.6 | 173.3 | -64.2 | 178.5 | 0 | 0 | 0 | 110.4 | E327 F328 W379 | E327-H330 PolarHBondContact O-CD2 3.48Å; E327-H330 PolarHBondContact O-NE2 3.44Å; F328-H330 PolarHBondContact O-N 3.23Å; H330-W379 WeakPolarHBondContact O-CZ2 3.25Å | ||
| 331 | G | 57 | Low | 70.2 | Confident | 66 Ų | 66 | 79.5 Ų | 79.5 | 68% | 0.68 | 45% | 0.445 | S | S | * | . | S | Bend | trans | -40.4 | 138.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 332 | N | 51.9 | Low | 69.8 | Low | 117 Ų | 117 | 81.5 Ų | 81.5 | 63% | 0.626 | 46% | 0.455 | S | S | * | . | S | Bend | trans | 34.3 | 117 | -179.4 | -90.5 | -28.5 | 0 | 0 | 0 | 116.8 | K334 | N332-K334 PolarHBondContact O-N 3Š|
| 333 | P | 56.4 | Low | 69.7 | Low | 58 Ų | 58 | 81.3 Ų | 81.3 | 38% | 0.377 | 45% | 0.454 | S | S | . | . | trans | -57.6 | 110.5 | 172 | 26.9 | -33.1 | 0 | 0 | 0 | 108.5 | ||||
| 334 | K | 53.8 | Low | 69.8 | Low | 165 Ų | 165 | 73.9 Ų | 73.9 | 72% | 0.717 | 43% | 0.434 | S | S | * | . | trans | -59.4 | 139.7 | 172.4 | -74.2 | -178 | 179.4 | 175.7 | 0 | 107.3 | N332 N336 G337 | N332-K334 PolarHBondContact O-N 3Å; K334-N336 PolarHBondContact O-N 2.89Å; K334-G337 PolarHBondContact O-N 3.38Å | ||
| 335 | P | 56 | Low | 69.9 | Low | 129 Ų | 129 | 74.9 Ų | 74.9 | 84% | 0.838 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.9 | -11.6 | -179.4 | 21.6 | -31.9 | 0 | 0 | 0 | 113.4 | G337 | P335-G337 PolarHBondContact O-N 2.92Š|
| 336 | N | 49.5 | Very low | 69.9 | Low | 135 Ų | 135 | 78.9 Ų | 78.9 | 72% | 0.722 | 47% | 0.467 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.8 | 25.4 | -173.9 | -59.4 | 2.8 | 0 | 0 | 0 | 114.2 | K334 V338 | K334-N336 PolarHBondContact O-N 2.89Å; N336-V338 PolarHBondContact O-N 2.88Å |
| 337 | G | 51 | Low | 70.2 | Confident | 67 Ų | 67 | 75.1 Ų | 75.1 | 69% | 0.691 | 45% | 0.452 | S | S | * | . | trans | 66 | 7 | 163.8 | 0 | 0 | 0 | 0 | 0 | 117 | K334 P335 C339 | K334-G337 PolarHBondContact O-N 3.38Å; P335-G337 PolarHBondContact O-N 2.92Å; G337-C339 VanDerWaalsContact C-N 3.3Å; G337-C339 PolarHBondContact O-N 3Å | ||
| 338 | V | 48.6 | Very low | 70.6 | Confident | 118 Ų | 118 | 70.2 Ų | 70.2 | 72% | 0.715 | 43% | 0.429 | S | S | * | . | trans | -75.7 | 87.4 | 174 | -171.6 | 0 | 0 | 0 | 0 | 107.9 | N336 G340 | N336-V338 PolarHBondContact O-N 2.88Å; V338-G340 PolarHBondContact O-N 3.3Å | ||
| 339 | C | 54.9 | Low | 71.1 | Confident | 47 Ų | 47 | 76.7 Ų | 76.7 | 32% | 0.318 | 45% | 0.453 | S | S | . | . | P | Polyproline II helix | trans | -52.7 | 122.4 | 164.7 | -82.9 | 0 | 0 | 0 | 0 | 107.6 | G337 S375 | G337-C339 VanDerWaalsContact C-N 3.3Å; G337-C339 PolarHBondContact O-N 3Å; C339-S375 PolarHBondContact SG-OG 3.43Å |
| 340 | G | 62.7 | Low | 71.7 | Confident | 23 Ų | 23 | 80.4 Ų | 80.4 | 24% | 0.237 | 48% | 0.48 | C | S | . | . | P | Polyproline II helix | trans | -50.8 | 163.2 | 172 | 0 | 0 | 0 | 0 | 0 | 111.5 | V338 L342 Q374 | V338-G340 PolarHBondContact O-N 3.3Å; G340-L342 PolarHBondContact O-N 3.04Å; G340-L342 VanDerWaalsContact O-N 3.16Å; G340-Q374 PolarHBondContact O-NE2 2.96Å; G340-Q374 PolarHBondContact O-OE1 3.16Å |
| 341 | T | 76.9 | Confident | 72.9 | Confident | 101 Ų | 101 | 77.2 Ų | 77.2 | 62% | 0.62 | 46% | 0.463 | S | S | * | . | P | Polyproline II helix | trans | -46.7 | 127.1 | 179.1 | -52.6 | 0 | 0 | 0 | 0 | 110 | F328 Q374 | F328-T341 WeakPolarHBondContact CD1-O 3.48Å; T341-Q374 PolarHBondContact O-NE2 3.2Å; T341-Q374 VanDerWaalsContact O-NE2 3.16Å |
| 342 | L | 85.4 | Confident | 74.6 | Confident | 41 Ų | 41 | 74.7 Ų | 74.7 | 22% | 0.215 | 43% | 0.433 | C | S | . | . | P | Polyproline II helix | trans | -86.3 | 139.4 | 173.5 | -80.1 | 170.1 | 0 | 0 | 0 | 108.9 | G340 I370 R371 | G340-L342 PolarHBondContact O-N 3.04Å; G340-L342 VanDerWaalsContact O-N 3.16Å; L342-I370 HydrophobicContact CD2-CG2 3.97Å; L342-R371 HydrophobicContact CD1-CB 4.07Å; L342-R371 HydrophobicContact CD1-CG 3.95Å; L342-R371 HydrophobicContact CD2-CB 3.78Å; L342-R371 HydrophobicContact CD2-CG 4.37Å |
