| 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 | 38.7 | Very low | 44.3 | Very low | 228 Ų | 228 | 157.5 Ų | 157.5 | 100% | 1.123 | 81% | 0.807 | S | S | * | * | 0 | 101.5 | 0 | -66.7 | 178.2 | 179 | 0 | 0 | 106.2 | |||||
| 2 | T | 40.2 | Very low | 44.4 | Very low | 127 Ų | 127 | 149.7 Ų | 149.7 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | 69.9 | 127.4 | 103.2 | 55.6 | 0 | 0 | 0 | 0 | 113 | |||||
| 3 | T | 42.4 | Very low | 44.3 | Very low | 119 Ų | 119 | 148.1 Ų | 148.1 | 73% | 0.73 | 78% | 0.776 | S | S | * | * | cis | -164.1 | 137.8 | 2.4 | 22.8 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 4 | S | 37.8 | Very low | 44.4 | Very low | 117 Ų | 117 | 147.3 Ų | 147.3 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | -81.8 | 119.4 | 169 | -69.5 | 0 | 0 | 0 | 0 | 111.4 | V6 | S4-V6 PolarHBondContact O-N 3.21Å; S4-V6 VanDerWaalsContact O-N 3.15Å | ||
| 5 | L | 49.6 | Very low | 44.8 | Very low | 160 Ų | 160 | 148.3 Ų | 148.3 | 84% | 0.838 | 79% | 0.785 | S | S | * | * | trans | -79.4 | 92.5 | 174.7 | -67.9 | 175.9 | 0 | 0 | 0 | 110.9 | L7 | L5-L7 PolarHBondContact O-N 2.84Š| ||
| 6 | V | 47 | Very low | 45.1 | Very low | 107 Ų | 107 | 148.7 Ų | 148.7 | 65% | 0.648 | 78% | 0.784 | S | S | * | * | trans | -74.3 | 102.5 | 170 | -179.1 | 0 | 0 | 0 | 0 | 109.2 | S4 H8 | S4-V6 PolarHBondContact O-N 3.21Å; S4-V6 VanDerWaalsContact O-N 3.15Å; V6-H8 PolarHBondContact O-CD2 3.2Å; V6-H8 PolarHBondContact O-N 3.27Å | ||
| 7 | L | 44.6 | Very low | 44.9 | Very low | 168 Ų | 168 | 153.1 Ų | 153.1 | 88% | 0.88 | 79% | 0.789 | S | S | * | * | trans | -72.2 | 92.5 | 172 | -80 | 166.9 | 0 | 0 | 0 | 110.5 | L5 | L5-L7 PolarHBondContact O-N 2.84Š| ||
| 8 | H | 45.8 | Very low | 45 | Very low | 150 Ų | 150 | 152.1 Ų | 152.1 | 69% | 0.694 | 79% | 0.791 | S | S | * | * | trans | -67.1 | 127.2 | 170.6 | -74.9 | -94.6 | 0 | 0 | 0 | 111.1 | V6 R10 | V6-H8 PolarHBondContact O-CD2 3.2Å; V6-H8 PolarHBondContact O-N 3.27Å; H8-R10 PolarHBondContact O-N 3.27Å; H8-R10 VanDerWaalsContact O-N 3.17Å | ||
| 9 | P | 45.1 | Very low | 44.5 | Very low | 95 Ų | 95 | 154.6 Ų | 154.6 | 62% | 0.617 | 79% | 0.79 | S | S | * | * | trans | -73.4 | 109.2 | 176.9 | 29.6 | -34.2 | 0 | 0 | 0 | 110.8 | W11 | P9-W11 VanDerWaalsContact C-N 3.29Å; P9-W11 PolarHBondContact O-N 3.44Å | ||
| 10 | R | 50.1 | Low | 44.1 | Very low | 249 Ų | 249 | 156.1 Ų | 156.1 | 94% | 0.94 | 79% | 0.794 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.9 | 66.3 | -174.5 | -57.4 | -172.4 | 77 | 153.9 | 5.5 | 114.1 | H8 | H8-R10 PolarHBondContact O-N 3.27Å; H8-R10 VanDerWaalsContact O-N 3.17Å |
| 11 | W | 45.4 | Very low | 43.5 | Very low | 213 Ų | 213 | 156.3 Ų | 156.3 | 81% | 0.807 | 79% | 0.789 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124 | -5.4 | 169.6 | 63.8 | -91.8 | 0 | 0 | 0 | 114.1 | P9 | P9-W11 VanDerWaalsContact C-N 3.29Å; P9-W11 PolarHBondContact O-N 3.44Å |
| 12 | A | 46.4 | Very low | 43.2 | Very low | 63 Ų | 63 | 150.7 Ų | 150.7 | 52% | 0.521 | 77% | 0.773 | S | S | . | * | S | Bend | trans | -83.2 | 140.6 | 159.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||
| 13 | D | 42.8 | Very low | 43.5 | Very low | 129 Ų | 129 | 149.9 Ų | 149.9 | 69% | 0.69 | 77% | 0.769 | S | S | * | * | S | Bend | trans | 131.6 | -37.7 | 157.5 | -64.9 | -15.2 | 0 | 0 | 0 | 114.1 | L15 M16 | D13-L15 PolarHBondContact O-N 3.23Å; D13-M16 PolarHBondContact O-N 3.28Å |
| 14 | T | 46.2 | Very low | 43 | Very low | 137 Ų | 137 | 151.8 Ų | 151.8 | 84% | 0.84 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | 6.7 | -174.8 | -29.2 | 0 | 0 | 0 | 0 | 115.3 | ||
| 15 | L | 50.2 | Low | 42.9 | Very low | 162 Ų | 162 | 155.1 Ų | 155.1 | 85% | 0.848 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.7 | 3.6 | 178.2 | -72.5 | -179.6 | 0 | 0 | 0 | 114.5 | D13 | D13-L15 PolarHBondContact O-N 3.23Š|
| 16 | M | 49.8 | Very low | 42.2 | Very low | 155 Ų | 155 | 152.1 Ų | 152.1 | 76% | 0.764 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -88.7 | -2.3 | 178.3 | -69 | -62.2 | -66.8 | 0 | 0 | 114 | D13 | D13-M16 PolarHBondContact O-N 3.28Š|
| 17 | Y | 41.3 | Very low | 41.6 | Very low | 224 Ų | 224 | 152.7 Ų | 152.7 | 88% | 0.878 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -113.9 | 35.1 | -172.9 | -89.9 | -79.9 | 0 | 0 | 0 | 114.8 | ||
| 18 | V | 45.9 | Very low | 41.2 | Very low | 135 Ų | 135 | 153 Ų | 153 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -134.3 | 36.5 | 167 | -157.6 | 0 | 0 | 0 | 0 | 111.1 | ||
| 19 | Y | 36 | Very low | 40.6 | Very low | 199 Ų | 199 | 151.4 Ų | 151.4 | 78% | 0.78 | 77% | 0.773 | S | S | * | * | trans | -127.8 | 51.2 | 170.5 | -147.1 | -91.4 | 0 | 0 | 0 | 111.1 | K21 | Y19-K21 HydrophobicContact CD1-CB 4.34Å; Y19-K21 HydrophobicContact CE1-CB 4.25Å; Y19-K21 PolarHBondContact O-N 3.38Å | ||
| 20 | E | 35.8 | Very low | 40.3 | Very low | 185 Ų | 185 | 155.3 Ų | 155.3 | 86% | 0.864 | 78% | 0.78 | S | S | * | * | trans | -64.9 | 106.3 | 158.6 | -99.6 | -85.6 | 98.9 | 0 | 0 | 107.9 | ||||
| 21 | K | 32.7 | Very low | 39.7 | Very low | 161 Ų | 161 | 148.5 Ų | 148.5 | 70% | 0.7 | 77% | 0.771 | S | S | * | * | trans | -98.4 | 97.5 | 178 | 174.3 | -169.2 | 171.9 | -173.7 | 0 | 107.5 | Y19 P23 | Y19-K21 HydrophobicContact CD1-CB 4.34Å; Y19-K21 HydrophobicContact CE1-CB 4.25Å; Y19-K21 PolarHBondContact O-N 3.38Å; K21-P23 WeakPolarHBondContact O-CD 3.49Å | ||
| 22 | S | 33.1 | Very low | 39.2 | Very low | 110 Ų | 110 | 147.2 Ų | 147.2 | 77% | 0.769 | 77% | 0.774 | S | S | * | * | trans | -59.7 | 126.3 | 169.6 | -55.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 23 | P | 45.2 | Very low | 38.7 | Very low | 110 Ų | 110 | 150.2 Ų | 150.2 | 71% | 0.714 | 79% | 0.786 | S | S | * | * | trans | -95.6 | 143.9 | 170.3 | 35 | -28.3 | 0 | 0 | 0 | 111.5 | K21 | K21-P23 WeakPolarHBondContact O-CD 3.49Š| ||
| 24 | N | 33.2 | Very low | 39 | Very low | 159 Ų | 159 | 152.2 Ų | 152.2 | 85% | 0.85 | 79% | 0.793 | S | S | * | * | trans | 49.1 | 116.1 | 163.3 | -80.2 | -4 | 0 | 0 | 0 | 120.2 | ||||
| 25 | E | 35.5 | Very low | 38.5 | Very low | 186 Ų | 186 | 154.5 Ų | 154.5 | 87% | 0.869 | 79% | 0.794 | S | S | * | * | -136.4 | 140.6 | 122.9 | -111 | -84.8 | 71.6 | 0 | 0 | 107.8 | |||||
| 26 | S | 34.1 | Very low | 37.8 | Very low | 97 Ų | 97 | 150.7 Ų | 150.7 | 68% | 0.678 | 79% | 0.794 | S | S | * | * | trans | -101.6 | 144.7 | -163 | 54.4 | 0 | 0 | 0 | 0 | 113.9 | Q28 | S26-Q28 PolarHBondContact O-N 2.89Š| ||
| 27 | S | 34.5 | Very low | 37.2 | Very low | 119 Ų | 119 | 151.7 Ų | 151.7 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | trans | -30.9 | 125 | 172.8 | -51.7 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 28 | Q | 35.9 | Very low | 36.9 | Very low | 175 Ų | 175 | 145.9 Ų | 145.9 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -144.7 | 119.2 | 143 | -101.6 | -172.5 | 10.9 | 0 | 0 | 113.7 | S26 | S26-Q28 PolarHBondContact O-N 2.89Š| ||
| 29 | N | 33.7 | Very low | 36.4 | Very low | 117 Ų | 117 | 142.8 Ų | 142.8 | 63% | 0.626 | 79% | 0.789 | S | S | * | * | trans | 59.4 | 115.3 | 142.2 | -70.2 | -41.6 | 0 | 0 | 0 | 123.5 | ||||
| 30 | K | 38.6 | Very low | 36.7 | Very low | 176 Ų | 176 | 140.4 Ų | 140.4 | 77% | 0.765 | 79% | 0.79 | S | S | * | * | 70.2 | 110.2 | 120.4 | -64.8 | 179.9 | -175.3 | -179.1 | 0 | 120.5 | |||||
| 31 | S | 36.9 | Very low | 36.7 | Very low | 107 Ų | 107 | 137.2 Ų | 137.2 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | trans | 38.4 | 97.4 | 132.2 | 60.7 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 32 | Q | 35.8 | Very low | 37.4 | Very low | 186 Ų | 186 | 135.9 Ų | 135.9 | 87% | 0.869 | 79% | 0.794 | S | S | * | * | trans | -91.6 | 99.7 | 166.4 | -167.7 | 168.7 | 28.3 | 0 | 0 | 110.5 | ||||
| 33 | T | 35.4 | Very low | 37.6 | Very low | 126 Ų | 126 | 134.8 Ų | 134.8 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | trans | -76.2 | 129.3 | 164.4 | -52 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 34 | M | 49.3 | Very low | 37.3 | Very low | 170 Ų | 170 | 136.4 Ų | 136.4 | 84% | 0.837 | 80% | 0.8 | S | S | * | * | trans | -97.7 | 99.5 | 177.6 | -91.9 | -99.8 | -69.1 | 0 | 0 | 110.4 | ||||
| 35 | E | 35.4 | Very low | 37.6 | Very low | 185 Ų | 185 | 136.8 Ų | 136.8 | 86% | 0.864 | 80% | 0.796 | S | S | * | * | trans | -140.1 | 120.2 | 153.3 | -70.2 | -160.7 | 153.7 | 0 | 0 | 109.3 | ||||
| 36 | G | 35.9 | Very low | 37.6 | Very low | 82 Ų | 82 | 132.5 Ų | 132.5 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | trans | -85.1 | 136.1 | -177.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 37 | L | 36.3 | Very low | 37.9 | Very low | 177 Ų | 177 | 138.3 Ų | 138.3 | 93% | 0.927 | 79% | 0.793 | S | S | * | * | trans | -69.9 | 143.1 | -175.8 | -79.1 | 163.3 | 0 | 0 | 0 | 113.6 | ||||
| 38 | S | 35.1 | Very low | 38.2 | Very low | 101 Ų | 101 | 138.8 Ų | 138.8 | 71% | 0.706 | 79% | 0.786 | S | S | * | * | trans | -45.7 | 130.9 | 167.4 | -176.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 39 | G | 35.9 | Very low | 38.4 | Very low | 71 Ų | 71 | 138.8 Ų | 138.8 | 73% | 0.732 | 79% | 0.791 | S | S | * | * | trans | -114.5 | 112.3 | 165.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 40 | N | 41.3 | Very low | 39 | Very low | 148 Ų | 148 | 141.6 Ų | 141.6 | 79% | 0.791 | 80% | 0.802 | S | S | * | * | trans | -72.7 | 141.3 | 178.1 | -83 | 9.4 | 0 | 0 | 0 | 112.1 | ||||
| 41 | C | 36.8 | Very low | 38.8 | Very low | 119 Ų | 119 | 138.8 Ų | 138.8 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | -67.4 | 164.9 | 165 | -51.1 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 42 | P | 47.3 | Very low | 38.8 | Very low | 132 Ų | 132 | 142.2 Ų | 142.2 | 86% | 0.857 | 81% | 0.808 | S | S | * | * | -130.2 | 164.3 | 104.8 | 36.6 | -29.9 | 0 | 0 | 0 | 114 | |||||
| 43 | A | 37.4 | Very low | 39.8 | Very low | 88 Ų | 88 | 138.8 Ų | 138.8 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | trans | -86.4 | 159.3 | -169.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 44 | T | 39.6 | Very low | 39.8 | Very low | 143 Ų | 143 | 137 Ų | 137 | 88% | 0.877 | 80% | 0.801 | S | S | * | * | trans | -158.8 | 129.8 | 136.7 | 18.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 45 | H | 39.8 | Very low | 39.5 | Very low | 168 Ų | 168 | 137.8 Ų | 137.8 | 78% | 0.778 | 81% | 0.807 | S | S | * | * | trans | 78 | 99.1 | 139.3 | -156.4 | -95.2 | 0 | 0 | 0 | 122 | ||||
| 46 | C | 34.7 | Very low | 39.5 | Very low | 95 Ų | 95 | 132.5 Ų | 132.5 | 64% | 0.642 | 80% | 0.803 | S | S | * | * | trans | 69.1 | 152.1 | 143.2 | -65.1 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 47 | R | 40.9 | Very low | 39.5 | Very low | 219 Ų | 219 | 139 Ų | 139 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | cis | -153.2 | 172.3 | -0.5 | -133.2 | -176.6 | 170.5 | 149.9 | -1.6 | 110.3 | ||||
| 48 | D | 39.6 | Very low | 39.7 | Very low | 129 Ų | 129 | 137 Ų | 137 | 69% | 0.69 | 79% | 0.787 | S | S | * | * | trans | -29.1 | 146.8 | 167.3 | -51 | -73.7 | 0 | 0 | 0 | 115.4 | ||||
| 49 | L | 40.2 | Very low | 40 | Very low | 176 Ų | 176 | 137.2 Ų | 137.2 | 92% | 0.921 | 79% | 0.789 | S | S | * | * | -152.3 | 153.4 | 66.6 | -80.9 | 164.6 | 0 | 0 | 0 | 114.8 | |||||
| 50 | M | 46.9 | Very low | 39.9 | Very low | 176 Ų | 176 | 137.4 Ų | 137.4 | 87% | 0.867 | 79% | 0.791 | S | S | * | * | trans | -111.4 | 131.6 | 178.6 | 170.1 | 148.8 | 55.4 | 0 | 0 | 111.5 | ||||
| 51 | S | 33.4 | Very low | 39.6 | Very low | 117 Ų | 117 | 135.3 Ų | 135.3 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | trans | -167.4 | 112.2 | 154.8 | 47.7 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 52 | H | 38.6 | Very low | 39.7 | Very low | 178 Ų | 178 | 137.3 Ų | 137.3 | 82% | 0.824 | 79% | 0.789 | S | S | * | * | trans | -92.9 | -175.3 | 153.7 | -71.1 | -75.5 | 0 | 0 | 0 | 108.5 | ||||
| 53 | P | 56.7 | Low | 39.1 | Very low | 115 Ų | 115 | 134.9 Ų | 134.9 | 75% | 0.747 | 78% | 0.78 | S | S | * | * | -132.4 | -158.9 | -62.8 | 40.7 | -24.9 | 0 | 0 | 0 | 111.6 | |||||
| 54 | A | 34.8 | Very low | 39 | Very low | 89 Ų | 89 | 136.6 Ų | 136.6 | 74% | 0.736 | 78% | 0.781 | S | S | * | * | trans | 87.1 | 119.8 | 153.7 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 55 | L | 43.9 | Very low | 38.9 | Very low | 186 Ų | 186 | 137.7 Ų | 137.7 | 97% | 0.974 | 78% | 0.776 | S | S | * | * | -140.4 | 141.8 | 129.7 | -76.5 | -176.2 | 0 | 0 | 0 | 108.1 | |||||
| 56 | G | 35.4 | Very low | 38.7 | Very low | 74 Ų | 74 | 138.8 Ų | 138.8 | 76% | 0.763 | 78% | 0.782 | S | S | * | * | trans | -135.8 | 163 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 57 | R | 34.2 | Very low | 38.6 | Very low | 217 Ų | 217 | 138 Ų | 138 | 82% | 0.819 | 79% | 0.79 | S | S | * | * | trans | -155.3 | 150.1 | 166.6 | -150.9 | 160.8 | -121.7 | -113.2 | 7.9 | 113.5 | ||||
| 58 | H | 41.1 | Very low | 38.6 | Very low | 135 Ų | 135 | 133.2 Ų | 133.2 | 63% | 0.625 | 79% | 0.79 | S | S | * | * | trans | -62.1 | 171.5 | -176.2 | 45.2 | -116.1 | 0 | 0 | 0 | 115.6 | ||||
| 59 | S | 41 | Very low | 38.3 | Very low | 106 Ų | 106 | 133 Ų | 133 | 74% | 0.741 | 79% | 0.793 | S | S | * | * | cis | -138.9 | 161.3 | 22.8 | -62.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 60 | G | 34.7 | Very low | 38.2 | Very low | 76 Ų | 76 | 134 Ų | 134 | 78% | 0.784 | 79% | 0.786 | S | S | * | * | 72.2 | 119.3 | 61.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 61 | S | 35.1 | Very low | 37.7 | Very low | 104 Ų | 104 | 130.9 Ų | 130.9 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | cis | -160.3 | 147.4 | 32.9 | -163.5 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 62 | I | 37.8 | Very low | 37.8 | Very low | 161 Ų | 161 | 131.2 Ų | 131.2 | 83% | 0.826 | 77% | 0.774 | S | S | * | * | trans | 24.1 | 141.7 | 133.1 | -52.7 | 172.7 | 0 | 0 | 0 | 118.9 | ||||
| 63 | A | 36.4 | Very low | 37.6 | Very low | 80 Ų | 80 | 129.6 Ų | 129.6 | 66% | 0.661 | 77% | 0.77 | S | S | * | * | cis | -173.9 | 172.2 | -19.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 64 | T | 34.7 | Very low | 36.5 | Very low | 124 Ų | 124 | 129.9 Ų | 129.9 | 76% | 0.761 | 78% | 0.775 | S | S | * | * | trans | -4.9 | 145 | 155.9 | 0.5 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 65 | H | 36.9 | Very low | 36.5 | Very low | 166 Ų | 166 | 130.8 Ų | 130.8 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | cis | -173.4 | 162.6 | 44.1 | 45.6 | -81.8 | 0 | 0 | 0 | 115.5 | ||||
| 66 | Q | 35.5 | Very low | 36.9 | Very low | 191 Ų | 191 | 126.8 Ų | 126.8 | 89% | 0.893 | 76% | 0.761 | S | S | * | * | trans | -12.1 | 154.5 | 160 | -50.7 | -168.8 | 72.1 | 0 | 0 | 121.6 | ||||
| 67 | G | 33.2 | Very low | 36.8 | Very low | 80 Ų | 80 | 132.1 Ų | 132.1 | 83% | 0.825 | 77% | 0.766 | S | S | * | * | trans | 156.1 | 127.3 | 148.6 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 68 | S | 39.9 | Very low | 36.7 | Very low | 118 Ų | 118 | 127.4 Ų | 127.4 | 83% | 0.825 | 77% | 0.766 | S | S | * | * | trans | -101.1 | 176.3 | 173.6 | -176.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 69 | V | 35.1 | Very low | 36.2 | Very low | 124 Ų | 124 | 123.9 Ų | 123.9 | 75% | 0.752 | 77% | 0.766 | S | S | * | * | trans | 110 | 112.1 | 153.7 | -176.3 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 70 | Y | 37 | Very low | 36.1 | Very low | 196 Ų | 196 | 130 Ų | 130 | 77% | 0.769 | 77% | 0.773 | S | S | * | * | trans | 56.6 | 138.6 | 145.9 | -99.3 | -105.2 | 0 | 0 | 0 | 126.4 | ||||
| 71 | S | 36.6 | Very low | 35.9 | Very low | 112 Ų | 112 | 133.9 Ų | 133.9 | 78% | 0.783 | 77% | 0.771 | S | S | * | * | trans | -175.8 | 122.7 | 135.6 | -68 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 72 | D | 34.6 | Very low | 35.9 | Very low | 123 Ų | 123 | 134.3 Ų | 134.3 | 66% | 0.658 | 77% | 0.773 | S | S | * | * | 58.1 | 135.3 | 70.7 | -76.2 | -37.5 | 0 | 0 | 0 | 113.8 | |||||
| 73 | I | 36.3 | Very low | 36.6 | Very low | 144 Ų | 144 | 132.9 Ų | 132.9 | 74% | 0.738 | 77% | 0.774 | S | S | * | * | cis | -161.5 | 163.6 | 14.5 | -116.2 | 158.2 | 0 | 0 | 0 | 112.4 | ||||
| 74 | S | 31.9 | Very low | 36.5 | Very low | 122 Ų | 122 | 133.4 Ų | 133.4 | 85% | 0.853 | 78% | 0.779 | S | S | * | * | trans | 84.2 | 146.3 | 155.2 | -92.2 | 0 | 0 | 0 | 0 | 126 | ||||
| 75 | S | 34.9 | Very low | 37.3 | Very low | 107 Ų | 107 | 132.9 Ų | 132.9 | 75% | 0.748 | 78% | 0.777 | S | S | * | * | trans | -112.8 | -171.2 | 173.1 | -148.6 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 76 | P | 52.9 | Low | 37.3 | Very low | 102 Ų | 102 | 133.3 Ų | 133.3 | 66% | 0.662 | 78% | 0.78 | S | S | * | * | cis | -144.9 | -169.2 | 9 | 43 | -20.8 | 0 | 0 | 0 | 118.2 | ||||
| 77 | E | 32.8 | Very low | 37.1 | Very low | 187 Ų | 187 | 130.1 Ų | 130.1 | 87% | 0.874 | 77% | 0.773 | S | S | * | * | trans | 72.6 | 133.1 | 155.5 | -119.9 | 160.9 | 108.1 | 0 | 0 | 118.9 | ||||
| 78 | S | 32.8 | Very low | 37.1 | Very low | 117 Ų | 117 | 131 Ų | 131 | 82% | 0.818 | 77% | 0.767 | S | S | * | * | cis | -147.6 | -172.1 | 11 | 71.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 79 | G | 31 | Very low | 37.1 | Very low | 61 Ų | 61 | 131 Ų | 131 | 63% | 0.629 | 77% | 0.767 | S | S | * | * | cis | 163.3 | 170.2 | 3.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 80 | R | 37.3 | Very low | 36.9 | Very low | 235 Ų | 235 | 131 Ų | 131 | 89% | 0.887 | 77% | 0.773 | S | S | * | * | trans | 68 | 138.2 | 179 | -58 | -175 | -169.6 | -89.1 | 3.3 | 116.3 | ||||
| 81 | Q | 31.9 | Very low | 36.7 | Very low | 158 Ų | 158 | 125.8 Ų | 125.8 | 74% | 0.738 | 77% | 0.769 | S | S | * | * | cis | -161.8 | 140.3 | -12.3 | -168.6 | 81 | 26 | 0 | 0 | 108.5 | ||||
| 82 | C | 34.3 | Very low | 36.7 | Very low | 113 Ų | 113 | 126.2 Ų | 126.2 | 76% | 0.764 | 77% | 0.773 | S | S | * | * | trans | -111 | 167.7 | 162.8 | -62.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 83 | P | 52.1 | Low | 37.1 | Very low | 130 Ų | 130 | 128.8 Ų | 128.8 | 84% | 0.844 | 79% | 0.785 | S | S | * | * | -137.2 | 153.3 | 117.8 | 31.9 | -17.6 | 0 | 0 | 0 | 114.8 | |||||
| 84 | A | 34.3 | Very low | 36.7 | Very low | 92 Ų | 92 | 127.9 Ų | 127.9 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | trans | -89.7 | -164.8 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 85 | P | 52.1 | Low | 37.3 | Very low | 113 Ų | 113 | 132.9 Ų | 132.9 | 73% | 0.734 | 79% | 0.794 | S | S | * | * | cis | -143.5 | 163.3 | 47.1 | 26.5 | -0.4 | 0 | 0 | 0 | 118.5 | ||||
| 86 | Q | 37.3 | Very low | 37.2 | Very low | 175 Ų | 175 | 131.1 Ų | 131.1 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | 40.3 | 140.3 | 133.4 | -44.7 | -81.7 | -29 | 0 | 0 | 119.5 | ||||
| 87 | T | 31.1 | Very low | 36.6 | Very low | 124 Ų | 124 | 135 Ų | 135 | 76% | 0.761 | 80% | 0.795 | S | S | * | * | -163.6 | 154.3 | 59 | 45.4 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 88 | S | 32.8 | Very low | 37.6 | Very low | 98 Ų | 98 | 132 Ų | 132 | 69% | 0.685 | 79% | 0.792 | S | S | * | * | trans | 17.2 | 119.1 | 152.3 | 61.4 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 89 | S | 39.3 | Very low | 38 | Very low | 119 Ų | 119 | 135.5 Ų | 135.5 | 83% | 0.832 | 79% | 0.792 | S | S | * | * | 47.9 | 108.6 | 118.2 | -50.2 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 90 | S | 31.3 | Very low | 38 | Very low | 124 Ų | 124 | 135.8 Ų | 135.8 | 87% | 0.867 | 80% | 0.796 | S | S | * | * | trans | 173.6 | 159.6 | 137.8 | 49.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 91 | A | 32.5 | Very low | 37.9 | Very low | 85 Ų | 85 | 131.9 Ų | 131.9 | 70% | 0.702 | 79% | 0.793 | S | S | * | * | cis | -158.3 | 163.1 | -34.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 92 | S | 36.1 | Very low | 38.7 | Very low | 122 Ų | 122 | 129.2 Ų | 129.2 | 85% | 0.853 | 79% | 0.789 | S | S | * | * | trans | 72.9 | 133.5 | 160.4 | -47.2 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 93 | L | 43.6 | Very low | 38.8 | Very low | 177 Ų | 177 | 134.7 Ų | 134.7 | 93% | 0.927 | 80% | 0.795 | S | S | * | * | trans | -72.5 | 145 | 171 | -65.9 | 150.6 | 0 | 0 | 0 | 111.8 | ||||
| 94 | S | 28.6 | Very low | 38.4 | Very low | 124 Ų | 124 | 139.4 Ų | 139.4 | 87% | 0.867 | 80% | 0.798 | S | S | * | * | trans | -159.5 | 139.9 | 135.3 | -154.9 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 95 | Y | 44.7 | Very low | 38.3 | Very low | 228 Ų | 228 | 138.3 Ų | 138.3 | 89% | 0.894 | 80% | 0.795 | S | S | * | * | trans | -86.7 | 108 | -177.9 | -157.4 | -98.2 | 0 | 0 | 0 | 109.1 | ||||
| 96 | G | 31.3 | Very low | 37.4 | Very low | 70 Ų | 70 | 139.1 Ų | 139.1 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | trans | -118.4 | 104.7 | -170 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 97 | Y | 41.5 | Very low | 37.6 | Very low | 183 Ų | 183 | 142.1 Ų | 142.1 | 72% | 0.718 | 81% | 0.806 | S | S | * | * | trans | -87.7 | 121.5 | 176.7 | -154.1 | -85.6 | 0 | 0 | 0 | 110.1 | F99 | Y97-F99 AromaticContact CD1-CD2 3.71Å; Y97-F99 HydrophobicContact CD1-CD2 3.71Å; Y97-F99 AromaticContact CD1-CE2 3.9Å; Y97-F99 HydrophobicContact CD1-CE2 3.9Å; Y97-F99 HydrophobicContact CE1-CD2 4.05Å; Y97-F99 AromaticContact CE1-CE2 3.83Å; Y97-F99 HydrophobicContact CE1-CE2 3.83Å; Y97-F99 PolarHBondContact O-N 3.27Å | ||
| 98 | P | 54.4 | Low | 37.8 | Very low | 125 Ų | 125 | 143 Ų | 143 | 81% | 0.812 | 81% | 0.805 | S | S | * | * | trans | -81.1 | 110.6 | 178.2 | 30.1 | -31.7 | 0 | 0 | 0 | 111.5 | ||||
| 99 | F | 40.5 | Very low | 37.8 | Very low | 189 Ų | 189 | 143.7 Ų | 143.7 | 83% | 0.829 | 81% | 0.81 | S | S | * | * | trans | -106.2 | 144.2 | 171.5 | -110.6 | -79.1 | 0 | 0 | 0 | 111.5 | Y97 | Y97-F99 AromaticContact CD1-CD2 3.71Å; Y97-F99 HydrophobicContact CD1-CD2 3.71Å; Y97-F99 AromaticContact CD1-CE2 3.9Å; Y97-F99 HydrophobicContact CD1-CE2 3.9Å; Y97-F99 HydrophobicContact CE1-CD2 4.05Å; Y97-F99 AromaticContact CE1-CE2 3.83Å; Y97-F99 HydrophobicContact CE1-CE2 3.83Å; Y97-F99 PolarHBondContact O-N 3.27Å | ||
| 100 | G | 30.8 | Very low | 37.6 | Very low | 68 Ų | 68 | 145.1 Ų | 145.1 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | trans | 88.9 | 144.9 | 169.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 101 | N | 36 | Very low | 37.7 | Very low | 153 Ų | 153 | 144.9 Ų | 144.9 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | cis | -162.2 | -177.7 | 0.4 | -141.2 | 14.9 | 0 | 0 | 0 | 106.7 | ||||
| 102 | P | 47.1 | Very low | 38 | Very low | 101 Ų | 101 | 148.7 Ų | 148.7 | 66% | 0.656 | 80% | 0.804 | S | S | * | * | cis | -126.4 | 155 | -11.2 | 38.7 | -22.8 | 0 | 0 | 0 | 115.1 | ||||
| 103 | Y | 37.3 | Very low | 37.9 | Very low | 228 Ų | 228 | 150 Ų | 150 | 89% | 0.894 | 80% | 0.802 | S | S | * | * | trans | -72.9 | 134.2 | 164.9 | -85.1 | -100.7 | 0 | 0 | 0 | 111.2 | G105 | Y103-G105 PolarHBondContact O-N 3.07Š| ||
| 104 | Y | 43.2 | Very low | 37.8 | Very low | 230 Ų | 230 | 147.8 Ų | 147.8 | 90% | 0.902 | 80% | 0.796 | S | S | * | * | trans | -68.5 | 98.5 | 163.2 | -85 | -90.3 | 0 | 0 | 0 | 109.9 | C106 | Y104-C106 PolarHBondContact O-N 2.99Š| ||