| 343 | P | 88.6 | Confident | 76.4 | Confident | 0 Ų | 0 | 71.8 Ų | 71.8 | 0% | 0 | 43% | 0.426 | C | S | . | . | P | Polyproline II helix | trans | -59 | 145.2 | 173.3 | 24.6 | -32.2 | 0 | 0 | 0 | 110.2 | F325 F328 V348 R367 I370 | F325-P343 HydrophobicContact CD1-CB 4.2Å; F325-P343 HydrophobicContact CD1-CG 4.01Å; F325-P343 HydrophobicContact CE1-CB 4.25Å; F325-P343 HydrophobicContact CE1-CG 4.23Å; F328-P343 HydrophobicContact CD1-CB 4.05Å; F328-P343 HydrophobicContact CD1-CG 4.34Å; F328-P343 HydrophobicContact CD2-CB 4.02Å; F328-P343 HydrophobicContact CD2-CG 4.24Å; F328-P343 HydrophobicContact CE1-CB 3.76Å; F328-P343 HydrophobicContact CE2-CB 3.74Å; F328-P343 HydrophobicContact CE2-CG 4.45Å; F328-P343 HydrophobicContact CG-CB 4.17Å; F328-P343 HydrophobicContact CG-CG 4.19Å; F328-P343 HydrophobicContact CZ-CB 3.62Å; P343-V348 HydrophobicContact CB-CG2 3.75Å; P343-V348 HydrophobicContact CG-CG2 3.61Å; P343-R367 PolarHBondContact O-NE 2.74Å; P343-I370 HydrophobicContact CG-CD1 3.76Å; P343-I370 HydrophobicContact CG-CG2 4.47Å |
| 344 | S | 91.3 | Very high | 77.8 | Confident | 54 Ų | 54 | 74.1 Ų | 74.1 | 38% | 0.378 | 44% | 0.443 | S | S | . | . | P | Polyproline II helix | trans | -64.1 | 152.8 | 173 | 68.4 | 0 | 0 | 0 | 0 | 110 | S346 E347 V348 | S344-S346 PolarHBondContact O-N 3.21Å; S344-S346 PolarHBondContact OG-OG 3Å; S344-S346 VanDerWaalsContact OG-OG 3.05Å; S344-E347 PolarHBondContact O-N 3.4Å; S344-E347 WeakPolarHBondContact OG-CB 3.42Å; S344-E347 PolarHBondContact OG-N 3.43Å; S344-V348 WeakPolarHBondContact O-CG2 3.43Å; S344-V348 PolarHBondContact O-N 3.3Å |
| 345 | L | 92.2 | Very high | 79.5 | Confident | 63 Ų | 63 | 67 Ų | 67 | 33% | 0.33 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -63.5 | -34.2 | -179.3 | -170.9 | 67.7 | 0 | 0 | 0 | 111.7 | V348 R349 A363 | L345-V348 PolarHBondContact O-N 3.34Å; L345-R349 VanDerWaalsContact O-CG 3.3Å; L345-R349 WeakPolarHBondContact O-CG 3.48Å; L345-R349 PolarHBondContact O-N 3.42Å; L345-A363 HydrophobicContact CD1-CB 3.83Å |
| 346 | S | 92 | Very high | 81 | Confident | 85 Ų | 85 | 69.1 Ų | 69.1 | 59% | 0.594 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -63 | -43.4 | 174.8 | 46.9 | 0 | 0 | 0 | 0 | 111.8 | S344 R349 S350 | S344-S346 PolarHBondContact O-N 3.21Å; S344-S346 PolarHBondContact OG-OG 3Å; S344-S346 VanDerWaalsContact OG-OG 3.05Å; S346-R349 WeakPolarHBondContact O-CB 3.43Å; S346-R349 PolarHBondContact O-N 3.49Å; S346-S350 PolarHBondContact O-N 3.49Å |
| 347 | E | 91.4 | Very high | 82.9 | Confident | 53 Ų | 53 | 62.7 Ų | 62.7 | 25% | 0.248 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -66.5 | -42.8 | 176.8 | 179.1 | 172.1 | -159.8 | 0 | 0 | 112.4 | F328 S344 R349 S350 R351 | F328-E347 VanDerWaalsContact CZ-CD 3.47Å; F328-E347 WeakPolarHBondContact CZ-OE1 3.26Å; F328-E347 VanDerWaalsContact CZ-OE2 3.24Å; F328-E347 WeakPolarHBondContact CZ-OE2 3.46Å; S344-E347 PolarHBondContact O-N 3.4Å; S344-E347 WeakPolarHBondContact OG-CB 3.42Å; S344-E347 PolarHBondContact OG-N 3.43Å; E347-R349 VanDerWaalsContact C-N 3.29Å; E347-R349 PolarHBondContact O-N 2.91Å; E347-S350 PolarHBondContact O-N 3.18Å; E347-R351 HydrophobicContact CG-CG 4.48Å; E347-R351 PolarHBondContact O-N 2.96Å; E347-R351 IonicContact OE1-CZ 3.29Å; E347-R351 IonicContact OE1-NE 3.03Å; E347-R351 PolarHBondContact OE1-NE 2.92Å; E347-R351 IonicContact OE1-NH2 2.74Å; E347-R351 PolarHBondContact OE1-NH2 2.88Å |
| 348 | V | 93.7 | Very high | 84.7 | Confident | 0 Ų | 0 | 65.3 Ų | 65.3 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -58.3 | -45.6 | 173.6 | 179.2 | 0 | 0 | 0 | 0 | 109.9 | F325 P343 S344 L345 S350 R351 I352 A363 V366 R367 | F325-V348 HydrophobicContact CE1-CB 4.35Å; F325-V348 HydrophobicContact CE1-CG2 3.88Å; F325-V348 HydrophobicContact CZ-CB 4.24Å; F325-V348 HydrophobicContact CZ-CG1 3.97Å; F325-V348 HydrophobicContact CZ-CG2 4.15Å; P343-V348 HydrophobicContact CB-CG2 3.75Å; P343-V348 HydrophobicContact CG-CG2 3.61Å; S344-V348 WeakPolarHBondContact O-CG2 3.43Å; S344-V348 PolarHBondContact O-N 3.3Å; L345-V348 PolarHBondContact O-N 3.34Å; V348-S350 VanDerWaalsContact C-N 3.34Å; V348-S350 PolarHBondContact O-N 2.89Å; V348-R351 PolarHBondContact O-N 3.38Å; V348-I352 HydrophobicContact CG1-CG2 4.04Å; V348-I352 VanDerWaalsContact O-CG1 3.25Å; V348-I352 WeakPolarHBondContact O-CG1 3.49Å; V348-I352 VanDerWaalsContact O-CG2 3.28Å; V348-I352 WeakPolarHBondContact O-CG2 3.44Å; V348-I352 PolarHBondContact O-N 2.84Å; V348-A363 HydrophobicContact CB-CB 4.29Å; V348-A363 HydrophobicContact CG1-CB 3.86Å; V348-A363 WeakPolarHBondContact CG1-O 3.28Å; V348-V366 HydrophobicContact CG1-CB 3.89Å; V348-V366 HydrophobicContact CG1-CG1 3.79Å; V348-R367 HydrophobicContact CG2-CB 4.27Å |