| 105 | G | 32.9 | Very low | 38 | Very low | 69 Ų | 69 | 148.8 Ų | 148.8 | 71% | 0.711 | 79% | 0.791 | S | S | * | * | trans | -75.4 | 108.8 | 174 | 0 | 0 | 0 | 0 | 0 | 112 | Y103 R107 | Y103-G105 PolarHBondContact O-N 3.07Å; G105-R107 PolarHBondContact O-N 3.3Å; G105-R107 VanDerWaalsContact O-N 3.15Å | ||
| 106 | C | 33.3 | Very low | 37.5 | Very low | 129 Ų | 129 | 144.3 Ų | 144.3 | 87% | 0.872 | 78% | 0.782 | S | S | * | * | trans | -64.8 | 111.2 | 167.5 | -70.6 | 0 | 0 | 0 | 0 | 110.3 | Y104 L108 | Y104-C106 PolarHBondContact O-N 2.99Å; C106-L108 PolarHBondContact O-N 2.86Å | ||
| 107 | R | 40.3 | Very low | 37.7 | Very low | 239 Ų | 239 | 148.6 Ų | 148.6 | 90% | 0.902 | 78% | 0.783 | S | S | * | * | trans | -66.5 | 120.8 | 167.2 | -74.3 | -107.9 | -174.2 | -116.4 | 2.2 | 109.4 | G105 S109 | G105-R107 PolarHBondContact O-N 3.3Å; G105-R107 VanDerWaalsContact O-N 3.15Å; R107-S109 PolarHBondContact O-N 3.25Å | ||
| 108 | L | 36.6 | Very low | 37.4 | Very low | 141 Ų | 141 | 147.2 Ų | 147.2 | 74% | 0.738 | 78% | 0.784 | S | S | * | * | trans | -87.4 | 93.4 | 177.6 | -174.5 | 67 | 0 | 0 | 0 | 109.4 | C106 H110 | C106-L108 PolarHBondContact O-N 2.86Å; L108-H110 PolarHBondContact O-N 3.48Å | ||
| 109 | S | 31.8 | Very low | 36.4 | Very low | 114 Ų | 114 | 149.5 Ų | 149.5 | 80% | 0.797 | 78% | 0.781 | S | S | * | * | trans | -71.1 | 89.6 | 179.7 | -54.6 | 0 | 0 | 0 | 0 | 111.8 | R107 S111 | R107-S109 PolarHBondContact O-N 3.25Å; S109-S111 PolarHBondContact O-N 3.17Å | ||
| 110 | H | 35.7 | Very low | 36.2 | Very low | 148 Ų | 148 | 146.7 Ų | 146.7 | 69% | 0.685 | 78% | 0.781 | S | S | * | * | trans | -77.1 | 102.5 | 163.2 | -84.9 | 83.5 | 0 | 0 | 0 | 109.4 | L108 H112 | L108-H110 PolarHBondContact O-N 3.48Å; H110-H112 VanDerWaalsContact C-N 3.31Å; H110-H112 PolarHBondContact O-N 3.42Å | ||
| 111 | S | 34.3 | Very low | 36.3 | Very low | 119 Ų | 119 | 149.2 Ų | 149.2 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | trans | -75.7 | 82.1 | 170.6 | 56.4 | 0 | 0 | 0 | 0 | 110.5 | S109 N113 | S109-S111 PolarHBondContact O-N 3.17Å; S111-N113 PolarHBondContact O-N 3.46Å | ||
| 112 | H | 38 | Very low | 36 | Very low | 165 Ų | 165 | 147 Ų | 147 | 76% | 0.764 | 78% | 0.784 | S | S | * | * | trans | -76.6 | 106.5 | 160.1 | -110.2 | -87.8 | 0 | 0 | 0 | 108.5 | H110 | H110-H112 VanDerWaalsContact C-N 3.31Å; H110-H112 PolarHBondContact O-N 3.42Å | ||
| 113 | N | 34.1 | Very low | 35.1 | Very low | 150 Ų | 150 | 152.5 Ų | 152.5 | 80% | 0.802 | 79% | 0.793 | S | S | * | * | trans | -149.2 | 90.6 | 164.9 | -135.4 | -64.9 | 0 | 0 | 0 | 108.5 | S111 | S111-N113 PolarHBondContact O-N 3.46Š| ||
| 114 | V | 40.8 | Very low | 35.1 | Very low | 131 Ų | 131 | 149.9 Ų | 149.9 | 79% | 0.794 | 79% | 0.788 | S | S | * | * | trans | -119.6 | 125.6 | 163.1 | -74.4 | 0 | 0 | 0 | 0 | 107 | ||||
| 115 | N | 33.8 | Very low | 35.2 | Very low | 145 Ų | 145 | 143.7 Ų | 143.7 | 78% | 0.775 | 78% | 0.776 | S | S | * | * | trans | -72.6 | 142.6 | -168.8 | -175.2 | -73.6 | 0 | 0 | 0 | 111.3 | Q117 | N115-Q117 PolarHBondContact O-N 2.95Š| ||
| 116 | L | 33.8 | Very low | 35.1 | Very low | 134 Ų | 134 | 145 Ų | 145 | 70% | 0.702 | 78% | 0.781 | S | S | * | * | trans | -80.4 | 106.1 | 179.7 | -173.5 | 77.9 | 0 | 0 | 0 | 110.4 | Q118 | L116-Q118 HydrophobicContact CD1-CG 4.01Å; L116-Q118 HydrophobicContact CG-CG 4.17Å | ||
| 117 | Q | 35.9 | Very low | 35.1 | Very low | 159 Ų | 159 | 148.1 Ų | 148.1 | 74% | 0.743 | 78% | 0.782 | S | S | * | * | trans | -119.9 | 98.4 | 156.1 | -161.3 | -179.9 | 107.9 | 0 | 0 | 110.1 | N115 | N115-Q117 PolarHBondContact O-N 2.95Š| ||
| 118 | Q | 35.8 | Very low | 35.1 | Very low | 155 Ų | 155 | 144.9 Ų | 144.9 | 72% | 0.724 | 78% | 0.775 | S | S | * | * | trans | -73.3 | 128.7 | 171.1 | -68 | 171.1 | -11.2 | 0 | 0 | 109.6 | L116 | L116-Q118 HydrophobicContact CD1-CG 4.01Å; L116-Q118 HydrophobicContact CG-CG 4.17Å | ||
| 119 | K | 32.5 | Very low | 34.9 | Very low | 173 Ų | 173 | 148.4 Ų | 148.4 | 75% | 0.752 | 78% | 0.78 | S | S | * | * | trans | -127 | 125.7 | 154.8 | -81.8 | -171.5 | 175.7 | -178.2 | 0 | 108 | ||||
| 120 | P | 36.8 | Very low | 35 | Very low | 129 Ų | 129 | 147.1 Ų | 147.1 | 84% | 0.838 | 78% | 0.776 | S | S | * | * | trans | -82.6 | 129 | 178.7 | 31.9 | -31.8 | 0 | 0 | 0 | 110.3 | ||||
| 121 | C | 32 | Very low | 35 | Very low | 121 Ų | 121 | 147.8 Ų | 147.8 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | -125.5 | 105.4 | 170.6 | -73.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 122 | S | 29.6 | Very low | 35.5 | Very low | 108 Ų | 108 | 147.4 Ų | 147.4 | 76% | 0.755 | 77% | 0.774 | S | S | * | * | trans | 39.7 | 108.6 | 149 | -55 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 123 | Y | 28.8 | Very low | 35.3 | Very low | 215 Ų | 215 | 144 Ų | 144 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | trans | -45.7 | 142.6 | 140.6 | -132.4 | -105.5 | 0 | 0 | 0 | 111.9 | ||||
| 124 | H | 36.9 | Very low | 35.2 | Very low | 174 Ų | 174 | 142.5 Ų | 142.5 | 81% | 0.806 | 77% | 0.766 | S | S | * | * | trans | -136.4 | 140.6 | 150.3 | -96.6 | -82.4 | 0 | 0 | 0 | 108.9 | ||||
| 125 | P | 45.1 | Very low | 34.9 | Very low | 99 Ų | 99 | 142.5 Ų | 142.5 | 64% | 0.643 | 77% | 0.766 | S | S | * | * | trans | -87.4 | 167.2 | -167.8 | 35.9 | -37 | 0 | 0 | 0 | 113.5 | ||||
| 126 | A | 30.9 | Very low | 35.1 | Very low | 98 Ų | 98 | 143.5 Ų | 143.5 | 81% | 0.81 | 77% | 0.77 | S | S | * | * | trans | -79.9 | 143 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 127 | E | 33.6 | Very low | 35.6 | Very low | 194 Ų | 194 | 142.5 Ų | 142.5 | 91% | 0.907 | 77% | 0.772 | S | S | * | * | trans | -121.8 | 155 | 159.6 | -66.5 | -157.1 | 147.8 | 0 | 0 | 110.7 | ||||
| 128 | K | 40.3 | Very low | 35.4 | Very low | 170 Ų | 170 | 140.7 Ų | 140.7 | 74% | 0.739 | 77% | 0.772 | S | S | * | * | trans | -111.8 | 168.9 | -169.3 | -71.9 | -174.3 | 173.1 | -174.4 | 0 | 111.8 | ||||
| 129 | Y | 32.2 | Very low | 35.3 | Very low | 215 Ų | 215 | 140.6 Ų | 140.6 | 84% | 0.843 | 77% | 0.771 | S | S | * | * | trans | 75.3 | 148.4 | 164.3 | -63.4 | -75.6 | 0 | 0 | 0 | 115.2 | ||||
| 130 | A | 34.7 | Very low | 35.4 | Very low | 88 Ų | 88 | 141.6 Ų | 141.6 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | cis | -143 | 153.6 | 3.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 131 | E | 34.4 | Very low | 35.4 | Very low | 162 Ų | 162 | 142.4 Ų | 142.4 | 76% | 0.757 | 78% | 0.775 | S | S | * | * | trans | -74.6 | 150.5 | 152.6 | -104.1 | -78.4 | 148.5 | 0 | 0 | 109 | S133 | E131-S133 PolarHBondContact OE2-N 2.98Š| ||
| 132 | P | 46 | Very low | 35.5 | Very low | 110 Ų | 110 | 142.8 Ų | 142.8 | 71% | 0.714 | 78% | 0.78 | S | S | * | * | -152.5 | 135.9 | 94.4 | 36.3 | -17.5 | 0 | 0 | 0 | 117.4 | |||||
| 133 | S | 33.8 | Very low | 35.8 | Very low | 93 Ų | 93 | 143.5 Ų | 143.5 | 65% | 0.65 | 78% | 0.779 | S | S | * | * | trans | 61.1 | 137.9 | 138.1 | -55 | 0 | 0 | 0 | 0 | 117.9 | E131 | E131-S133 PolarHBondContact OE2-N 2.98Š| ||
| 134 | T | 31.8 | Very low | 36 | Very low | 120 Ų | 120 | 144.9 Ų | 144.9 | 74% | 0.736 | 78% | 0.783 | S | S | * | * | 179.9 | 146.6 | 79 | -64.4 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 135 | T | 34.5 | Very low | 36.4 | Very low | 131 Ų | 131 | 141.7 Ų | 141.7 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | trans | 64.6 | 112.4 | 161.6 | 46.4 | 0 | 0 | 0 | 0 | 123 | ||||
| 136 | L | 37.8 | Very low | 36.1 | Very low | 165 Ų | 165 | 145.7 Ų | 145.7 | 86% | 0.864 | 79% | 0.785 | S | S | * | * | trans | -78.6 | -178.1 | 137.8 | -69.6 | 173.3 | 0 | 0 | 0 | 109.9 | ||||
| 137 | P | 43.5 | Very low | 36.8 | Very low | 113 Ų | 113 | 150 Ų | 150 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | cis | -128 | -177.3 | 1.5 | 38.3 | -17.6 | 0 | 0 | 0 | 113.5 | ||||
| 138 | T | 33 | Very low | 36.9 | Very low | 122 Ų | 122 | 149.4 Ų | 149.4 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | -177.6 | 135.2 | 90.4 | -66 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 139 | E | 34.2 | Very low | 37 | Very low | 152 Ų | 152 | 145.1 Ų | 145.1 | 71% | 0.71 | 78% | 0.779 | S | S | * | * | trans | 9.6 | 126 | 153.1 | -57.4 | -69.2 | 121 | 0 | 0 | 120.4 | ||||
| 140 | E | 34.2 | Very low | 37.2 | Very low | 195 Ų | 195 | 143.4 Ų | 143.4 | 91% | 0.911 | 78% | 0.776 | S | S | * | * | -154.8 | 127.8 | 110.4 | -137.3 | -174.3 | 163.3 | 0 | 0 | 112.1 | |||||
| 141 | L | 35.3 | Very low | 37.8 | Very low | 145 Ų | 145 | 149.2 Ų | 149.2 | 76% | 0.759 | 78% | 0.781 | S | S | * | * | trans | -97.1 | 129.6 | 177.8 | -77.4 | 156.8 | 0 | 0 | 0 | 110.5 | ||||
| 142 | S | 35.1 | Very low | 38.4 | Very low | 130 Ų | 130 | 145 Ų | 145 | 91% | 0.909 | 77% | 0.768 | S | S | * | * | trans | -127.3 | 127.2 | 162.3 | -171.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 143 | T | 36.3 | Very low | 38 | Very low | 122 Ų | 122 | 145.5 Ų | 145.5 | 75% | 0.748 | 77% | 0.774 | S | S | * | * | trans | -109.6 | 128.1 | -163 | 38.5 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 144 | R | 33.6 | Very low | 38.5 | Very low | 245 Ų | 245 | 149.8 Ų | 149.8 | 93% | 0.925 | 78% | 0.781 | S | S | * | * | trans | -164.9 | 163.6 | 151 | -110.4 | -157.4 | 151.9 | 116.3 | -5.4 | 111 | ||||
| 145 | P | 44.6 | Very low | 39.1 | Very low | 106 Ų | 106 | 148.9 Ų | 148.9 | 69% | 0.688 | 79% | 0.786 | S | S | * | * | -122.7 | 137.4 | -125.5 | 30.2 | -10.8 | 0 | 0 | 0 | 116.6 | |||||
| 146 | K | 39.4 | Very low | 39.1 | Very low | 183 Ų | 183 | 147.1 Ų | 147.1 | 80% | 0.796 | 78% | 0.779 | S | S | * | * | trans | 35.9 | 97.3 | 132.9 | -165.2 | 170.9 | -174.8 | 171.3 | 0 | 119.7 | ||||
| 147 | E | 44.5 | Very low | 39.3 | Very low | 188 Ų | 188 | 144.4 Ų | 144.4 | 88% | 0.879 | 77% | 0.774 | S | S | * | * | trans | -134.9 | 87.7 | 148.8 | -63.9 | -175.3 | -161.6 | 0 | 0 | 107.2 | ||||
| 148 | F | 35.1 | Very low | 39.1 | Very low | 183 Ų | 183 | 149.5 Ų | 149.5 | 80% | 0.803 | 78% | 0.78 | S | S | * | * | 49.3 | 64.2 | 92.9 | -139.6 | -83.9 | 0 | 0 | 0 | 115.8 | |||||
| 149 | A | 43.1 | Very low | 39.8 | Very low | 79 Ų | 79 | 151.7 Ų | 151.7 | 65% | 0.653 | 78% | 0.782 | S | S | * | * | trans | -118.3 | 112.7 | 162.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | Y151 | A149-Y151 PolarHBondContact O-N 2.85Š| ||
| 150 | F | 37.6 | Very low | 40.6 | Very low | 180 Ų | 180 | 148.9 Ų | 148.9 | 79% | 0.789 | 78% | 0.784 | S | S | * | * | trans | -88.3 | 98.5 | -176.8 | -171.3 | -87.8 | 0 | 0 | 0 | 109.8 | ||||
| 151 | Y | 46.1 | Very low | 41.2 | Very low | 209 Ų | 209 | 145.9 Ų | 145.9 | 82% | 0.82 | 78% | 0.779 | S | S | * | * | trans | -95.4 | 119.7 | 171 | -89.6 | -80 | 0 | 0 | 0 | 110.7 | A149 S153 | A149-Y151 PolarHBondContact O-N 2.85Å; Y151-S153 PolarHBondContact O-N 3.48Å | ||
| 152 | P | 47.7 | Very low | 42 | Very low | 74 Ų | 74 | 144.9 Ų | 144.9 | 48% | 0.481 | 78% | 0.781 | S | S | . | * | trans | -68.5 | 117.5 | 172.9 | -17.5 | 31.4 | 0 | 0 | 0 | 110.9 | F154 | P152-F154 HydrophobicContact CB-CE2 3.98Å; P152-F154 HydrophobicContact CB-CZ 4.04Å; P152-F154 PolarHBondContact O-N 3.29Å; P152-F154 VanDerWaalsContact O-N 3.16Å | ||
| 153 | S | 37 | Very low | 42.4 | Very low | 121 Ų | 121 | 142.3 Ų | 142.3 | 85% | 0.846 | 78% | 0.775 | S | S | * | * | trans | -73.3 | 100.3 | 169.4 | -60.4 | 0 | 0 | 0 | 0 | 110.4 | Y151 A155 | Y151-S153 PolarHBondContact O-N 3.48Å; S153-A155 PolarHBondContact O-N 3.17Å | ||
| 154 | F | 44 | Very low | 42.8 | Very low | 182 Ų | 182 | 145.7 Ų | 145.7 | 80% | 0.798 | 78% | 0.776 | S | S | * | * | trans | -78.1 | 87.7 | 168.3 | -62.3 | -76.2 | 0 | 0 | 0 | 110.3 | P152 S156 | P152-F154 HydrophobicContact CB-CE2 3.98Å; P152-F154 HydrophobicContact CB-CZ 4.04Å; P152-F154 PolarHBondContact O-N 3.29Å; P152-F154 VanDerWaalsContact O-N 3.16Å; F154-S156 PolarHBondContact O-N 3Å | ||
| 155 | A | 45.7 | Very low | 43.8 | Very low | 102 Ų | 102 | 142.9 Ų | 142.9 | 84% | 0.843 | 78% | 0.778 | S | S | * | * | trans | -69.3 | 94.6 | 162.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | S153 | S153-A155 PolarHBondContact O-N 3.17Š| ||
| 156 | S | 33.9 | Very low | 44 | Very low | 93 Ų | 93 | 142 Ų | 142 | 65% | 0.65 | 77% | 0.768 | S | S | * | * | trans | -102.6 | 96.1 | 173.6 | -166.7 | 0 | 0 | 0 | 0 | 110.3 | F154 Y158 | F154-S156 PolarHBondContact O-N 3Å; S156-Y158 PolarHBondContact O-N 3.14Å; S156-Y158 VanDerWaalsContact O-N 3.17Å | ||
| 157 | S | 41.1 | Very low | 44.9 | Very low | 109 Ų | 109 | 140.5 Ų | 140.5 | 76% | 0.762 | 77% | 0.773 | S | S | * | * | trans | -73.5 | 96.6 | 171 | 51.9 | 0 | 0 | 0 | 0 | 110 | Q159 | S157-Q159 PolarHBondContact O-N 3.47Å; S157-Q159 VanDerWaalsContact O-N 3.09Å | ||
| 158 | Y | 40.1 | Very low | 45 | Very low | 219 Ų | 219 | 136 Ų | 136 | 86% | 0.859 | 76% | 0.762 | S | S | * | * | trans | -65.1 | 107.9 | 171 | -97.7 | -92.9 | 0 | 0 | 0 | 110.5 | S156 | S156-Y158 PolarHBondContact O-N 3.14Å; S156-Y158 VanDerWaalsContact O-N 3.17Å | ||
| 159 | Q | 48.2 | Very low | 45.7 | Very low | 169 Ų | 169 | 134 Ų | 134 | 79% | 0.79 | 77% | 0.765 | S | S | * | * | trans | -69.1 | 124.2 | 162.3 | -75.1 | -99.5 | -23.7 | 0 | 0 | 108.6 | S157 | S157-Q159 PolarHBondContact O-N 3.47Å; S157-Q159 VanDerWaalsContact O-N 3.09Å | ||
| 160 | A | 49.2 | Very low | 46.1 | Very low | 92 Ų | 92 | 136.4 Ų | 136.4 | 76% | 0.76 | 77% | 0.771 | S | S | * | * | trans | -76.8 | 121 | 168 | 0 | 0 | 0 | 0 | 0 | 108.8 | P162 | A160-P162 WeakPolarHBondContact O-CD 3.37Š| ||
| 161 | V | 46.9 | Very low | 46.6 | Very low | 133 Ų | 133 | 133.6 Ų | 133.6 | 81% | 0.806 | 77% | 0.771 | S | S | * | * | trans | -98 | 112.7 | 174.4 | 179 | 0 | 0 | 0 | 0 | 109 | ||||
| 162 | P | 54.1 | Low | 46.1 | Very low | 124 Ų | 124 | 126.9 Ų | 126.9 | 81% | 0.805 | 77% | 0.765 | S | S | * | * | trans | -88.3 | 132.8 | 173.4 | -1.3 | 21.5 | 0 | 0 | 0 | 110.9 | A160 | A160-P162 WeakPolarHBondContact O-CD 3.37Š| ||
| 163 | G | 42.2 | Very low | 45.6 | Very low | 75 Ų | 75 | 131.7 Ų | 131.7 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | trans | 106.1 | 109.2 | 160.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 164 | Y | 45.1 | Very low | 45.4 | Very low | 194 Ų | 194 | 131.3 Ų | 131.3 | 76% | 0.761 | 78% | 0.783 | S | S | * | * | -162.3 | 91.9 | 112.1 | -159.2 | -94.9 | 0 | 0 | 0 | 109.7 | D166 | Y164-D166 VanDerWaalsContact CE1-O 3.23Å; Y164-D166 WeakPolarHBondContact CE1-O 3.45Å | |||
| 165 | L | 53.6 | Low | 44.9 | Very low | 185 Ų | 185 | 127 Ų | 127 | 97% | 0.969 | 78% | 0.781 | S | S | * | * | trans | -121.4 | 82.3 | 162.2 | -79 | 179.1 | 0 | 0 | 0 | 107.5 | ||||
| 166 | D | 50.4 | Low | 44.4 | Very low | 89 Ų | 89 | 130.9 Ų | 130.9 | 48% | 0.476 | 78% | 0.781 | S | S | . | * | trans | -143.4 | 114.6 | 163.2 | -171.6 | 1.2 | 0 | 0 | 0 | 108.7 | Y164 S168 | Y164-D166 VanDerWaalsContact CE1-O 3.23Å; Y164-D166 WeakPolarHBondContact CE1-O 3.45Å; D166-S168 PolarHBondContact OD1-OG 2.91Å | ||
| 167 | V | 57.8 | Low | 44.8 | Very low | 151 Ų | 151 | 131 Ų | 131 | 92% | 0.915 | 78% | 0.779 | S | S | * | * | trans | -133.9 | 119.2 | 162 | -172.5 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 168 | S | 46.3 | Very low | 44.5 | Very low | 93 Ų | 93 | 133.9 Ų | 133.9 | 65% | 0.65 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 163.7 | -145 | -45.2 | 0 | 0 | 0 | 0 | 115.8 | D166 | D166-S168 PolarHBondContact OD1-OG 2.91Š|
| 169 | V | 50.1 | Low | 44.7 | Very low | 141 Ų | 141 | 128 Ų | 128 | 86% | 0.855 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 142.2 | 174.6 | 167.3 | 0 | 0 | 0 | 0 | 112.5 | ||
| 170 | V | 50.9 | Low | 44.6 | Very low | 129 Ų | 129 | 129.7 Ų | 129.7 | 78% | 0.782 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 144.1 | 178.8 | 178.8 | 0 | 0 | 0 | 0 | 112.3 | ||
| 171 | P | 48.3 | Very low | 44.2 | Very low | 122 Ų | 122 | 134 Ų | 134 | 79% | 0.792 | 77% | 0.772 | S | S | * | * | trans | -151.3 | 136.6 | 132.8 | 31.1 | -11.1 | 0 | 0 | 0 | 118 | ||||
| 172 | G | 36.3 | Very low | 44.1 | Very low | 68 Ų | 68 | 134.3 Ų | 134.3 | 70% | 0.701 | 77% | 0.77 | S | S | * | * | trans | 85.9 | 147.5 | 152.7 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 173 | I | 37.1 | Very low | 43.5 | Very low | 174 Ų | 174 | 132.7 Ų | 132.7 | 89% | 0.892 | 77% | 0.767 | S | S | * | * | cis | -157.5 | 159.8 | 4.9 | 41 | 166.6 | 0 | 0 | 0 | 111.5 | ||||
| 174 | S | 31.9 | Very low | 44.1 | Very low | 114 Ų | 114 | 136.6 Ų | 136.6 | 80% | 0.797 | 77% | 0.769 | S | S | * | * | trans | 122.4 | 95 | 149.8 | -155.4 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 175 | A | 33.3 | Very low | 44.2 | Very low | 92 Ų | 92 | 134.6 Ų | 134.6 | 76% | 0.76 | 77% | 0.77 | S | S | * | * | trans | 39.2 | 110.3 | 136.5 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 176 | H | 36.3 | Very low | 44 | Very low | 182 Ų | 182 | 130.3 Ų | 130.3 | 84% | 0.843 | 75% | 0.753 | S | S | * | * | -160.8 | 142.8 | 116.1 | -146.9 | -93.9 | 0 | 0 | 0 | 111.7 | |||||
| 177 | P | 41.3 | Very low | 43.9 | Very low | 95 Ų | 95 | 134.9 Ų | 134.9 | 62% | 0.617 | 77% | 0.774 | S | S | * | * | trans | -84.8 | 147 | 175.3 | 33.2 | -36.5 | 0 | 0 | 0 | 113.8 | ||||
| 178 | E | 35 | Very low | 43.2 | Very low | 170 Ų | 170 | 135.9 Ų | 135.9 | 79% | 0.794 | 77% | 0.769 | S | S | * | * | trans | 47.9 | 161.6 | 134.2 | -164.8 | 160.5 | -164.6 | 0 | 0 | 120.5 | ||||
| 179 | P | 44.5 | Very low | 43.3 | Very low | 95 Ų | 95 | 134.2 Ų | 134.2 | 62% | 0.617 | 77% | 0.766 | S | S | * | * | cis | -118.1 | -176.8 | -18 | 19.9 | 4.3 | 0 | 0 | 0 | 115.2 | ||||
| 180 | R | 45.3 | Very low | 42.8 | Very low | 206 Ų | 206 | 137.8 Ų | 137.8 | 78% | 0.777 | 77% | 0.766 | S | S | * | * | trans | -34.2 | 137.1 | 166.1 | -60.7 | 171.6 | 175.3 | 78.4 | 4 | 116 | ||||
| 181 | H | 41 | Very low | 42.4 | Very low | 181 Ų | 181 | 140.2 Ų | 140.2 | 84% | 0.838 | 77% | 0.769 | S | S | * | * | trans | -125.7 | 107.7 | 147.4 | -81.9 | -74.3 | 0 | 0 | 0 | 110.2 | A183 | H181-A183 PolarHBondContact O-N 3.42Š| ||
| 182 | D | 44.9 | Very low | 41.9 | Very low | 141 Ų | 141 | 139.9 Ų | 139.9 | 75% | 0.754 | 76% | 0.757 | S | S | * | * | trans | -64.1 | 120.4 | 163.7 | -83.9 | -81.8 | 0 | 0 | 0 | 109.8 | ||||
| 183 | A | 42.8 | Very low | 42.7 | Very low | 90 Ų | 90 | 145.6 Ų | 145.6 | 74% | 0.744 | 76% | 0.757 | S | S | * | * | trans | -122.1 | 87.6 | 167 | 0 | 0 | 0 | 0 | 0 | 108.5 | H181 I185 | H181-A183 PolarHBondContact O-N 3.42Å; A183-I185 PolarHBondContact O-N 3.49Å; A183-I185 VanDerWaalsContact O-N 3.11Å | ||
| 184 | L | 53.4 | Low | 43.3 | Very low | 157 Ų | 157 | 141.2 Ų | 141.2 | 82% | 0.822 | 75% | 0.746 | S | S | * | * | trans | -61.5 | 108.4 | 173.3 | -70.9 | 165.1 | 0 | 0 | 0 | 110 | ||||
| 185 | I | 47.8 | Very low | 44.1 | Very low | 152 Ų | 152 | 142.9 Ų | 142.9 | 78% | 0.779 | 75% | 0.746 | S | S | * | * | trans | -105.4 | 115.6 | 157.2 | -60.2 | -61.7 | 0 | 0 | 0 | 107.3 | A183 M187 | A183-I185 PolarHBondContact O-N 3.49Å; A183-I185 VanDerWaalsContact O-N 3.11Å; I185-M187 PolarHBondContact O-N 3.24Å | ||
| 186 | P | 49.4 | Very low | 44.7 | Very low | 95 Ų | 95 | 143.5 Ų | 143.5 | 62% | 0.617 | 74% | 0.744 | S | S | * | * | trans | -59 | 133 | 174.1 | -24.9 | 35.1 | 0 | 0 | 0 | 111.9 | E188 | P186-E188 VanDerWaalsContact C-N 3.26Å; P186-E188 PolarHBondContact O-N 3.03Å | ||
| 187 | M | 48.7 | Very low | 45.1 | Very low | 185 Ų | 185 | 141.7 Ų | 141.7 | 91% | 0.911 | 74% | 0.741 | S | S | * | * | trans | -77.7 | 75.6 | 176.4 | -173.4 | 78.5 | 77.2 | 0 | 0 | 110.1 | I185 G189 | I185-M187 PolarHBondContact O-N 3.24Å; M187-G189 PolarHBondContact O-N 2.65Å | ||
| 188 | E | 43.1 | Very low | 44.7 | Very low | 172 Ų | 172 | 140.9 Ų | 140.9 | 80% | 0.804 | 75% | 0.75 | S | S | * | * | trans | -73.2 | 109 | -176.8 | -148.1 | 68.6 | -130.7 | 0 | 0 | 111.7 | P186 | P186-E188 VanDerWaalsContact C-N 3.26Å; P186-E188 PolarHBondContact O-N 3.03Å | ||
| 189 | G | 48.1 | Very low | 45.4 | Very low | 58 Ų | 58 | 144.2 Ų | 144.2 | 60% | 0.598 | 76% | 0.756 | S | S | * | * | trans | 75.1 | 35.7 | 145 | 0 | 0 | 0 | 0 | 0 | 119.8 | M187 Q191 | M187-G189 PolarHBondContact O-N 2.65Å; G189-Q191 VanDerWaalsContact C-N 3.27Å; G189-Q191 PolarHBondContact O-N 3.31Å | ||
| 190 | Y | 38.8 | Very low | 45.4 | Very low | 215 Ų | 215 | 147.7 Ų | 147.7 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | trans | -72.6 | 83.8 | 163.7 | -153.5 | -91.1 | 0 | 0 | 0 | 110.9 | H192 | Y190-H192 VanDerWaalsContact C-N 3.29Å; Y190-H192 PolarHBondContact O-N 2.89Å | ||
| 191 | Q | 43 | Very low | 44.8 | Very low | 180 Ų | 180 | 141 Ų | 141 | 84% | 0.841 | 76% | 0.764 | S | S | * | * | trans | -64.7 | 85.9 | 173.6 | -80.7 | -77.6 | -59.9 | 0 | 0 | 110.5 | G189 | G189-Q191 VanDerWaalsContact C-N 3.27Å; G189-Q191 PolarHBondContact O-N 3.31Å | ||
| 192 | H | 38.2 | Very low | 44.6 | Very low | 116 Ų | 116 | 141.4 Ų | 141.4 | 54% | 0.537 | 77% | 0.766 | S | S | . | * | trans | -58.7 | 138.1 | 167.3 | -161.9 | -98 | 0 | 0 | 0 | 108.8 | Y190 A194 | Y190-H192 VanDerWaalsContact C-N 3.29Å; Y190-H192 PolarHBondContact O-N 2.89Å; H192-A194 PolarHBondContact O-N 3.38Å | ||
| 193 | W | 51.9 | Low | 45 | Very low | 188 Ų | 188 | 141.9 Ų | 141.9 | 71% | 0.712 | 77% | 0.774 | S | S | * | * | trans | -65.6 | 73.8 | -172.8 | 44.9 | -82 | 0 | 0 | 0 | 111.7 | L195 | W193-L195 HydrophobicContact CE3-CD1 4.21Å; W193-L195 HydrophobicContact CE3-CG 4.19Å; W193-L195 HydrophobicContact CZ3-CD1 3.88Å; W193-L195 HydrophobicContact CZ3-CG 4.33Å; W193-L195 PolarHBondContact O-N 3.44Å | ||
| 194 | A | 51.4 | Low | 44.7 | Very low | 81 Ų | 81 | 147 Ų | 147 | 67% | 0.669 | 78% | 0.775 | S | S | * | * | trans | -64.3 | 99.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | H192 S196 | H192-A194 PolarHBondContact O-N 3.38Å; A194-S196 PolarHBondContact O-N 2.75Å; A194-S196 PolarHBondContact O-OG 3.09Å | ||
| 195 | L | 48.6 | Very low | 44.2 | Very low | 149 Ų | 149 | 146 Ų | 146 | 78% | 0.78 | 78% | 0.78 | S | S | * | * | trans | -65.4 | 88.4 | 161.5 | -73 | 171.1 | 0 | 0 | 0 | 107.6 | W193 N197 | W193-L195 HydrophobicContact CE3-CD1 4.21Å; W193-L195 HydrophobicContact CE3-CG 4.19Å; W193-L195 HydrophobicContact CZ3-CD1 3.88Å; W193-L195 HydrophobicContact CZ3-CG 4.33Å; W193-L195 PolarHBondContact O-N 3.44Å; L195-N197 PolarHBondContact O-N 2.58Å | ||
| 196 | S | 44.9 | Very low | 43.6 | Very low | 105 Ų | 105 | 143.6 Ų | 143.6 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | trans | -65.2 | 85.7 | 174.4 | -44.5 | 0 | 0 | 0 | 0 | 109.9 | A194 | A194-S196 PolarHBondContact O-N 2.75Å; A194-S196 PolarHBondContact O-OG 3.09Å | ||
| 197 | N | 44.5 | Very low | 43.2 | Very low | 144 Ų | 144 | 147.5 Ų | 147.5 | 77% | 0.77 | 78% | 0.784 | S | S | * | * | trans | -167.7 | 74.7 | 157.3 | -85.5 | -40.3 | 0 | 0 | 0 | 106.7 | L195 W199 | L195-N197 PolarHBondContact O-N 2.58Å; N197-W199 PolarHBondContact O-NE1 3.44Å | ||