| 349 | R | 93.9 | Very high | 86.5 | Confident | 155 Ų | 155 | 65.3 Ų | 65.3 | 59% | 0.585 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -57.9 | -44.8 | 175.9 | -75.2 | 173.9 | 176.5 | 178.7 | -1.4 | 112.2 | L345 S346 E347 I352 A353 A363 | L345-R349 VanDerWaalsContact O-CG 3.3Å; L345-R349 WeakPolarHBondContact O-CG 3.48Å; L345-R349 PolarHBondContact O-N 3.42Å; S346-R349 WeakPolarHBondContact O-CB 3.43Å; S346-R349 PolarHBondContact O-N 3.49Å; E347-R349 VanDerWaalsContact C-N 3.29Å; E347-R349 PolarHBondContact O-N 2.91Å; R349-I352 WeakPolarHBondContact O-CG1 3.37Å; R349-A353 VanDerWaalsContact O-CB 3.31Å; R349-A353 WeakPolarHBondContact O-CB 3.25Å; R349-A353 PolarHBondContact O-N 2.74Å; R349-A353 VanDerWaalsContact O-N 3.14Å; R349-A363 HydrophobicContact CB-CB 4.47Å; R349-A363 HydrophobicContact CG-CB 3.46Å; R349-A363 VanDerWaalsContact CG-CB 3.46Å |
| 350 | S | 92.3 | Very high | 88 | Confident | 87 Ų | 87 | 65 Ų | 65 | 61% | 0.608 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -62.9 | -49 | 179.3 | -179.1 | 0 | 0 | 0 | 0 | 112 | S346 E347 V348 A353 | S346-S350 PolarHBondContact O-N 3.49Å; E347-S350 PolarHBondContact O-N 3.18Å; V348-S350 VanDerWaalsContact C-N 3.34Å; V348-S350 PolarHBondContact O-N 2.89Å; S350-A353 PolarHBondContact O-N 3.03Å |
| 351 | R | 91.5 | Very high | 89.3 | Confident | 58 Ų | 58 | 65.2 Ų | 65.2 | 22% | 0.219 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -70.7 | -35.5 | -178.4 | -65.8 | -170 | -167.4 | -145.8 | -4 | 113.5 | L324 F325 E327 E347 V348 A353 S354 | L324-R351 PolarHBondContact O-NH1 3.19Å; F325-R351 HydrophobicContact CE1-CB 4.19Å; F325-R351 HydrophobicContact CE1-CG 4.41Å; F325-R351 HydrophobicContact CZ-CB 3.9Å; E327-R351 IonicContact OE1-CZ 3.35Å; E327-R351 IonicContact OE1-NH1 3.33Å; E327-R351 IonicContact OE1-NH2 2.7Å; E327-R351 PolarHBondContact OE1-NH2 2.99Å; E327-R351 IonicContact OE2-CZ 3.47Å; E327-R351 IonicContact OE2-NH1 3.58Å; E327-R351 PolarHBondContact OE2-NH1 3.32Å; E327-R351 IonicContact OE2-NH2 2.64Å; E327-R351 PolarHBondContact OE2-NH2 3.35Å; E347-R351 HydrophobicContact CG-CG 4.48Å; E347-R351 PolarHBondContact O-N 2.96Å; E347-R351 IonicContact OE1-CZ 3.29Å; E347-R351 IonicContact OE1-NE 3.03Å; E347-R351 PolarHBondContact OE1-NE 2.92Å; E347-R351 IonicContact OE1-NH2 2.74Å; E347-R351 PolarHBondContact OE1-NH2 2.88Å; V348-R351 PolarHBondContact O-N 3.38Å; R351-A353 VanDerWaalsContact C-N 3.32Å; R351-S354 PolarHBondContact O-OG 3.24Å; R351-S354 VanDerWaalsContact O-OG 3.13Å |
| 352 | I | 92.5 | Very high | 90.1 | Very high | 13 Ų | 13 | 64.2 Ų | 64.2 | 7% | 0.067 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -72.4 | -30 | 177.9 | 70.5 | -176.4 | 0 | 0 | 0 | 111.5 | F325 V348 R349 S354 S355 L357 K358 A363 V366 | F325-I352 HydrophobicContact CE2-CG2 4.44Å; F325-I352 HydrophobicContact CZ-CG2 4.33Å; V348-I352 HydrophobicContact CG1-CG2 4.04Å; V348-I352 VanDerWaalsContact O-CG1 3.25Å; V348-I352 WeakPolarHBondContact O-CG1 3.49Å; V348-I352 VanDerWaalsContact O-CG2 3.28Å; V348-I352 WeakPolarHBondContact O-CG2 3.44Å; V348-I352 PolarHBondContact O-N 2.84Å; R349-I352 WeakPolarHBondContact O-CG1 3.37Å; I352-S354 PolarHBondContact O-N 2.94Å; I352-S355 WeakPolarHBondContact CA-OG 3.3Å; I352-S355 WeakPolarHBondContact O-CA 3.32Å; I352-S355 WeakPolarHBondContact O-CB 3.3Å; I352-S355 PolarHBondContact O-N 3.05Å; I352-S355 VanDerWaalsContact O-O 3.08Å; I352-S355 PolarHBondContact O-OG 3.25Å; I352-L357 HydrophobicContact CB-CB 4.36Å; I352-L357 HydrophobicContact CG2-CB 4.33Å; I352-L357 HydrophobicContact CG2-CD1 4.43Å; I352-K358 WeakPolarHBondContact O-CB 3.22Å; I352-A363 HydrophobicContact CD1-CB 3.79Å; I352-V366 HydrophobicContact CG2-CG1 4.28Å; I352-V366 HydrophobicContact CG2-CG2 4.24Å |
| 353 | A | 89.5 | Confident | 90.4 | Very high | 56 Ų | 56 | 62.6 Ų | 62.6 | 46% | 0.463 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.6 | -29.3 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | R349 S350 R351 S355 K358 | R349-A353 VanDerWaalsContact O-CB 3.31Å; R349-A353 WeakPolarHBondContact O-CB 3.25Å; R349-A353 PolarHBondContact O-N 2.74Å; R349-A353 VanDerWaalsContact O-N 3.14Å; S350-A353 PolarHBondContact O-N 3.03Å; R351-A353 VanDerWaalsContact C-N 3.32Å; A353-S355 VanDerWaalsContact C-N 3.33Å; A353-K358 WeakPolarHBondContact O-CD 3.4Å |