| 198 | G | 34.3 | Very low | 42.9 | Very low | 79 Ų | 79 | 146 Ų | 146 | 81% | 0.814 | 78% | 0.775 | S | S | * | * | trans | -90.4 | 126.5 | 161 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 199 | W | 48.3 | Very low | 42.5 | Very low | 240 Ų | 240 | 146.9 Ų | 146.9 | 91% | 0.909 | 78% | 0.779 | S | S | * | * | trans | -117.6 | 71 | -169.5 | 26.3 | -68.1 | 0 | 0 | 0 | 109.1 | N197 | N197-W199 PolarHBondContact O-NE1 3.44Š| ||
| 200 | D | 43.9 | Very low | 42.1 | Very low | 168 Ų | 168 | 149.6 Ų | 149.6 | 90% | 0.898 | 78% | 0.784 | S | S | * | * | trans | -176.5 | 148.8 | 146.7 | -167.6 | 23.4 | 0 | 0 | 0 | 108.4 | ||||
| 201 | G | 34.8 | Very low | 42.5 | Very low | 65 Ų | 65 | 147.9 Ų | 147.9 | 67% | 0.67 | 78% | 0.784 | S | S | * | * | trans | 152 | 70.6 | -178.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 202 | Q | 35.5 | Very low | 42.2 | Very low | 189 Ų | 189 | 144.9 Ų | 144.9 | 88% | 0.883 | 78% | 0.782 | S | S | * | * | trans | 40.5 | 120.2 | 157.9 | -75.1 | 179.6 | -107.6 | 0 | 0 | 120.7 | Y204 | Q202-Y204 PolarHBondContact O-N 2.73Š| ||
| 203 | V | 53 | Low | 42.4 | Very low | 151 Ų | 151 | 144.9 Ų | 144.9 | 92% | 0.915 | 79% | 0.791 | S | S | * | * | trans | -67.6 | 116.5 | 160.5 | -71 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 204 | Y | 37.3 | Very low | 42.2 | Very low | 198 Ų | 198 | 142.3 Ų | 142.3 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | trans | -144.8 | 105.5 | 158.5 | -170.1 | -99.4 | 0 | 0 | 0 | 109.8 | Q202 S206 | Q202-Y204 PolarHBondContact O-N 2.73Å; Y204-S206 WeakPolarHBondContact CE1-OG 3.48Å; Y204-S206 PolarHBondContact O-N 3.37Å | ||
| 205 | C | 43.3 | Very low | 42.2 | Very low | 136 Ų | 136 | 147.1 Ų | 147.1 | 92% | 0.919 | 80% | 0.8 | S | S | * | * | trans | -77.9 | 100.4 | 174.5 | -82.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 206 | S | 35.2 | Very low | 42.2 | Very low | 102 Ų | 102 | 150.9 Ų | 150.9 | 71% | 0.713 | 80% | 0.804 | S | S | * | * | trans | -85 | 138.2 | 155.6 | -90 | 0 | 0 | 0 | 0 | 110.6 | Y204 | Y204-S206 WeakPolarHBondContact CE1-OG 3.48Å; Y204-S206 PolarHBondContact O-N 3.37Å | ||
| 207 | K | 40.5 | Very low | 41.9 | Very low | 176 Ų | 176 | 153.4 Ų | 153.4 | 77% | 0.765 | 80% | 0.802 | S | S | * | * | trans | -90.1 | 146.1 | -167.8 | 177.4 | 176.5 | 175.7 | 179.8 | 0 | 112.1 | ||||
| 208 | E | 42.6 | Very low | 42.2 | Very low | 155 Ų | 155 | 150.6 Ų | 150.6 | 72% | 0.724 | 79% | 0.794 | S | S | * | * | trans | 34 | 107.1 | 169.9 | -87.9 | 80.4 | -108.5 | 0 | 0 | 119.5 | ||||
| 209 | Q | 34 | Very low | 43.2 | Very low | 190 Ų | 190 | 152.5 Ų | 152.5 | 89% | 0.888 | 79% | 0.792 | S | S | * | * | trans | -153.7 | 107.5 | 138.4 | -144.9 | 165.4 | 22.5 | 0 | 0 | 115 | ||||
| 210 | T | 41.1 | Very low | 43 | Very low | 114 Ų | 114 | 149.8 Ų | 149.8 | 70% | 0.699 | 79% | 0.787 | S | S | * | * | trans | 23.5 | 126.4 | 139.8 | -49.2 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 211 | Q | 45.3 | Very low | 43.5 | Very low | 180 Ų | 180 | 147.9 Ų | 147.9 | 84% | 0.841 | 78% | 0.783 | S | S | * | * | trans | 66.2 | 104.6 | 156.5 | -73.2 | 177.4 | 60.1 | 0 | 0 | 120 | ||||
| 212 | S | 37.4 | Very low | 44.2 | Very low | 116 Ų | 116 | 151.4 Ų | 151.4 | 81% | 0.811 | 79% | 0.787 | S | S | * | * | -179.1 | 91.6 | 116.9 | 43.6 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 213 | T | 42.5 | Very low | 44.7 | Very low | 117 Ų | 117 | 149.1 Ų | 149.1 | 72% | 0.718 | 79% | 0.785 | S | S | * | * | trans | -111.9 | 161.2 | 158.2 | 59.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 214 | H | 48.5 | Very low | 44.9 | Very low | 134 Ų | 134 | 147 Ų | 147 | 62% | 0.62 | 77% | 0.773 | S | S | * | * | trans | 102.8 | 5.1 | 173.3 | -45 | -38.9 | 0 | 0 | 0 | 120.4 | W216 | H214-W216 PolarHBondContact O-N 2.98Š| ||
| 215 | L | 50.3 | Low | 46 | Very low | 182 Ų | 182 | 142.5 Ų | 142.5 | 95% | 0.953 | 77% | 0.767 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.9 | 20.7 | 175.9 | -69.9 | -178.7 | 0 | 0 | 0 | 116.8 | ||
| 216 | W | 49 | Very low | 46.4 | Very low | 228 Ų | 228 | 144 Ų | 144 | 86% | 0.864 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.7 | 6 | 174.1 | 65.3 | -95.6 | 0 | 0 | 0 | 116 | H214 S218 | H214-W216 PolarHBondContact O-N 2.98Å; W216-S218 PolarHBondContact O-N 2.84Å |
| 217 | K | 39.6 | Very low | 46.5 | Very low | 157 Ų | 157 | 147 Ų | 147 | 68% | 0.683 | 77% | 0.768 | S | S | * | * | trans | -80.8 | 103.2 | 174.8 | -82.7 | -172 | 169.2 | -172.4 | 0 | 111.1 | ||||
| 218 | S | 50.1 | Low | 47.1 | Very low | 86 Ų | 86 | 144.7 Ų | 144.7 | 60% | 0.601 | 77% | 0.771 | S | S | * | * | trans | -59.9 | 132.9 | 166 | 168.3 | 0 | 0 | 0 | 0 | 110.6 | W216 F220 | W216-S218 PolarHBondContact O-N 2.84Å; S218-F220 PolarHBondContact O-N 3.34Å | ||
| 219 | P | 54.6 | Low | 47.4 | Very low | 119 Ų | 119 | 144.1 Ų | 144.1 | 77% | 0.773 | 77% | 0.769 | S | S | * | * | trans | -88.4 | 99.8 | 176.8 | 32.9 | -31.7 | 0 | 0 | 0 | 111 | ||||
| 220 | F | 44.4 | Very low | 48.5 | Very low | 183 Ų | 183 | 139 Ų | 139 | 80% | 0.803 | 75% | 0.75 | S | S | * | * | trans | -134.9 | 132.4 | 155.6 | -72.7 | -73.6 | 0 | 0 | 0 | 108.1 | S218 | S218-F220 PolarHBondContact O-N 3.34Š| ||
| 221 | P | 54.7 | Low | 49 | Very low | 127 Ų | 127 | 138.9 Ų | 138.9 | 83% | 0.825 | 75% | 0.754 | S | S | * | * | trans | -73.2 | 155.2 | -176.5 | 30.3 | -34.5 | 0 | 0 | 0 | 112.1 | ||||
| 222 | D | 50 | Low | 49.6 | Very low | 139 Ų | 139 | 134 Ų | 134 | 74% | 0.743 | 74% | 0.74 | S | S | * | * | trans | -75.1 | 125 | -173 | -173.5 | 20.9 | 0 | 0 | 0 | 112.7 | V224 | D222-V224 WeakPolarHBondContact OD1-CG2 3.34Š| ||
| 223 | V | 46 | Very low | 50.2 | Low | 141 Ų | 141 | 138 Ų | 138 | 86% | 0.855 | 74% | 0.739 | S | S | * | * | trans | -142.3 | 108 | 160.2 | -176 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 224 | V | 56.7 | Low | 51 | Low | 108 Ų | 108 | 143 Ų | 143 | 66% | 0.655 | 74% | 0.744 | S | S | * | * | trans | -80.5 | 160.2 | 173.1 | 169.8 | 0 | 0 | 0 | 0 | 109.2 | D222 | D222-V224 WeakPolarHBondContact OD1-CG2 3.34Š| ||
| 225 | P | 60.8 | Low | 51.3 | Low | 102 Ų | 102 | 147 Ų | 147 | 66% | 0.662 | 75% | 0.754 | S | S | * | * | cis | -133.6 | 169.4 | 13 | 12.9 | 15.1 | 0 | 0 | 0 | 119 | ||||
| 226 | L | 50.5 | Low | 52.1 | Low | 167 Ų | 167 | 142.7 Ų | 142.7 | 87% | 0.874 | 75% | 0.753 | S | S | * | * | trans | 57.6 | 96 | 144.3 | -64 | 165.6 | 0 | 0 | 0 | 120.6 | ||||
| 227 | Q | 38.2 | Very low | 53.6 | Low | 166 Ų | 166 | 142.7 Ų | 142.7 | 78% | 0.776 | 75% | 0.753 | S | S | * | * | trans | -148.5 | 119 | 149.3 | -102.9 | -63 | -10.4 | 0 | 0 | 111.4 | E229 | Q227-E229 PolarHBondContact O-N 3.24Š| ||
| 228 | P | 53.4 | Low | 55.8 | Low | 128 Ų | 128 | 145.1 Ų | 145.1 | 83% | 0.831 | 76% | 0.764 | S | S | * | * | trans | -88.4 | 63.5 | 177.5 | 36.3 | -35.7 | 0 | 0 | 0 | 112.4 | ||||
| 229 | E | 48.8 | Very low | 57.6 | Low | 143 Ų | 143 | 150.2 Ų | 150.2 | 67% | 0.668 | 78% | 0.775 | S | S | * | * | trans | -129.7 | 118.7 | 175.9 | -117.8 | -79.1 | 102.3 | 0 | 0 | 112.5 | Q227 S231 | Q227-E229 PolarHBondContact O-N 3.24Å; E229-S231 PolarHBondContact O-N 3.39Å | ||
| 230 | V | 57.5 | Low | 59.4 | Low | 81 Ų | 81 | 156.1 Ų | 156.1 | 49% | 0.491 | 78% | 0.782 | S | S | . | * | trans | 17.2 | 79.9 | 163.3 | -62.8 | 0 | 0 | 0 | 0 | 119.6 | S232 | V230-S232 PolarHBondContact O-N 2.87Š| ||
| 231 | S | 51 | Low | 61.7 | Low | 112 Ų | 112 | 153.2 Ų | 153.2 | 78% | 0.783 | 78% | 0.779 | S | S | * | * | trans | -69.6 | 69.1 | 155.4 | -162.7 | 0 | 0 | 0 | 0 | 111.4 | E229 | E229-S231 PolarHBondContact O-N 3.39Š| ||
| 232 | S | 58.6 | Low | 63.7 | Low | 78 Ų | 78 | 152.5 Ų | 152.5 | 55% | 0.545 | 78% | 0.775 | S | S | . | * | trans | -94.9 | -5.2 | 179.4 | 58.1 | 0 | 0 | 0 | 0 | 112.9 | V230 R234 | V230-S232 PolarHBondContact O-N 2.87Å; S232-R234 VanDerWaalsContact C-N 3.26Å; S232-R234 PolarHBondContact O-N 3.22Å | ||
| 233 | Y | 49.9 | Very low | 66 | Low | 201 Ų | 201 | 149.4 Ų | 149.4 | 79% | 0.788 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.6 | 1 | -174.5 | -58.8 | -75.4 | 0 | 0 | 0 | 115.8 | ||
| 234 | R | 57.5 | Low | 68.4 | Low | 222 Ų | 222 | 146.3 Ų | 146.3 | 84% | 0.838 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.5 | 8.3 | -179.3 | -69.9 | -58.6 | -136.8 | -110.3 | 4.9 | 115.7 | S232 | S232-R234 VanDerWaalsContact C-N 3.26Å; S232-R234 PolarHBondContact O-N 3.22Å |
| 235 | R | 56.7 | Low | 70.4 | Confident | 216 Ų | 216 | 150.1 Ų | 150.1 | 82% | 0.815 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -161.6 | 108 | 161.3 | -133.2 | 167.4 | -74.1 | -119.4 | 2.2 | 111.3 | R237 | R235-R237 PolarHBondContact O-N 3.03Š|
| 236 | G | 66.3 | Low | 72.1 | Confident | 92 Ų | 92 | 151.6 Ų | 151.6 | 95% | 0.948 | 74% | 0.743 | S | S | * | * | trans | -68.8 | 43.3 | -169.7 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 237 | R | 80.1 | Confident | 74.4 | Confident | 228 Ų | 228 | 145.1 Ų | 145.1 | 86% | 0.86 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -113.7 | 127.9 | 166.7 | -59.1 | -166 | -152.5 | -133.2 | 8.4 | 109.5 | R235 K239 | R235-R237 PolarHBondContact O-N 3.03Å; R237-K239 PolarHBondContact O-N 2.87Å |
| 238 | K | 85.6 | Confident | 77.2 | Confident | 209 Ų | 209 | 139.9 Ų | 139.9 | 91% | 0.909 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 124.4 | 175.4 | -171 | 157.5 | -176.1 | 162.9 | 0 | 110.3 | R240 | K238-R240 PolarHBondContact O-N 3.18Š|
| 239 | K | 88.5 | Confident | 79.4 | Confident | 192 Ų | 192 | 140.8 Ų | 140.8 | 84% | 0.835 | 68% | 0.676 | S | S | * | * | P | Polyproline II helix | trans | -53 | 133.2 | 179.1 | -172.2 | 179.2 | -179.3 | -179.6 | 0 | 109.5 | R237 V241 | R237-K239 PolarHBondContact O-N 2.87Å; K239-V241 PolarHBondContact O-N 2.69Å |
| 240 | R | 92.1 | Very high | 81.7 | Confident | 243 Ų | 243 | 136.7 Ų | 136.7 | 92% | 0.917 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 125 | 177.3 | -65 | -177.6 | 115.5 | 133.2 | 2.2 | 109.1 | K238 | K238-R240 PolarHBondContact O-N 3.18Š|
| 241 | V | 93.6 | Very high | 83.6 | Confident | 123 Ų | 123 | 132.9 Ų | 132.9 | 75% | 0.745 | 63% | 0.634 | S | S | * | * | P | Polyproline II helix | trans | -94.6 | 126.5 | 171.9 | -176.8 | 0 | 0 | 0 | 0 | 107.9 | K239 | K239-V241 PolarHBondContact O-N 2.69Š|
| 242 | P | 96 | Very high | 85.9 | Confident | 112 Ų | 112 | 132.1 Ų | 132.1 | 73% | 0.727 | 62% | 0.618 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 149.8 | 174.3 | 30.5 | -34.2 | 0 | 0 | 0 | 110.7 | ||
| 243 | Y | 97.6 | Very high | 87.7 | Confident | 74 Ų | 74 | 134.2 Ų | 134.2 | 29% | 0.29 | 62% | 0.617 | S | S | . | * | P | Polyproline II helix | trans | -71.9 | 143.8 | 173 | -59.5 | -55.6 | 0 | 0 | 0 | 110.9 | L248 L275 W283 | Y243-L248 HydrophobicContact CD2-CD2 4.25Å; Y243-L248 HydrophobicContact CG-CD2 4.5Å; Y243-L275 HydrophobicContact CD1-CD1 3.9Å; Y243-L275 HydrophobicContact CD1-CD2 3.82Å; Y243-L275 HydrophobicContact CE1-CD1 3.87Å; Y243-L275 HydrophobicContact CE1-CD2 3.69Å; Y243-L275 HydrophobicContact CE1-CG 4.45Å; Y243-W283 AromaticContact CD2-CD1 3.87Å; Y243-W283 AromaticContact CE2-CD1 3.69Å |
| 244 | T | 98.1 | Very high | 90 | Very high | 75 Ų | 75 | 126.2 Ų | 126.2 | 46% | 0.46 | 59% | 0.587 | S | S | . | * | P | Polyproline II helix | trans | -72.6 | 160.1 | 177.8 | 75.9 | 0 | 0 | 0 | 0 | 111.3 | I246 Q247 L248 | T244-I246 PolarHBondContact O-N 3.42Å; T244-Q247 PolarHBondContact O-N 3.44Å; T244-Q247 WeakPolarHBondContact OG1-CG 3.48Å; T244-Q247 PolarHBondContact OG1-N 3.46Å; T244-L248 WeakPolarHBondContact O-CG 3.5Å; T244-L248 PolarHBondContact O-N 3.03Å |