| 354 | S | 86.6 | Confident | 90.7 | Very high | 106 Ų | 106 | 66.6 Ų | 66.6 | 74% | 0.741 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.1 | 5.6 | 173.4 | 59.3 | 0 | 0 | 0 | 0 | 113.7 | R351 I352 | R351-S354 PolarHBondContact O-OG 3.24Å; R351-S354 VanDerWaalsContact O-OG 3.13Å; I352-S354 PolarHBondContact O-N 2.94Å |
| 355 | S | 88.7 | Confident | 90.8 | Very high | 15 Ų | 15 | 65.5 Ų | 65.5 | 11% | 0.105 | 35% | 0.351 | C | S | . | . | S | Bend | trans | -122.5 | 163.8 | -175 | 83.8 | 0 | 0 | 0 | 0 | 112.6 | I352 A353 L357 K358 | I352-S355 WeakPolarHBondContact CA-OG 3.3Å; I352-S355 WeakPolarHBondContact O-CA 3.32Å; I352-S355 WeakPolarHBondContact O-CB 3.3Å; I352-S355 PolarHBondContact O-N 3.05Å; I352-S355 VanDerWaalsContact O-O 3.08Å; I352-S355 PolarHBondContact O-OG 3.25Å; A353-S355 VanDerWaalsContact C-N 3.33Å; S355-L357 PolarHBondContact O-N 3.06Å; S355-L357 VanDerWaalsContact O-N 3.12Å; S355-L357 WeakPolarHBondContact OG-CB 3.32Å; S355-L357 PolarHBondContact OG-N 2.87Å; S355-L357 VanDerWaalsContact OG-N 3.14Å; S355-K358 WeakPolarHBondContact O-CG 3.41Å; S355-K358 PolarHBondContact O-N 2.94Å |
| 356 | R | 88.8 | Confident | 90.8 | Very high | 175 Ų | 175 | 62.5 Ų | 62.5 | 66% | 0.66 | 34% | 0.335 | S | S | * | . | G | 310 helix | trans | -64.4 | -10.9 | 172.4 | -64.7 | -178.4 | 67.4 | -172 | 1.2 | 113.8 | W316 L320 K358 | W316-R356 HydrophobicContact CH2-CB 4.39Å; W316-R356 HydrophobicContact CZ3-CB 4.14Å; L320-R356 HydrophobicContact CD2-CB 4.4Å; R356-K358 VanDerWaalsContact C-N 3.29Å; R356-K358 PolarHBondContact O-N 2.93Å |
| 357 | L | 89.3 | Confident | 90.9 | Very high | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 32% | 0.324 | C | S | . | . | G | 310 helix | trans | -72.1 | -21.5 | 177.6 | -65.5 | 171 | 0 | 0 | 0 | 113 | W316 E317 L320 I321 L324 I352 S355 E359 T360 R361 | W316-L357 HydrophobicContact CZ3-CD2 4.41Å; E317-L357 HydrophobicContact CB-CD2 3.81Å; E317-L357 HydrophobicContact CG-CD2 3.95Å; L320-L357 HydrophobicContact CD2-CD1 4.23Å; L320-L357 HydrophobicContact CD2-CD2 4.28Å; L320-L357 HydrophobicContact CD2-CG 3.75Å; L320-L357 HydrophobicContact CG-CD1 4.1Å; L320-L357 HydrophobicContact CG-CG 4.18Å; I321-L357 HydrophobicContact CG1-CD1 3.63Å; L324-L357 HydrophobicContact CD1-CD1 3.91Å; I352-L357 HydrophobicContact CB-CB 4.36Å; I352-L357 HydrophobicContact CG2-CB 4.33Å; I352-L357 HydrophobicContact CG2-CD1 4.43Å; S355-L357 PolarHBondContact O-N 3.06Å; S355-L357 VanDerWaalsContact O-N 3.12Å; S355-L357 WeakPolarHBondContact OG-CB 3.32Å; S355-L357 PolarHBondContact OG-N 2.87Å; S355-L357 VanDerWaalsContact OG-N 3.14Å; L357-E359 PolarHBondContact O-N 3.4Å; L357-T360 PolarHBondContact O-N 3.13Å; L357-R361 PolarHBondContact O-N 3.23Å |
| 358 | K | 88.9 | Confident | 90.9 | Very high | 121 Ų | 121 | 62.9 Ų | 62.9 | 53% | 0.526 | 33% | 0.33 | S | S | . | . | G | 310 helix | trans | -59.1 | -31 | -178.7 | 76.4 | -170.2 | -175.8 | 179.3 | 0 | 112.9 | I352 A353 S355 R356 | I352-K358 WeakPolarHBondContact O-CB 3.22Å; A353-K358 WeakPolarHBondContact O-CD 3.4Å; S355-K358 WeakPolarHBondContact O-CG 3.41Å; S355-K358 PolarHBondContact O-N 2.94Å; R356-K358 VanDerWaalsContact C-N 3.29Å; R356-K358 PolarHBondContact O-N 2.93Å |
| 359 | E | 84.7 | Confident | 90.8 | Very high | 118 Ų | 118 | 65 Ų | 65 | 55% | 0.551 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.2 | -26.4 | -176.9 | -72.9 | 154 | -147 | 0 | 0 | 112 | L357 | L357-E359 PolarHBondContact O-N 3.4Š|
| 360 | T | 87.4 | Confident | 90.7 | Very high | 41 Ų | 41 | 57.6 Ų | 57.6 | 25% | 0.252 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109 | -21.2 | -170.3 | 66.6 | 0 | 0 | 0 | 0 | 114 | W316 E317 L357 | W316-T360 HydrophobicContact CH2-CG2 4.25Å; W316-T360 HydrophobicContact CZ2-CG2 4.29Å; E317-T360 VanDerWaalsContact OE1-CB 3.28Å; E317-T360 WeakPolarHBondContact OE1-CB 3.4Å; E317-T360 PolarHBondContact OE1-OG1 3.41Å; L357-T360 PolarHBondContact O-N 3.13Å |
| 361 | R | 90.6 | Very high | 90.6 | Very high | 27 Ų | 27 | 60.6 Ų | 60.6 | 10% | 0.102 | 31% | 0.309 | C | S | . | . | trans | -142.9 | 145.7 | -171.1 | -57.7 | -65.3 | 170 | -141.2 | 14.5 | 113 | R311 L312 F313 E317 L357 V366 | R311-R361 PolarHBondContact O-NH2 3.46Å; L312-R361 PolarHBondContact O-NH2 2.88Å; F313-R361 HydrophobicContact CD1-CG 4.34Å; F313-R361 HydrophobicContact CE1-CB 4.45Å; F313-R361 HydrophobicContact CE1-CG 3.74Å; F313-R361 HydrophobicContact CZ-CG 4.32Å; E317-R361 VanDerWaalsContact CD-NE 3.32Å; E317-R361 IonicContact OE1-CZ 3.28Å; E317-R361 IonicContact OE1-NE 3.44Å; E317-R361 PolarHBondContact OE1-NE 2.91Å; E317-R361 IonicContact OE1-NH2 3.24Å; E317-R361 IonicContact OE2-CZ 3.41Å; E317-R361 VanDerWaalsContact OE2-CZ 3.29Å; E317-R361 IonicContact OE2-NE 2.94Å; E317-R361 PolarHBondContact OE2-NE 3.1Å; E317-R361 IonicContact OE2-NH2 3.51Å; E317-R361 PolarHBondContact OE2-NH2 2.9Å; L357-R361 PolarHBondContact O-N 3.23Å; R361-V366 HydrophobicContact CB-CG2 3.81Å | ||
| 362 | T | 92.5 | Very high | 90.5 | Very high | 80 Ų | 80 | 66.5 Ų | 66.5 | 49% | 0.491 | 33% | 0.331 | S | S | . | . | trans | -81.9 | 152.7 | 170 | 65 | 0 | 0 | 0 | 0 | 111.2 | T364 A365 V366 | T362-T364 PolarHBondContact O-N 3.39Å; T362-A365 WeakPolarHBondContact O-CB 3.39Å; T362-A365 PolarHBondContact O-N 3.14Å; T362-A365 WeakPolarHBondContact OG1-CB 3.43Å; T362-A365 PolarHBondContact OG1-N 3.32Å; T362-V366 PolarHBondContact O-N 3.14Å | ||
| 363 | A | 92.7 | Very high | 90.3 | Very high | 8 Ų | 8 | 66 Ų | 66 | 7% | 0.066 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -56.3 | -36.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L345 V348 R349 I352 V366 R367 | L345-A363 HydrophobicContact CD1-CB 3.83Å; V348-A363 HydrophobicContact CB-CB 4.29Å; V348-A363 HydrophobicContact CG1-CB 3.86Å; V348-A363 WeakPolarHBondContact CG1-O 3.28Å; R349-A363 HydrophobicContact CB-CB 4.47Å; R349-A363 HydrophobicContact CG-CB 3.46Å; R349-A363 VanDerWaalsContact CG-CB 3.46Å; I352-A363 HydrophobicContact CD1-CB 3.79Å; A363-V366 PolarHBondContact O-N 2.84Å; A363-R367 WeakPolarHBondContact O-CB 3.34Å; A363-R367 PolarHBondContact O-N 3.17Å |
| 364 | T | 93.4 | Very high | 90.1 | Very high | 83 Ų | 83 | 63.8 Ų | 63.8 | 51% | 0.509 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65 | -41.1 | 176.3 | -49.6 | 0 | 0 | 0 | 0 | 111.9 | T362 S368 | T362-T364 PolarHBondContact O-N 3.39Å; T364-S368 WeakPolarHBondContact O-CB 3.28Å; T364-S368 PolarHBondContact O-N 3.26Å; T364-S368 PolarHBondContact O-OG 3.47Å |
| 365 | A | 93.4 | Very high | 89.9 | Confident | 31 Ų | 31 | 62.4 Ų | 62.4 | 26% | 0.256 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -65.2 | -45.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | F313 T362 S368 K369 | F313-A365 HydrophobicContact CZ-CB 4.18Å; F313-A365 WeakPolarHBondContact CZ-O 3.31Å; T362-A365 WeakPolarHBondContact O-CB 3.39Å; T362-A365 PolarHBondContact O-N 3.14Å; T362-A365 WeakPolarHBondContact OG1-CB 3.43Å; T362-A365 PolarHBondContact OG1-N 3.32Å; A365-S368 PolarHBondContact O-N 3.3Å; A365-K369 PolarHBondContact O-N 3.32Å |
| 366 | V | 93.5 | Very high | 89.8 | Confident | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -60.8 | -47.3 | 176.5 | 173.9 | 0 | 0 | 0 | 0 | 110.8 | F313 I321 F325 V348 I352 R361 T362 A363 S368 K369 I370 | F313-V366 HydrophobicContact CE1-CG2 4.34Å; I321-V366 HydrophobicContact CD1-CG1 4.25Å; I321-V366 HydrophobicContact CG1-CG1 4.15Å; F325-V366 HydrophobicContact CE2-CG1 3.85Å; F325-V366 HydrophobicContact CZ-CG1 4.28Å; V348-V366 HydrophobicContact CG1-CB 3.89Å; V348-V366 HydrophobicContact CG1-CG1 3.79Å; I352-V366 HydrophobicContact CG2-CG1 4.28Å; I352-V366 HydrophobicContact CG2-CG2 4.24Å; R361-V366 HydrophobicContact CB-CG2 3.81Å; T362-V366 PolarHBondContact O-N 3.14Å; A363-V366 PolarHBondContact O-N 2.84Å; V366-S368 VanDerWaalsContact C-N 3.29Å; V366-S368 PolarHBondContact O-N 2.7Å; V366-K369 WeakPolarHBondContact O-CB 3.46Å; V366-K369 PolarHBondContact O-N 3.21Å; V366-K369 VanDerWaalsContact O-N 3.1Å; V366-I370 HydrophobicContact CG1-CD1 3.99Å; V366-I370 HydrophobicContact CG1-CG1 4.47Å; V366-I370 WeakPolarHBondContact O-CG1 3.45Å; V366-I370 PolarHBondContact O-N 2.8Å |
| 367 | R | 92.8 | Very high | 89.4 | Confident | 94 Ų | 94 | 57.4 Ų | 57.4 | 36% | 0.355 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -59.9 | -40.3 | 176.8 | -168.8 | 174 | -178.5 | -100.8 | -1.5 | 112.2 | P343 V348 A363 I370 R371 | P343-R367 PolarHBondContact O-NE 2.74Å; V348-R367 HydrophobicContact CG2-CB 4.27Å; A363-R367 WeakPolarHBondContact O-CB 3.34Å; A363-R367 PolarHBondContact O-N 3.17Å; R367-I370 PolarHBondContact O-N 2.88Å; R367-R371 PolarHBondContact O-N 3.13Å |