| 245 | K | 97.7 | Very high | 91.9 | Very high | 189 Ų | 189 | 115.8 Ų | 115.8 | 82% | 0.822 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -55.5 | -37.7 | 176.5 | -66.9 | -175.3 | 178.7 | -178.8 | 0 | 112.4 | L248 K249 | K245-L248 PolarHBondContact O-N 3.36Å; K245-K249 WeakPolarHBondContact O-CB 3.22Å; K245-K249 PolarHBondContact O-N 3.05Å |
| 246 | I | 97 | Very high | 93.8 | Very high | 132 Ų | 132 | 109.4 Ų | 109.4 | 68% | 0.677 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -68.6 | -44.6 | 179.4 | -57.2 | 174.7 | 0 | 0 | 0 | 110.7 | T244 L248 K249 E250 | T244-I246 PolarHBondContact O-N 3.42Å; I246-L248 VanDerWaalsContact C-N 3.33Å; I246-L248 PolarHBondContact O-N 3.49Å; I246-K249 PolarHBondContact O-N 2.92Å; I246-E250 PolarHBondContact O-N 3.37Å |
| 247 | Q | 98 | Very high | 95.3 | Very high | 31 Ų | 31 | 108.5 Ų | 108.5 | 15% | 0.145 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -59.6 | -44.5 | 175.6 | -70.5 | 174.2 | -29.6 | 0 | 0 | 111.5 | T244 L251 T273 L275 | T244-Q247 PolarHBondContact O-N 3.44Å; T244-Q247 WeakPolarHBondContact OG1-CG 3.48Å; T244-Q247 PolarHBondContact OG1-N 3.46Å; Q247-L251 WeakPolarHBondContact O-CB 3.27Å; Q247-L251 VanDerWaalsContact O-CD1 3.31Å; Q247-L251 WeakPolarHBondContact O-CD1 3.34Å; Q247-L251 WeakPolarHBondContact O-CG 3.47Å; Q247-L251 PolarHBondContact O-N 2.88Å; Q247-L251 VanDerWaalsContact O-N 3.14Å; Q247-T273 WeakPolarHBondContact CG-O 3.38Å; Q247-T273 PolarHBondContact NE2-O 3.31Å; Q247-L275 HydrophobicContact CB-CD1 4.39Å; Q247-L275 HydrophobicContact CG-CD1 4.49Å |
| 248 | L | 97.9 | Very high | 96.1 | Very high | 57 Ų | 57 | 99.8 Ų | 99.8 | 30% | 0.298 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.1 | -43.1 | 177 | -67.2 | 174.9 | 0 | 0 | 0 | 112 | Y243 T244 K245 I246 E250 L251 E252 | Y243-L248 HydrophobicContact CD2-CD2 4.25Å; Y243-L248 HydrophobicContact CG-CD2 4.5Å; T244-L248 WeakPolarHBondContact O-CG 3.5Å; T244-L248 PolarHBondContact O-N 3.03Å; K245-L248 PolarHBondContact O-N 3.36Å; I246-L248 VanDerWaalsContact C-N 3.33Å; I246-L248 PolarHBondContact O-N 3.49Å; L248-E250 PolarHBondContact O-N 3.23Å; L248-L251 PolarHBondContact O-N 3.41Å; L248-E252 WeakPolarHBondContact O-CB 3.44Å; L248-E252 WeakPolarHBondContact O-CG 3.35Å; L248-E252 PolarHBondContact O-N 2.74Å |
| 249 | K | 98 | Very high | 96.6 | Very high | 147 Ų | 147 | 93.7 Ų | 93.7 | 64% | 0.639 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -56.6 | -49.5 | 178.2 | -177.6 | -178.9 | 176.5 | -177.5 | 0 | 112.5 | K245 I246 E252 K253 | K245-K249 WeakPolarHBondContact O-CB 3.22Å; K245-K249 PolarHBondContact O-N 3.05Å; I246-K249 PolarHBondContact O-N 2.92Å; K249-E252 PolarHBondContact O-N 3.06Å; K249-K253 VanDerWaalsContact O-CB 3.27Å; K249-K253 WeakPolarHBondContact O-CB 3.31Å; K249-K253 PolarHBondContact O-N 2.7Å |
| 250 | E | 97.6 | Very high | 97 | Very high | 57 Ų | 57 | 90.8 Ų | 90.8 | 27% | 0.266 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -69 | -36.8 | 179.4 | -71.5 | -57.8 | 125.2 | 0 | 0 | 112.5 | I246 L248 K253 E254 T273 | I246-E250 PolarHBondContact O-N 3.37Å; L248-E250 PolarHBondContact O-N 3.23Å; E250-K253 IonicContact OE1-NZ 3.27Å; E250-K253 PolarHBondContact OE1-NZ 3.23Å; E250-K253 WeakPolarHBondContact OE2-CD 3.49Å; E250-K253 IonicContact OE2-NZ 2.84Å; E250-K253 PolarHBondContact OE2-NZ 3.18Å; E250-E254 PolarHBondContact O-N 3.41Å; E250-T273 HydrophobicContact CB-CG2 3.91Å |
| 251 | L | 98.2 | Very high | 97.3 | Very high | 0 Ų | 0 | 80.4 Ų | 80.4 | 0% | 0 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -63.8 | -40.5 | 174.2 | -73.1 | 164.6 | 0 | 0 | 0 | 112.3 | Q247 L248 Y255 I269 L275 V280 W283 F284 | Q247-L251 WeakPolarHBondContact O-CB 3.27Å; Q247-L251 VanDerWaalsContact O-CD1 3.31Å; Q247-L251 WeakPolarHBondContact O-CD1 3.34Å; Q247-L251 WeakPolarHBondContact O-CG 3.47Å; Q247-L251 PolarHBondContact O-N 2.88Å; Q247-L251 VanDerWaalsContact O-N 3.14Å; L248-L251 PolarHBondContact O-N 3.41Å; L251-Y255 WeakPolarHBondContact O-CB 3.43Å; L251-Y255 PolarHBondContact O-N 3.01Å; L251-I269 HydrophobicContact CD2-CG2 3.78Å; L251-I269 HydrophobicContact CG-CG2 4.45Å; L251-L275 HydrophobicContact CD1-CD1 3.93Å; L251-V280 HydrophobicContact CD2-CG1 4.09Å; L251-V280 HydrophobicContact CD2-CG2 4.47Å; L251-W283 HydrophobicContact CB-CD2 3.94Å; L251-W283 HydrophobicContact CB-CE3 3.94Å; L251-W283 HydrophobicContact CB-CH2 3.76Å; L251-W283 HydrophobicContact CB-CZ2 3.73Å; L251-W283 HydrophobicContact CB-CZ3 3.86Å; L251-W283 HydrophobicContact CD1-CD2 3.94Å; L251-W283 HydrophobicContact CD1-CG 3.85Å; L251-W283 HydrophobicContact CD2-CD2 4.19Å; L251-W283 HydrophobicContact CD2-CE3 4.11Å; L251-W283 HydrophobicContact CD2-CG 4.4Å; L251-W283 HydrophobicContact CG-CD2 4.26Å; L251-W283 HydrophobicContact CG-CE3 4.46Å; L251-W283 WeakPolarHBondContact O-CZ3 3.36Å; L251-F284 HydrophobicContact CD2-CE2 4.14Å |
| 252 | E | 98 | Very high | 97.5 | Very high | 97 Ų | 97 | 78.5 Ų | 78.5 | 45% | 0.453 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -73.7 | -38.2 | 179.3 | -72.8 | -178 | 160 | 0 | 0 | 112.7 | L248 K249 Y255 A256 W283 | L248-E252 WeakPolarHBondContact O-CB 3.44Å; L248-E252 WeakPolarHBondContact O-CG 3.35Å; L248-E252 PolarHBondContact O-N 2.74Å; K249-E252 PolarHBondContact O-N 3.06Å; E252-Y255 PolarHBondContact O-N 3.17Å; E252-A256 PolarHBondContact O-N 2.75Å; E252-W283 HydrophobicContact CG-CH2 3.68Å; E252-W283 HydrophobicContact CG-CZ2 3.7Å |
| 253 | K | 97.7 | Very high | 97.6 | Very high | 122 Ų | 122 | 80.3 Ų | 80.3 | 53% | 0.53 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -56.1 | -49.4 | 172 | 174.7 | -171.9 | 170.9 | -167 | 0 | 112 | K249 E250 A256 A257 | K249-K253 VanDerWaalsContact O-CB 3.27Å; K249-K253 WeakPolarHBondContact O-CB 3.31Å; K249-K253 PolarHBondContact O-N 2.7Å; E250-K253 IonicContact OE1-NZ 3.27Å; E250-K253 PolarHBondContact OE1-NZ 3.23Å; E250-K253 WeakPolarHBondContact OE2-CD 3.49Å; E250-K253 IonicContact OE2-NZ 2.84Å; E250-K253 PolarHBondContact OE2-NZ 3.18Å; K253-A256 PolarHBondContact O-N 3.16Å; K253-A257 PolarHBondContact O-N 3.34Å |
| 254 | E | 97.6 | Very high | 97.6 | Very high | 32 Ų | 32 | 80.6 Ų | 80.6 | 15% | 0.15 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -72.1 | -29.3 | 177 | -78.3 | -79.2 | -175.7 | 0 | 0 | 112.5 | E250 A257 S258 K265 I269 F284 | E250-E254 PolarHBondContact O-N 3.41Å; E254-A257 PolarHBondContact O-N 2.79Å; E254-S258 PolarHBondContact O-N 3.41Å; E254-K265 IonicContact OE1-NZ 3.94Å; E254-K265 WeakPolarHBondContact OE2-CD 3.46Å; E254-K265 WeakPolarHBondContact OE2-CE 3.27Å; E254-K265 IonicContact OE2-NZ 2.75Å; E254-K265 PolarHBondContact OE2-NZ 2.93Å; E254-I269 HydrophobicContact CB-CD1 3.61Å; E254-I269 HydrophobicContact CB-CG1 4.5Å; E254-I269 HydrophobicContact CG-CD1 3.67Å; E254-I269 HydrophobicContact CG-CG1 4.05Å; E254-F284 HydrophobicContact CB-CZ 4.29Å |
| 255 | Y | 97.8 | Very high | 97.5 | Very high | 4 Ų | 4 | 79.4 Ų | 79.4 | 2% | 0.016 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -68.8 | -31.6 | 172.6 | -169.2 | -98 | 0 | 0 | 0 | 113.7 | L251 E252 S258 K259 W283 F284 R287 R288 E291 | L251-Y255 WeakPolarHBondContact O-CB 3.43Å; L251-Y255 PolarHBondContact O-N 3.01Å; E252-Y255 PolarHBondContact O-N 3.17Å; Y255-S258 WeakPolarHBondContact CA-O 3.38Å; Y255-S258 CarbonylContact O-C 3.4Å; Y255-K259 HydrophobicContact CD1-CD 4.16Å; Y255-K259 HydrophobicContact CE1-CD 3.53Å; Y255-K259 HydrophobicContact CE2-CB 4.38Å; Y255-K259 HydrophobicContact CE2-CD 4.15Å; Y255-W283 HydrophobicContact CD2-CZ3 4.21Å; Y255-W283 HydrophobicContact CG-CZ3 4.25Å; Y255-F284 AromaticContact CD2-CD1 3.81Å; Y255-F284 HydrophobicContact CD2-CD1 3.81Å; Y255-F284 AromaticContact CD2-CE1 3.81Å; Y255-F284 HydrophobicContact CD2-CE1 3.81Å; Y255-F284 HydrophobicContact CE2-CD1 4.38Å; Y255-R287 HydrophobicContact CD1-CG 3.66Å; Y255-R287 HydrophobicContact CD2-CB 4.15Å; Y255-R287 HydrophobicContact CD2-CG 3.69Å; Y255-R287 HydrophobicContact CE1-CG 3.6Å; Y255-R287 HydrophobicContact CE2-CB 3.94Å; Y255-R287 HydrophobicContact CE2-CG 3.63Å; Y255-R287 HydrophobicContact CG-CG 3.7Å; Y255-R288 HydrophobicContact CE2-CG 3.85Å; Y255-R288 WeakPolarHBondContact OH-CA 3.37Å; Y255-R288 WeakPolarHBondContact OH-CG 3.29Å; Y255-E291 WeakPolarHBondContact CE1-OE1 3.45Å; Y255-E291 PolarHBondContact OH-OE2 2.88Å |
| 256 | A | 97.2 | Very high | 97.5 | Very high | 81 Ų | 81 | 73.6 Ų | 73.6 | 67% | 0.669 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -67.4 | -41.2 | 172 | 0 | 0 | 0 | 0 | 0 | 110.9 | E252 K253 | E252-A256 PolarHBondContact O-N 2.75Å; K253-A256 PolarHBondContact O-N 3.16Å |
| 257 | A | 96.8 | Very high | 97.6 | Very high | 74 Ų | 74 | 72.9 Ų | 72.9 | 61% | 0.612 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -70.8 | -34.6 | 176 | 0 | 0 | 0 | 0 | 0 | 113.6 | K253 E254 | K253-A257 PolarHBondContact O-N 3.34Å; E254-A257 PolarHBondContact O-N 2.79Å |
| 258 | S | 96.6 | Very high | 97.6 | Very high | 44 Ų | 44 | 78.5 Ų | 78.5 | 31% | 0.308 | 38% | 0.384 | S | S | . | . | trans | -155.5 | 130.9 | 173.9 | 176.1 | 0 | 0 | 0 | 0 | 112.2 | E254 Y255 F260 | E254-S258 PolarHBondContact O-N 3.41Å; Y255-S258 WeakPolarHBondContact CA-O 3.38Å; Y255-S258 CarbonylContact O-C 3.4Å; S258-F260 WeakPolarHBondContact CB-O 3.46Å; S258-F260 PolarHBondContact O-N 2.65Å; S258-F260 VanDerWaalsContact O-N 3.16Å; S258-F260 PolarHBondContact OG-N 3.18Å; S258-F260 PolarHBondContact OG-O 3.36Å | ||
| 259 | K | 96.7 | Very high | 97.6 | Very high | 81 Ų | 81 | 76.2 Ų | 76.2 | 35% | 0.352 | 37% | 0.372 | S | S | . | . | S | Bend | trans | -66.5 | -14.6 | 174.6 | -52.3 | -61.8 | 178.4 | 176 | 0 | 113.3 | Y255 R288 E291 | Y255-K259 HydrophobicContact CD1-CD 4.16Å; Y255-K259 HydrophobicContact CE1-CD 3.53Å; Y255-K259 HydrophobicContact CE2-CB 4.38Å; Y255-K259 HydrophobicContact CE2-CD 4.15Å; K259-R288 WeakPolarHBondContact O-CD 3.22Å; K259-E291 IonicContact NZ-OE1 3.59Å; K259-E291 PolarHBondContact NZ-OE1 3Å; K259-E291 IonicContact NZ-OE2 2.74Å |
| 260 | F | 97.3 | Very high | 97.6 | Very high | 132 Ų | 132 | 70.3 Ų | 70.3 | 58% | 0.579 | 35% | 0.349 | S | S | * | . | S | Bend | trans | -126.2 | 141.6 | -179.1 | -65.2 | -99.7 | 0 | 0 | 0 | 111.5 | S258 | S258-F260 WeakPolarHBondContact CB-O 3.46Å; S258-F260 PolarHBondContact O-N 2.65Å; S258-F260 VanDerWaalsContact O-N 3.16Å; S258-F260 PolarHBondContact OG-N 3.18Å; S258-F260 PolarHBondContact OG-O 3.36Å |
| 261 | I | 97.1 | Very high | 97.6 | Very high | 25 Ų | 25 | 71 Ų | 71 | 13% | 0.128 | 37% | 0.365 | C | S | . | . | trans | -106.8 | 118 | -174.3 | -166.9 | 72.5 | 0 | 0 | 0 | 111.9 | K265 R266 I269 F284 | I261-K265 HydrophobicContact CD1-CB 3.42Å; I261-K265 VanDerWaalsContact CD1-CB 3.42Å; I261-K265 HydrophobicContact CD1-CD 4.37Å; I261-K265 HydrophobicContact CG1-CB 4.23Å; I261-R266 HydrophobicContact CG1-CB 3.83Å; I261-I269 HydrophobicContact CD1-CD1 3.47Å; I261-I269 VanDerWaalsContact CD1-CD1 3.47Å; I261-I269 HydrophobicContact CG1-CD1 4.45Å; I261-F284 HydrophobicContact CB-CD1 3.9Å; I261-F284 HydrophobicContact CB-CD2 4.26Å; I261-F284 HydrophobicContact CB-CE1 3.92Å; I261-F284 HydrophobicContact CB-CE2 4.28Å; I261-F284 HydrophobicContact CB-CG 4.09Å; I261-F284 HydrophobicContact CB-CZ 4.12Å; I261-F284 HydrophobicContact CD1-CE1 4.31Å; I261-F284 HydrophobicContact CD1-CE2 4.17Å; I261-F284 HydrophobicContact CD1-CZ 3.84Å; I261-F284 HydrophobicContact CG1-CE2 4.35Å; I261-F284 HydrophobicContact CG1-CZ 4.34Å; I261-F284 HydrophobicContact CG2-CB 4.27Å; I261-F284 HydrophobicContact CG2-CD1 4.21Å; I261-F284 HydrophobicContact CG2-CD2 4.24Å; I261-F284 HydrophobicContact CG2-CG 3.98Å | ||