| 368 | S | 91.5 | Very high | 89.2 | Confident | 53 Ų | 53 | 59.6 Ų | 59.6 | 37% | 0.371 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -65.5 | -38.9 | 175.7 | -59.4 | 0 | 0 | 0 | 0 | 112 | T364 A365 V366 R371 R372 | T364-S368 WeakPolarHBondContact O-CB 3.28Å; T364-S368 PolarHBondContact O-N 3.26Å; T364-S368 PolarHBondContact O-OG 3.47Å; A365-S368 PolarHBondContact O-N 3.3Å; V366-S368 VanDerWaalsContact C-N 3.29Å; V366-S368 PolarHBondContact O-N 2.7Å; S368-R371 PolarHBondContact O-N 3.2Å; S368-R372 WeakPolarHBondContact O-CG 3.47Å; S368-R372 PolarHBondContact O-N 2.91Å |
| 369 | K | 93.1 | Very high | 88.9 | Confident | 43 Ų | 43 | 54.1 Ų | 54.1 | 19% | 0.187 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -65 | -44.1 | 174.6 | 179.1 | 63.7 | 172.8 | -171.4 | 0 | 111.6 | F313 T318 I321 A365 V366 R371 R372 M373 | F313-K369 HydrophobicContact CB-CD 4.29Å; F313-K369 HydrophobicContact CD1-CB 4.49Å; F313-K369 HydrophobicContact CD1-CG 4.05Å; F313-K369 HydrophobicContact CD2-CB 4.04Å; F313-K369 HydrophobicContact CD2-CD 3.67Å; F313-K369 HydrophobicContact CD2-CG 3.85Å; F313-K369 HydrophobicContact CE1-CB 4.06Å; F313-K369 HydrophobicContact CE1-CG 4.11Å; F313-K369 HydrophobicContact CE2-CB 3.56Å; F313-K369 HydrophobicContact CE2-CD 4.12Å; F313-K369 HydrophobicContact CE2-CG 3.91Å; F313-K369 HydrophobicContact CG-CB 4.48Å; F313-K369 HydrophobicContact CG-CD 3.9Å; F313-K369 HydrophobicContact CG-CG 3.92Å; F313-K369 HydrophobicContact CZ-CB 3.57Å; F313-K369 HydrophobicContact CZ-CG 4.03Å; T318-K369 WeakPolarHBondContact OG1-CE 3.49Å; T318-K369 PolarHBondContact OG1-NZ 3.12Å; I321-K369 HydrophobicContact CD1-CB 4.36Å; I321-K369 HydrophobicContact CD1-CG 3.86Å; A365-K369 PolarHBondContact O-N 3.32Å; V366-K369 WeakPolarHBondContact O-CB 3.46Å; V366-K369 PolarHBondContact O-N 3.21Å; V366-K369 VanDerWaalsContact O-N 3.1Å; K369-R371 VanDerWaalsContact C-N 3.34Å; K369-R371 PolarHBondContact O-N 2.95Å; K369-R372 PolarHBondContact O-N 3.14Å; K369-M373 HydrophobicContact CD-CG 4.23Å; K369-M373 HydrophobicContact CD-SD 4.08Å; K369-M373 HydrophobicContact CG-CG 4.44Å; K369-M373 HydrophobicContact CG-SD 3.85Å; K369-M373 WeakPolarHBondContact O-CB 3.34Å; K369-M373 VanDerWaalsContact O-CG 3.24Å; K369-M373 WeakPolarHBondContact O-CG 3.42Å; K369-M373 PolarHBondContact O-N 3.47Å |
| 370 | I | 91.2 | Very high | 88.7 | Confident | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -57.4 | -48 | 174.4 | -65.6 | 167.6 | 0 | 0 | 0 | 110.2 | I321 F325 F329 L342 P343 V366 R367 R372 M373 Q374 | I321-I370 HydrophobicContact CG2-CD1 4.25Å; I321-I370 HydrophobicContact CG2-CG1 3.59Å; F325-I370 HydrophobicContact CB-CD1 3.99Å; F325-I370 HydrophobicContact CD1-CD1 3.77Å; F325-I370 HydrophobicContact CD2-CD1 3.65Å; F325-I370 HydrophobicContact CE1-CD1 4.13Å; F325-I370 HydrophobicContact CE2-CD1 4.03Å; F325-I370 HydrophobicContact CG-CD1 3.51Å; F325-I370 HydrophobicContact CG-CG1 4.49Å; F325-I370 HydrophobicContact CZ-CD1 4.26Å; F329-I370 HydrophobicContact CE1-CG2 4Å; F329-I370 HydrophobicContact CZ-CB 4.38Å; F329-I370 HydrophobicContact CZ-CG1 4.2Å; F329-I370 HydrophobicContact CZ-CG2 3.96Å; L342-I370 HydrophobicContact CD2-CG2 3.97Å; P343-I370 HydrophobicContact CG-CD1 3.76Å; P343-I370 HydrophobicContact CG-CG2 4.47Å; V366-I370 HydrophobicContact CG1-CD1 3.99Å; V366-I370 HydrophobicContact CG1-CG1 4.47Å; V366-I370 WeakPolarHBondContact O-CG1 3.45Å; V366-I370 PolarHBondContact O-N 2.8Å; R367-I370 PolarHBondContact O-N 2.88Å; I370-R372 PolarHBondContact O-N 3.27Å; I370-M373 PolarHBondContact O-N 3.22Å; I370-Q374 HydrophobicContact CG2-CG 4.46Å; I370-Q374 WeakPolarHBondContact O-CG 3.43Å; I370-Q374 PolarHBondContact O-N 3.5Å |
| 371 | R | 89.7 | Confident | 88.5 | Confident | 151 Ų | 151 | 57.8 Ų | 57.8 | 57% | 0.57 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -57.3 | -48 | 176.5 | -172.5 | 177.5 | -176.3 | 178.4 | 1.9 | 112.3 | L342 R367 S368 K369 M373 Q374 S375 | L342-R371 HydrophobicContact CD1-CB 4.07Å; L342-R371 HydrophobicContact CD1-CG 3.95Å; L342-R371 HydrophobicContact CD2-CB 3.78Å; L342-R371 HydrophobicContact CD2-CG 4.37Å; R367-R371 PolarHBondContact O-N 3.13Å; S368-R371 PolarHBondContact O-N 3.2Å; K369-R371 VanDerWaalsContact C-N 3.34Å; K369-R371 PolarHBondContact O-N 2.95Å; R371-M373 VanDerWaalsContact C-N 3.34Å; R371-M373 PolarHBondContact O-N 3.1Å; R371-Q374 PolarHBondContact O-N 3.01Å; R371-S375 PolarHBondContact O-N 3.18Å; R371-S375 PolarHBondContact O-OG 3.13Å; R371-S375 VanDerWaalsContact O-OG 3.09Å |
| 372 | R | 88.9 | Confident | 88.1 | Confident | 182 Ų | 182 | 59.6 Ų | 59.6 | 69% | 0.687 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -60.4 | -45.2 | 177.1 | -71.5 | -179.3 | -163.9 | -177.3 | 5.1 | 111.4 | S368 K369 I370 Q374 S375 S376 | S368-R372 WeakPolarHBondContact O-CG 3.47Å; S368-R372 PolarHBondContact O-N 2.91Å; K369-R372 PolarHBondContact O-N 3.14Å; I370-R372 PolarHBondContact O-N 3.27Å; R372-Q374 PolarHBondContact O-N 3.36Å; R372-S375 PolarHBondContact O-N 2.94Å; R372-S376 WeakPolarHBondContact O-CB 3.25Å; R372-S376 PolarHBondContact O-N 3.48Å; R372-S376 PolarHBondContact O-OG 3.45Å |
| 373 | M | 89.3 | Confident | 87 | Confident | 1 Ų | 1 | 62.9 Ų | 62.9 | 1% | 0.005 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.4 | -42.9 | 178.9 | -71.7 | 171.7 | 70.1 | 0 | 0 | 111.8 | T318 I321 S322 F329 K369 I370 R371 S376 G377 T378 W379 Y382 | T318-M373 HydrophobicContact CG2-CE 3.74Å; T318-M373 HydrophobicContact CG2-SD 3.89Å; I321-M373 HydrophobicContact CG2-SD 4.32Å; S322-M373 WeakPolarHBondContact OG-CE 3.35Å; F329-M373 HydrophobicContact CE1-CB 3.88Å; F329-M373 HydrophobicContact CE1-CE 4.48Å; F329-M373 HydrophobicContact CZ-CB 4.37Å; F329-M373 HydrophobicContact CZ-CE 4.11Å; F329-M373 HydrophobicContact CZ-SD 4.35Å; K369-M373 HydrophobicContact CD-CG 4.23Å; K369-M373 HydrophobicContact CD-SD 4.08Å; K369-M373 HydrophobicContact CG-CG 4.44Å; K369-M373 HydrophobicContact CG-SD 3.85Å; K369-M373 WeakPolarHBondContact O-CB 3.34Å; K369-M373 VanDerWaalsContact O-CG 3.24Å; K369-M373 WeakPolarHBondContact O-CG 3.42Å; K369-M373 PolarHBondContact O-N 3.47Å; I370-M373 PolarHBondContact O-N 3.22Å; R371-M373 VanDerWaalsContact C-N 3.34Å; R371-M373 PolarHBondContact O-N 3.1Å; M373-S376 PolarHBondContact O-N 2.89Å; M373-G377 WeakPolarHBondContact O-CA 3.34Å; M373-G377 PolarHBondContact O-N 2.98Å; M373-T378 PolarHBondContact O-N 3.44Å; M373-W379 HydrophobicContact CB-CB 4.26Å; M373-W379 HydrophobicContact CE-CB 3.64Å; M373-W379 VanDerWaalsContact O-CD1 3.26Å; M373-Y382 HydrophobicContact CE-CD2 4.25Å |
| 374 | Q | 85.8 | Confident | 86.8 | Confident | 11 Ų | 11 | 65.6 Ų | 65.6 | 5% | 0.051 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -60.2 | -46 | 174.6 | -75 | 176.2 | -27 | 0 | 0 | 111.7 | F328 F329 G340 T341 I370 R371 R372 | F328-Q374 PolarHBondContact O-NE2 3.46Å; F329-Q374 HydrophobicContact CD1-CG 3.97Å; F329-Q374 HydrophobicContact CE1-CG 4.04Å; G340-Q374 PolarHBondContact O-NE2 2.96Å; G340-Q374 PolarHBondContact O-OE1 3.16Å; T341-Q374 PolarHBondContact O-NE2 3.2Å; T341-Q374 VanDerWaalsContact O-NE2 3.16Å; I370-Q374 HydrophobicContact CG2-CG 4.46Å; I370-Q374 WeakPolarHBondContact O-CG 3.43Å; I370-Q374 PolarHBondContact O-N 3.5Å; R371-Q374 PolarHBondContact O-N 3.01Å; R372-Q374 PolarHBondContact O-N 3.36Å |
| 375 | S | 82.5 | Confident | 86.4 | Confident | 77 Ų | 77 | 64.7 Ų | 64.7 | 54% | 0.538 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -66.2 | -39.1 | 179.1 | -54.8 | 0 | 0 | 0 | 0 | 113 | C339 R371 R372 | C339-S375 PolarHBondContact SG-OG 3.43Å; R371-S375 PolarHBondContact O-N 3.18Å; R371-S375 PolarHBondContact O-OG 3.13Å; R371-S375 VanDerWaalsContact O-OG 3.09Å; R372-S375 PolarHBondContact O-N 2.94Å |
| 376 | S | 85 | Confident | 86 | Confident | 73 Ų | 73 | 66.6 Ų | 66.6 | 51% | 0.51 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -90.5 | -6.7 | -177 | 64.9 | 0 | 0 | 0 | 0 | 114.2 | R372 M373 T378 | R372-S376 WeakPolarHBondContact O-CB 3.25Å; R372-S376 PolarHBondContact O-N 3.48Å; R372-S376 PolarHBondContact O-OG 3.45Å; M373-S376 PolarHBondContact O-N 2.89Å; S376-T378 PolarHBondContact O-N 3.21Å; S376-T378 VanDerWaalsContact O-N 3.15Å; S376-T378 WeakPolarHBondContact OG-CG2 3.35Å; S376-T378 PolarHBondContact OG-OG1 3.05Å |
| 377 | G | 81.8 | Confident | 85.6 | Confident | 12 Ų | 12 | 70.5 Ų | 70.5 | 12% | 0.124 | 34% | 0.338 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 64.4 | 12.1 | -172.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | M373 W379 L380 | M373-G377 WeakPolarHBondContact O-CA 3.34Å; M373-G377 PolarHBondContact O-N 2.98Å; G377-W379 PolarHBondContact O-N 3.49Å; G377-L380 WeakPolarHBondContact O-CB 3.49Å; G377-L380 PolarHBondContact O-N 3.02Å |