| 262 | T | 98 | Very high | 97.5 | Very high | 83 Ų | 83 | 74.5 Ų | 74.5 | 51% | 0.509 | 39% | 0.393 | S | S | . | . | trans | -71.6 | 161.7 | 172.9 | 59.9 | 0 | 0 | 0 | 0 | 111.5 | D264 K265 R266 | T262-D264 VanDerWaalsContact C-N 3.33Å; T262-D264 PolarHBondContact O-N 3.21Å; T262-K265 PolarHBondContact O-N 3.49Å; T262-R266 VanDerWaalsContact O-CB 3.3Å; T262-R266 WeakPolarHBondContact O-CB 3.48Å; T262-R266 PolarHBondContact O-N 3.33Å | ||
| 263 | K | 97.8 | Very high | 97.5 | Very high | 149 Ų | 149 | 70.2 Ų | 70.2 | 65% | 0.648 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -54.8 | -45.9 | -179.8 | -172.6 | 179.1 | 178.3 | -176.1 | 0 | 112.2 | R266 R267 | K263-R266 WeakPolarHBondContact O-CB 3.32Å; K263-R266 PolarHBondContact O-N 3.27Å; K263-R267 PolarHBondContact O-N 2.95Å |
| 264 | D | 97.6 | Very high | 97.5 | Very high | 81 Ų | 81 | 71.4 Ų | 71.4 | 43% | 0.433 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -74.5 | -38.8 | -176.3 | -55 | -67.5 | 0 | 0 | 0 | 113.5 | T262 R266 R267 R268 | T262-D264 VanDerWaalsContact C-N 3.33Å; T262-D264 PolarHBondContact O-N 3.21Å; D264-R266 VanDerWaalsContact C-N 3.31Å; D264-R266 PolarHBondContact O-N 3.38Å; D264-R267 PolarHBondContact O-N 2.84Å; D264-R267 IonicContact OD1-CZ 2.69Å; D264-R267 IonicContact OD1-NH1 3.21Å; D264-R267 PolarHBondContact OD1-NH1 3.32Å; D264-R267 IonicContact OD1-NH2 3.98Å; D264-R267 PolarHBondContact OD1-NH2 3.47Å; D264-R268 WeakPolarHBondContact O-CG 3.3Å; D264-R268 PolarHBondContact O-N 3.34Å |
| 265 | K | 97.3 | Very high | 97.5 | Very high | 49 Ų | 49 | 70.3 Ų | 70.3 | 21% | 0.213 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -62.4 | -40.8 | 170.7 | -75 | -169.3 | 163.8 | -148.8 | 0 | 111.1 | E254 I261 T262 R267 R268 I269 | E254-K265 IonicContact OE1-NZ 3.94Å; E254-K265 WeakPolarHBondContact OE2-CD 3.46Å; E254-K265 WeakPolarHBondContact OE2-CE 3.27Å; E254-K265 IonicContact OE2-NZ 2.75Å; E254-K265 PolarHBondContact OE2-NZ 2.93Å; I261-K265 HydrophobicContact CD1-CB 3.42Å; I261-K265 VanDerWaalsContact CD1-CB 3.42Å; I261-K265 HydrophobicContact CD1-CD 4.37Å; I261-K265 HydrophobicContact CG1-CB 4.23Å; T262-K265 PolarHBondContact O-N 3.49Å; K265-R267 PolarHBondContact O-N 3.23Å; K265-R268 PolarHBondContact O-N 2.9Å; K265-I269 WeakPolarHBondContact O-CG1 3.44Å; K265-I269 PolarHBondContact O-N 2.76Å |
| 266 | R | 98.3 | Very high | 97.5 | Very high | 67 Ų | 67 | 72.7 Ų | 72.7 | 25% | 0.253 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -59.1 | -46.3 | 177.3 | -171.1 | -167.6 | -58.5 | 171.4 | 0.2 | 111.8 | I261 T262 K263 D264 I269 S270 E277 V280 T281 | I261-R266 HydrophobicContact CG1-CB 3.83Å; T262-R266 VanDerWaalsContact O-CB 3.3Å; T262-R266 WeakPolarHBondContact O-CB 3.48Å; T262-R266 PolarHBondContact O-N 3.33Å; K263-R266 WeakPolarHBondContact O-CB 3.32Å; K263-R266 PolarHBondContact O-N 3.27Å; D264-R266 VanDerWaalsContact C-N 3.31Å; D264-R266 PolarHBondContact O-N 3.38Å; R266-I269 PolarHBondContact O-N 3.22Å; R266-S270 VanDerWaalsContact O-CB 3.23Å; R266-S270 WeakPolarHBondContact O-CB 3.45Å; R266-S270 PolarHBondContact O-N 3.15Å; R266-E277 WeakPolarHBondContact CD-OE2 3.43Å; R266-E277 HydrophobicContact CG-CB 4.04Å; R266-E277 HydrophobicContact CG-CG 4.08Å; R266-V280 HydrophobicContact CG-CB 4.23Å; R266-V280 HydrophobicContact CG-CG1 4.11Å; R266-T281 WeakPolarHBondContact CD-OG1 3.49Å; R266-T281 PolarHBondContact NE-OG1 3.35Å; R266-T281 VanDerWaalsContact NE-OG1 3.17Å |
| 267 | R | 98.3 | Very high | 97.5 | Very high | 118 Ų | 118 | 72.1 Ų | 72.1 | 45% | 0.445 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -61.2 | -43.7 | 175.7 | -172.1 | 171.2 | 67.3 | -98.2 | 3.4 | 111.8 | K263 D264 K265 S270 A271 | K263-R267 PolarHBondContact O-N 2.95Å; D264-R267 PolarHBondContact O-N 2.84Å; D264-R267 IonicContact OD1-CZ 2.69Å; D264-R267 IonicContact OD1-NH1 3.21Å; D264-R267 PolarHBondContact OD1-NH1 3.32Å; D264-R267 IonicContact OD1-NH2 3.98Å; D264-R267 PolarHBondContact OD1-NH2 3.47Å; K265-R267 PolarHBondContact O-N 3.23Å; R267-S270 WeakPolarHBondContact O-CB 3.23Å; R267-S270 PolarHBondContact O-N 3.18Å; R267-A271 PolarHBondContact O-N 3.45Å; R267-A271 VanDerWaalsContact O-N 3.09Å |
| 268 | R | 98.1 | Very high | 97.6 | Very high | 148 Ų | 148 | 78 Ų | 78 | 56% | 0.558 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -62.2 | -47.5 | 175.9 | -74.4 | -169.3 | -76.7 | 129.9 | -18.1 | 113.1 | D264 K265 S270 A271 A272 | D264-R268 WeakPolarHBondContact O-CG 3.3Å; D264-R268 PolarHBondContact O-N 3.34Å; K265-R268 PolarHBondContact O-N 2.9Å; R268-S270 VanDerWaalsContact C-N 3.34Å; R268-S270 PolarHBondContact O-N 3.17Å; R268-A271 PolarHBondContact O-N 2.73Å; R268-A272 WeakPolarHBondContact O-CB 3.43Å; R268-A272 PolarHBondContact O-N 3.33Å |
| 269 | I | 97.4 | Very high | 97.7 | Very high | 9 Ų | 9 | 79.4 Ų | 79.4 | 5% | 0.046 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -64.2 | -40.6 | 176.6 | -63.2 | 172 | 0 | 0 | 0 | 110.8 | L251 E254 I261 K265 R266 A271 A272 T273 V280 F284 | L251-I269 HydrophobicContact CD2-CG2 3.78Å; L251-I269 HydrophobicContact CG-CG2 4.45Å; E254-I269 HydrophobicContact CB-CD1 3.61Å; E254-I269 HydrophobicContact CB-CG1 4.5Å; E254-I269 HydrophobicContact CG-CD1 3.67Å; E254-I269 HydrophobicContact CG-CG1 4.05Å; I261-I269 HydrophobicContact CD1-CD1 3.47Å; I261-I269 VanDerWaalsContact CD1-CD1 3.47Å; I261-I269 HydrophobicContact CG1-CD1 4.45Å; K265-I269 WeakPolarHBondContact O-CG1 3.44Å; K265-I269 PolarHBondContact O-N 2.76Å; R266-I269 PolarHBondContact O-N 3.22Å; I269-A271 VanDerWaalsContact C-N 3.34Å; I269-A271 PolarHBondContact O-N 2.92Å; I269-A272 PolarHBondContact O-N 3.13Å; I269-T273 HydrophobicContact CG2-CG2 3.97Å; I269-T273 WeakPolarHBondContact O-CB 3.47Å; I269-T273 WeakPolarHBondContact O-CG2 3.36Å; I269-T273 PolarHBondContact O-N 3.1Å; I269-T273 PolarHBondContact O-OG1 3.32Å; I269-V280 HydrophobicContact CB-CG1 4.36Å; I269-V280 HydrophobicContact CD1-CG1 4.49Å; I269-V280 HydrophobicContact CG2-CG1 4.08Å; I269-V280 HydrophobicContact CG2-CG2 4.01Å; I269-F284 HydrophobicContact CD1-CE2 4.21Å; I269-F284 HydrophobicContact CD1-CZ 4.36Å |
| 270 | S | 98.3 | Very high | 97.7 | Very high | 23 Ų | 23 | 75.5 Ų | 75.5 | 16% | 0.161 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -55.6 | -49.1 | 177.6 | 179.7 | 0 | 0 | 0 | 0 | 111.3 | R266 R267 R268 N274 L275 E277 | R266-S270 VanDerWaalsContact O-CB 3.23Å; R266-S270 WeakPolarHBondContact O-CB 3.45Å; R266-S270 PolarHBondContact O-N 3.15Å; R267-S270 WeakPolarHBondContact O-CB 3.23Å; R267-S270 PolarHBondContact O-N 3.18Å; R268-S270 VanDerWaalsContact C-N 3.34Å; R268-S270 PolarHBondContact O-N 3.17Å; S270-N274 WeakPolarHBondContact O-CA 3.42Å; S270-N274 PolarHBondContact O-N 3.47Å; S270-N274 VanDerWaalsContact O-N 3.07Å; S270-L275 WeakPolarHBondContact CA-O 3.33Å; S270-L275 VanDerWaalsContact CB-O 3.27Å; S270-L275 WeakPolarHBondContact CB-O 3.33Å; S270-L275 PolarHBondContact O-N 3.11Å; S270-L275 PolarHBondContact OG-O 3.33Å; S270-E277 PolarHBondContact OG-N 2.57Å |
| 271 | A | 97.7 | Very high | 97.8 | Very high | 72 Ų | 72 | 70.7 Ų | 70.7 | 60% | 0.595 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -63.6 | -46.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | R267 R268 I269 T273 | R267-A271 PolarHBondContact O-N 3.45Å; R267-A271 VanDerWaalsContact O-N 3.09Å; R268-A271 PolarHBondContact O-N 2.73Å; I269-A271 VanDerWaalsContact C-N 3.34Å; I269-A271 PolarHBondContact O-N 2.92Å; A271-T273 VanDerWaalsContact C-N 3.33Å; A271-T273 PolarHBondContact O-N 3.45Å |
| 272 | A | 97.1 | Very high | 97.8 | Very high | 73 Ų | 73 | 72.5 Ų | 72.5 | 60% | 0.603 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -67.8 | -28.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | R268 I269 | R268-A272 WeakPolarHBondContact O-CB 3.43Å; R268-A272 PolarHBondContact O-N 3.33Å; I269-A272 PolarHBondContact O-N 3.13Å |
| 273 | T | 96.9 | Very high | 97.8 | Very high | 7 Ų | 7 | 69.6 Ų | 69.6 | 4% | 0.043 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -105.4 | -4.9 | -174.7 | 60.8 | 0 | 0 | 0 | 0 | 114.1 | Q247 E250 I269 A271 L275 | Q247-T273 WeakPolarHBondContact CG-O 3.38Å; Q247-T273 PolarHBondContact NE2-O 3.31Å; E250-T273 HydrophobicContact CB-CG2 3.91Å; I269-T273 HydrophobicContact CG2-CG2 3.97Å; I269-T273 WeakPolarHBondContact O-CB 3.47Å; I269-T273 WeakPolarHBondContact O-CG2 3.36Å; I269-T273 PolarHBondContact O-N 3.1Å; I269-T273 PolarHBondContact O-OG1 3.32Å; A271-T273 VanDerWaalsContact C-N 3.33Å; A271-T273 PolarHBondContact O-N 3.45Å; T273-L275 PolarHBondContact O-N 2.95Å |
| 274 | N | 97.8 | Very high | 97.9 | Very high | 148 Ų | 148 | 62.7 Ų | 62.7 | 79% | 0.791 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.5 | 35.9 | -170.6 | -64.2 | -63 | 0 | 0 | 0 | 113.1 | S270 | S270-N274 WeakPolarHBondContact O-CA 3.42Å; S270-N274 PolarHBondContact O-N 3.47Å; S270-N274 VanDerWaalsContact O-N 3.07Å |
| 275 | L | 97.1 | Very high | 97.9 | Very high | 9 Ų | 9 | 63.2 Ų | 63.2 | 5% | 0.047 | 31% | 0.313 | C | S | . | . | trans | -109.2 | 144.3 | 173.9 | -64.4 | -179.3 | 0 | 0 | 0 | 109.5 | Y243 Q247 L251 S270 T273 Q279 V280 | Y243-L275 HydrophobicContact CD1-CD1 3.9Å; Y243-L275 HydrophobicContact CD1-CD2 3.82Å; Y243-L275 HydrophobicContact CE1-CD1 3.87Å; Y243-L275 HydrophobicContact CE1-CD2 3.69Å; Y243-L275 HydrophobicContact CE1-CG 4.45Å; Q247-L275 HydrophobicContact CB-CD1 4.39Å; Q247-L275 HydrophobicContact CG-CD1 4.49Å; L251-L275 HydrophobicContact CD1-CD1 3.93Å; S270-L275 WeakPolarHBondContact CA-O 3.33Å; S270-L275 VanDerWaalsContact CB-O 3.27Å; S270-L275 WeakPolarHBondContact CB-O 3.33Å; S270-L275 PolarHBondContact O-N 3.11Å; S270-L275 PolarHBondContact OG-O 3.33Å; T273-L275 PolarHBondContact O-N 2.95Å; L275-Q279 HydrophobicContact CB-CB 4.29Å; L275-V280 HydrophobicContact CB-CG2 4.2Å | ||
| 276 | S | 98.2 | Very high | 97.9 | Very high | 54 Ų | 54 | 65.6 Ų | 65.6 | 38% | 0.378 | 33% | 0.329 | S | S | . | . | trans | -63.1 | 148.6 | 172.7 | 62.8 | 0 | 0 | 0 | 0 | 111.6 | R278 Q279 V280 | S276-R278 PolarHBondContact O-N 3.32Å; S276-Q279 WeakPolarHBondContact O-CA 3.39Å; S276-Q279 WeakPolarHBondContact O-CB 3.44Å; S276-Q279 PolarHBondContact O-N 2.88Å; S276-Q279 WeakPolarHBondContact OG-CG 3.37Å; S276-Q279 PolarHBondContact OG-N 3.4Å; S276-Q279 PolarHBondContact OG-OE1 3.1Å; S276-V280 PolarHBondContact O-N 3.25Å | ||
| 277 | E | 98.1 | Very high | 97.9 | Very high | 69 Ų | 69 | 65.2 Ų | 65.2 | 32% | 0.322 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -50.9 | -33.6 | 173.2 | -74.9 | -162.2 | -151.5 | 0 | 0 | 113 | R266 S270 T281 | R266-E277 WeakPolarHBondContact CD-OE2 3.43Å; R266-E277 HydrophobicContact CG-CB 4.04Å; R266-E277 HydrophobicContact CG-CG 4.08Å; S270-E277 PolarHBondContact OG-N 2.57Å; E277-T281 WeakPolarHBondContact O-CB 3.49Å; E277-T281 PolarHBondContact O-N 3.41Å; E277-T281 PolarHBondContact O-OG1 3.24Å |
| 278 | R | 97.9 | Very high | 97.9 | Very high | 196 Ų | 196 | 63.8 Ų | 63.8 | 74% | 0.74 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -65.9 | -43.9 | 174.3 | -173.8 | 179.2 | 179.7 | -171.6 | 2.7 | 112 | S276 T281 I282 | S276-R278 PolarHBondContact O-N 3.32Å; R278-T281 PolarHBondContact O-N 3.49Å; R278-I282 HydrophobicContact CG-CD1 3.89Å; R278-I282 WeakPolarHBondContact O-CB 3.42Å; R278-I282 VanDerWaalsContact O-CG1 3.28Å; R278-I282 WeakPolarHBondContact O-CG1 3.28Å; R278-I282 PolarHBondContact O-N 3.43Å |