| 378 | T | 85 | Confident | 85.1 | Confident | 46 Ų | 46 | 69 Ų | 69 | 28% | 0.282 | 34% | 0.337 | S | S | . | . | G | 310 helix | trans | -73.8 | -13.7 | -171.3 | 50.8 | 0 | 0 | 0 | 0 | 113.3 | M373 S376 L380 K381 Y382 | M373-T378 PolarHBondContact O-N 3.44Å; S376-T378 PolarHBondContact O-N 3.21Å; S376-T378 VanDerWaalsContact O-N 3.15Å; S376-T378 WeakPolarHBondContact OG-CG2 3.35Å; S376-T378 PolarHBondContact OG-OG1 3.05Å; T378-L380 PolarHBondContact O-N 3.26Å; T378-K381 PolarHBondContact O-N 3.22Å; T378-Y382 VanDerWaalsContact O-CD2 3.31Å; T378-Y382 WeakPolarHBondContact O-CD2 3.47Å |
| 379 | W | 82.2 | Confident | 84.7 | Confident | 6 Ų | 6 | 70.1 Ų | 70.1 | 2% | 0.023 | 34% | 0.335 | C | S | . | . | G | 310 helix | trans | -63.1 | -25.2 | 174 | 60.4 | -95.8 | 0 | 0 | 0 | 113 | F329 H330 M373 G377 K381 Y382 Q383 | F329-W379 HydrophobicContact CB-CD2 3.62Å; F329-W379 HydrophobicContact CB-CE3 3.73Å; F329-W379 HydrophobicContact CB-CG 4.02Å; F329-W379 HydrophobicContact CB-CH2 4.4Å; F329-W379 HydrophobicContact CB-CZ2 4.33Å; F329-W379 HydrophobicContact CB-CZ3 4.15Å; F329-W379 HydrophobicContact CD1-CB 3.58Å; F329-W379 AromaticContact CD1-CD1 3.45Å; F329-W379 VanDerWaalsContact CD1-CD1 3.45Å; F329-W379 AromaticContact CD1-CD2 3.92Å; F329-W379 HydrophobicContact CD1-CD2 3.92Å; F329-W379 AromaticContact CD1-CG 3.36Å; F329-W379 HydrophobicContact CD1-CG 3.36Å; F329-W379 HydrophobicContact CD2-CB 4.38Å; F329-W379 HydrophobicContact CE1-CB 3.75Å; F329-W379 AromaticContact CE1-CG 3.97Å; F329-W379 HydrophobicContact CE1-CG 3.97Å; F329-W379 HydrophobicContact CG-CB 3.92Å; F329-W379 AromaticContact CG-CD2 3.94Å; F329-W379 HydrophobicContact CG-CD2 3.94Å; F329-W379 HydrophobicContact CG-CE3 4.32Å; F329-W379 AromaticContact CG-CG 3.78Å; F329-W379 HydrophobicContact CG-CG 3.78Å; F329-W379 HydrophobicContact CZ-CB 4.23Å; H330-W379 WeakPolarHBondContact O-CZ2 3.25Å; M373-W379 HydrophobicContact CB-CB 4.26Å; M373-W379 HydrophobicContact CE-CB 3.64Å; M373-W379 VanDerWaalsContact O-CD1 3.26Å; G377-W379 PolarHBondContact O-N 3.49Å; W379-K381 PolarHBondContact O-N 3.42Å; W379-Y382 PolarHBondContact O-N 3.07Å; W379-Q383 HydrophobicContact CE3-CG 3.89Å; W379-Q383 HydrophobicContact CZ3-CG 4.07Å; W379-Q383 PolarHBondContact O-N 3.21Å |
| 380 | L | 81.4 | Confident | 84.1 | Confident | 77 Ų | 77 | 72 Ų | 72 | 40% | 0.403 | 35% | 0.345 | S | S | . | . | G | 310 helix | trans | -59.4 | -27 | 176.6 | -74.8 | 160.4 | 0 | 0 | 0 | 112.4 | G377 T378 Y382 | G377-L380 WeakPolarHBondContact O-CB 3.49Å; G377-L380 PolarHBondContact O-N 3.02Å; T378-L380 PolarHBondContact O-N 3.26Å; L380-Y382 PolarHBondContact O-N 3.16Å |
| 381 | K | 83.1 | Confident | 83.6 | Confident | 159 Ų | 159 | 77.5 Ų | 77.5 | 69% | 0.691 | 37% | 0.372 | S | S | * | . | G | 310 helix | trans | -73.3 | -11.1 | 177.5 | -60.2 | -173.2 | 177.6 | -171.5 | 0 | 113.7 | T378 W379 | T378-K381 PolarHBondContact O-N 3.22Å; W379-K381 PolarHBondContact O-N 3.42Å |
| 382 | Y | 82 | Confident | 83.1 | Confident | 64 Ų | 64 | 71.4 Ų | 71.4 | 25% | 0.251 | 36% | 0.355 | S | S | . | . | G | 310 helix | trans | -127.3 | 8.4 | -169.2 | -57.6 | -75.4 | 0 | 0 | 0 | 113.5 | T318 R319 S322 M373 T378 W379 L380 | T318-Y382 HydrophobicContact CG2-CD1 4.45Å; T318-Y382 HydrophobicContact CG2-CD2 3.68Å; T318-Y382 HydrophobicContact CG2-CE1 4.16Å; T318-Y382 HydrophobicContact CG2-CE2 3.36Å; T318-Y382 HydrophobicContact CG2-CG 4.21Å; R319-Y382 HydrophobicContact CG-CD1 3.5Å; R319-Y382 HydrophobicContact CG-CE1 4.21Å; R319-Y382 HydrophobicContact CG-CG 4.35Å; S322-Y382 VanDerWaalsContact OG-CB 3.28Å; S322-Y382 WeakPolarHBondContact OG-CB 3.12Å; M373-Y382 HydrophobicContact CE-CD2 4.25Å; T378-Y382 VanDerWaalsContact O-CD2 3.31Å; T378-Y382 WeakPolarHBondContact O-CD2 3.47Å; W379-Y382 PolarHBondContact O-N 3.07Å; L380-Y382 PolarHBondContact O-N 3.16Å |
| 383 | Q | 69.9 | Low | 82.5 | Confident | 149 Ų | 149 | 61.4 Ų | 61.4 | 70% | 0.696 | 33% | 0.325 | S | S | * | . | trans | -78.9 | 0 | 165.9 | -73 | -161.6 | -27.7 | 0 | 0 | 110.5 | W379 | W379-Q383 HydrophobicContact CE3-CG 3.89Å; W379-Q383 HydrophobicContact CZ3-CG 4.07Å; W379-Q383 PolarHBondContact O-N 3.21Å |
Retrieved 383 of 383 residues in 139.6 ms
(Link to these results)