| 279 | Q | 98 | Very high | 97.9 | Very high | 74 Ų | 74 | 60.3 Ų | 60.3 | 35% | 0.346 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -63.5 | -43.1 | 175.2 | -77.1 | 162.6 | -64 | 0 | 0 | 111.7 | L275 S276 T281 I282 W283 | L275-Q279 HydrophobicContact CB-CB 4.29Å; S276-Q279 WeakPolarHBondContact O-CA 3.39Å; S276-Q279 WeakPolarHBondContact O-CB 3.44Å; S276-Q279 PolarHBondContact O-N 2.88Å; S276-Q279 WeakPolarHBondContact OG-CG 3.37Å; S276-Q279 PolarHBondContact OG-N 3.4Å; S276-Q279 PolarHBondContact OG-OE1 3.1Å; Q279-T281 VanDerWaalsContact C-N 3.33Å; Q279-T281 PolarHBondContact O-N 3.48Å; Q279-I282 PolarHBondContact O-N 2.94Å; Q279-W283 WeakPolarHBondContact O-CB 3.47Å; Q279-W283 PolarHBondContact O-N 3.08Å |
| 280 | V | 98.2 | Very high | 97.8 | Very high | 0 Ų | 0 | 65.5 Ų | 65.5 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -57.9 | -47.2 | 173.7 | 179.4 | 0 | 0 | 0 | 0 | 110.1 | L251 R266 I269 L275 S276 I282 W283 F284 | L251-V280 HydrophobicContact CD2-CG1 4.09Å; L251-V280 HydrophobicContact CD2-CG2 4.47Å; R266-V280 HydrophobicContact CG-CB 4.23Å; R266-V280 HydrophobicContact CG-CG1 4.11Å; I269-V280 HydrophobicContact CB-CG1 4.36Å; I269-V280 HydrophobicContact CD1-CG1 4.49Å; I269-V280 HydrophobicContact CG2-CG1 4.08Å; I269-V280 HydrophobicContact CG2-CG2 4.01Å; L275-V280 HydrophobicContact CB-CG2 4.2Å; S276-V280 PolarHBondContact O-N 3.25Å; V280-I282 PolarHBondContact O-N 3.06Å; V280-W283 PolarHBondContact O-N 3.4Å; V280-F284 HydrophobicContact CG1-CD2 4.06Å; V280-F284 HydrophobicContact CG1-CE2 4.11Å; V280-F284 WeakPolarHBondContact O-CD2 3.49Å; V280-F284 PolarHBondContact O-N 2.93Å |
| 281 | T | 98.1 | Very high | 97.7 | Very high | 31 Ų | 31 | 67 Ų | 67 | 19% | 0.19 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.7 | -46.4 | 178.4 | -55.5 | 0 | 0 | 0 | 0 | 112.4 | R266 E277 R278 Q279 W283 F284 Q285 | R266-T281 WeakPolarHBondContact CD-OG1 3.49Å; R266-T281 PolarHBondContact NE-OG1 3.35Å; R266-T281 VanDerWaalsContact NE-OG1 3.17Å; E277-T281 WeakPolarHBondContact O-CB 3.49Å; E277-T281 PolarHBondContact O-N 3.41Å; E277-T281 PolarHBondContact O-OG1 3.24Å; R278-T281 PolarHBondContact O-N 3.49Å; Q279-T281 VanDerWaalsContact C-N 3.33Å; Q279-T281 PolarHBondContact O-N 3.48Å; T281-W283 VanDerWaalsContact C-N 3.33Å; T281-W283 PolarHBondContact O-N 2.98Å; T281-F284 PolarHBondContact O-N 3.08Å; T281-Q285 WeakPolarHBondContact O-CG 3.39Å; T281-Q285 PolarHBondContact O-N 3.22Å |
| 282 | I | 98.1 | Very high | 97.6 | Very high | 63 Ų | 63 | 70.8 Ų | 70.8 | 32% | 0.323 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -63.8 | -39.1 | 176.9 | -70.8 | 167.3 | 0 | 0 | 0 | 110.9 | R278 Q279 V280 Q285 N286 | R278-I282 HydrophobicContact CG-CD1 3.89Å; R278-I282 WeakPolarHBondContact O-CB 3.42Å; R278-I282 VanDerWaalsContact O-CG1 3.28Å; R278-I282 WeakPolarHBondContact O-CG1 3.28Å; R278-I282 PolarHBondContact O-N 3.43Å; Q279-I282 PolarHBondContact O-N 2.94Å; V280-I282 PolarHBondContact O-N 3.06Å; I282-Q285 PolarHBondContact O-N 3.39Å; I282-N286 WeakPolarHBondContact CG2-ND2 3.21Å; I282-N286 WeakPolarHBondContact O-CB 3.18Å; I282-N286 VanDerWaalsContact O-CG 3.27Å; I282-N286 PolarHBondContact O-N 3.41Å; I282-N286 PolarHBondContact O-ND2 3.19Å |
| 283 | W | 98.3 | Very high | 97.4 | Very high | 21 Ų | 21 | 74.1 Ų | 74.1 | 8% | 0.08 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -62.7 | -46 | 176.5 | -171.7 | 103.2 | 0 | 0 | 0 | 111.2 | Y243 L251 E252 Y255 Q279 V280 T281 Q285 N286 R287 | Y243-W283 AromaticContact CD2-CD1 3.87Å; Y243-W283 AromaticContact CE2-CD1 3.69Å; L251-W283 HydrophobicContact CB-CD2 3.94Å; L251-W283 HydrophobicContact CB-CE3 3.94Å; L251-W283 HydrophobicContact CB-CH2 3.76Å; L251-W283 HydrophobicContact CB-CZ2 3.73Å; L251-W283 HydrophobicContact CB-CZ3 3.86Å; L251-W283 HydrophobicContact CD1-CD2 3.94Å; L251-W283 HydrophobicContact CD1-CG 3.85Å; L251-W283 HydrophobicContact CD2-CD2 4.19Å; L251-W283 HydrophobicContact CD2-CE3 4.11Å; L251-W283 HydrophobicContact CD2-CG 4.4Å; L251-W283 HydrophobicContact CG-CD2 4.26Å; L251-W283 HydrophobicContact CG-CE3 4.46Å; L251-W283 WeakPolarHBondContact O-CZ3 3.36Å; E252-W283 HydrophobicContact CG-CH2 3.68Å; E252-W283 HydrophobicContact CG-CZ2 3.7Å; Y255-W283 HydrophobicContact CD2-CZ3 4.21Å; Y255-W283 HydrophobicContact CG-CZ3 4.25Å; Q279-W283 WeakPolarHBondContact O-CB 3.47Å; Q279-W283 PolarHBondContact O-N 3.08Å; V280-W283 PolarHBondContact O-N 3.4Å; T281-W283 VanDerWaalsContact C-N 3.33Å; T281-W283 PolarHBondContact O-N 2.98Å; W283-Q285 VanDerWaalsContact C-N 3.32Å; W283-Q285 PolarHBondContact O-N 3.37Å; W283-N286 PolarHBondContact O-N 2.99Å; W283-R287 HydrophobicContact CD2-CB 4.45Å; W283-R287 HydrophobicContact CE3-CB 3.96Å; W283-R287 HydrophobicContact CE3-CG 4.47Å; W283-R287 HydrophobicContact CH2-CB 4.01Å; W283-R287 HydrophobicContact CH2-CG 3.64Å; W283-R287 HydrophobicContact CZ2-CB 4.49Å; W283-R287 HydrophobicContact CZ2-CG 4.31Å; W283-R287 HydrophobicContact CZ3-CB 3.72Å; W283-R287 HydrophobicContact CZ3-CG 3.73Å; W283-R287 WeakPolarHBondContact O-CB 3.48Å; W283-R287 PolarHBondContact O-N 3.46Å |
| 284 | F | 98.4 | Very high | 97.2 | Very high | 4 Ų | 4 | 79.8 Ų | 79.8 | 2% | 0.018 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -63.7 | -32.8 | 176.2 | -91.1 | -102.8 | 0 | 0 | 0 | 113.2 | L251 E254 Y255 I261 I269 V280 T281 R288 | L251-F284 HydrophobicContact CD2-CE2 4.14Å; E254-F284 HydrophobicContact CB-CZ 4.29Å; Y255-F284 AromaticContact CD2-CD1 3.81Å; Y255-F284 HydrophobicContact CD2-CD1 3.81Å; Y255-F284 AromaticContact CD2-CE1 3.81Å; Y255-F284 HydrophobicContact CD2-CE1 3.81Å; Y255-F284 HydrophobicContact CE2-CD1 4.38Å; I261-F284 HydrophobicContact CB-CD1 3.9Å; I261-F284 HydrophobicContact CB-CD2 4.26Å; I261-F284 HydrophobicContact CB-CE1 3.92Å; I261-F284 HydrophobicContact CB-CE2 4.28Å; I261-F284 HydrophobicContact CB-CG 4.09Å; I261-F284 HydrophobicContact CB-CZ 4.12Å; I261-F284 HydrophobicContact CD1-CE1 4.31Å; I261-F284 HydrophobicContact CD1-CE2 4.17Å; I261-F284 HydrophobicContact CD1-CZ 3.84Å; I261-F284 HydrophobicContact CG1-CE2 4.35Å; I261-F284 HydrophobicContact CG1-CZ 4.34Å; I261-F284 HydrophobicContact CG2-CB 4.27Å; I261-F284 HydrophobicContact CG2-CD1 4.21Å; I261-F284 HydrophobicContact CG2-CD2 4.24Å; I261-F284 HydrophobicContact CG2-CG 3.98Å; I269-F284 HydrophobicContact CD1-CE2 4.21Å; I269-F284 HydrophobicContact CD1-CZ 4.36Å; V280-F284 HydrophobicContact CG1-CD2 4.06Å; V280-F284 HydrophobicContact CG1-CE2 4.11Å; V280-F284 WeakPolarHBondContact O-CD2 3.49Å; V280-F284 PolarHBondContact O-N 2.93Å; T281-F284 PolarHBondContact O-N 3.08Å; F284-R288 WeakPolarHBondContact O-CG 3.41Å; F284-R288 PolarHBondContact O-N 3.42Å; F284-R288 PolarHBondContact O-NE 2.8Å |
| 285 | Q | 98.3 | Very high | 96.7 | Very high | 92 Ų | 92 | 76.4 Ų | 76.4 | 43% | 0.43 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -65.8 | -51.7 | 170.8 | -69.8 | 170.6 | 5 | 0 | 0 | 111 | T281 I282 W283 R287 R288 V289 | T281-Q285 WeakPolarHBondContact O-CG 3.39Å; T281-Q285 PolarHBondContact O-N 3.22Å; I282-Q285 PolarHBondContact O-N 3.39Å; W283-Q285 VanDerWaalsContact C-N 3.32Å; W283-Q285 PolarHBondContact O-N 3.37Å; Q285-R287 VanDerWaalsContact C-N 3.29Å; Q285-R287 PolarHBondContact O-N 3.37Å; Q285-R288 PolarHBondContact O-N 3.46Å; Q285-V289 WeakPolarHBondContact O-CG2 3.43Å; Q285-V289 PolarHBondContact O-N 2.88Å; Q285-V289 VanDerWaalsContact O-N 3.1Å |
| 286 | N | 98 | Very high | 96 | Very high | 100 Ų | 100 | 79.5 Ų | 79.5 | 54% | 0.535 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -60.8 | -37 | 178.7 | -71 | -26.9 | 0 | 0 | 0 | 112.5 | I282 W283 V289 K290 | I282-N286 WeakPolarHBondContact CG2-ND2 3.21Å; I282-N286 WeakPolarHBondContact O-CB 3.18Å; I282-N286 VanDerWaalsContact O-CG 3.27Å; I282-N286 PolarHBondContact O-N 3.41Å; I282-N286 PolarHBondContact O-ND2 3.19Å; W283-N286 PolarHBondContact O-N 2.99Å; N286-V289 PolarHBondContact O-N 3.43Å; N286-K290 VanDerWaalsContact O-CB 3.29Å; N286-K290 WeakPolarHBondContact O-CB 3.47Å; N286-K290 PolarHBondContact O-N 3.35Å |
| 287 | R | 98 | Very high | 95 | Very high | 59 Ų | 59 | 83.6 Ų | 83.6 | 22% | 0.223 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -67.5 | -38.7 | -179.5 | -172.4 | 63.8 | -175.1 | 75.7 | -3.7 | 112.5 | Y255 W283 Q285 E291 | Y255-R287 HydrophobicContact CD1-CG 3.66Å; Y255-R287 HydrophobicContact CD2-CB 4.15Å; Y255-R287 HydrophobicContact CD2-CG 3.69Å; Y255-R287 HydrophobicContact CE1-CG 3.6Å; Y255-R287 HydrophobicContact CE2-CB 3.94Å; Y255-R287 HydrophobicContact CE2-CG 3.63Å; Y255-R287 HydrophobicContact CG-CG 3.7Å; W283-R287 HydrophobicContact CD2-CB 4.45Å; W283-R287 HydrophobicContact CE3-CB 3.96Å; W283-R287 HydrophobicContact CE3-CG 4.47Å; W283-R287 HydrophobicContact CH2-CB 4.01Å; W283-R287 HydrophobicContact CH2-CG 3.64Å; W283-R287 HydrophobicContact CZ2-CB 4.49Å; W283-R287 HydrophobicContact CZ2-CG 4.31Å; W283-R287 HydrophobicContact CZ3-CB 3.72Å; W283-R287 HydrophobicContact CZ3-CG 3.73Å; W283-R287 WeakPolarHBondContact O-CB 3.48Å; W283-R287 PolarHBondContact O-N 3.46Å; Q285-R287 VanDerWaalsContact C-N 3.29Å; Q285-R287 PolarHBondContact O-N 3.37Å; R287-E291 IonicContact NH1-OE1 2.75Å; R287-E291 WeakPolarHBondContact O-CB 3.48Å; R287-E291 PolarHBondContact O-N 3.31Å |
| 288 | R | 97.7 | Very high | 93.7 | Very high | 88 Ų | 88 | 84.1 Ų | 84.1 | 33% | 0.332 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -66.7 | -43.4 | 171.9 | -73.9 | -178.8 | -68.4 | 149 | -0.5 | 112.4 | Y255 K259 F284 Q285 K290 E291 K292 | Y255-R288 HydrophobicContact CE2-CG 3.85Å; Y255-R288 WeakPolarHBondContact OH-CA 3.37Å; Y255-R288 WeakPolarHBondContact OH-CG 3.29Å; K259-R288 WeakPolarHBondContact O-CD 3.22Å; F284-R288 WeakPolarHBondContact O-CG 3.41Å; F284-R288 PolarHBondContact O-N 3.42Å; F284-R288 PolarHBondContact O-NE 2.8Å; Q285-R288 PolarHBondContact O-N 3.46Å; R288-K290 VanDerWaalsContact C-N 3.33Å; R288-K290 PolarHBondContact O-N 3.42Å; R288-E291 PolarHBondContact O-N 2.86Å; R288-K292 PolarHBondContact O-N 3.37Å |
| 289 | V | 97.8 | Very high | 92 | Very high | 74 Ų | 74 | 81.9 Ų | 81.9 | 45% | 0.448 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.2 | -41.9 | 175.5 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | Q285 N286 K293 | Q285-V289 WeakPolarHBondContact O-CG2 3.43Å; Q285-V289 PolarHBondContact O-N 2.88Å; Q285-V289 VanDerWaalsContact O-N 3.1Å; N286-V289 PolarHBondContact O-N 3.43Å; V289-K293 HydrophobicContact CG1-CD 4.37Å; V289-K293 WeakPolarHBondContact O-CG 3.37Å; V289-K293 PolarHBondContact O-N 3.15Å; V289-K293 VanDerWaalsContact O-N 3.08Å |
| 290 | K | 96.3 | Very high | 90.2 | Very high | 118 Ų | 118 | 83.1 Ų | 83.1 | 51% | 0.513 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -61.5 | -46.5 | 174.7 | 174.4 | 179.5 | -85.2 | -164.7 | 0 | 111.5 | N286 R288 K293 F294 | N286-K290 VanDerWaalsContact O-CB 3.29Å; N286-K290 WeakPolarHBondContact O-CB 3.47Å; N286-K290 PolarHBondContact O-N 3.35Å; R288-K290 VanDerWaalsContact C-N 3.33Å; R288-K290 PolarHBondContact O-N 3.42Å; K290-K293 PolarHBondContact O-N 3.22Å; K290-F294 HydrophobicContact CD-CE2 3.86Å; K290-F294 HydrophobicContact CG-CD2 3.81Å; K290-F294 HydrophobicContact CG-CE2 3.35Å; K290-F294 HydrophobicContact CG-CZ 4.29Å; K290-F294 WeakPolarHBondContact O-CD2 3.44Å; K290-F294 PolarHBondContact O-N 2.82Å; K290-F294 VanDerWaalsContact O-N 3.1Å |
| 291 | E | 95.8 | Very high | 88.3 | Confident | 55 Ų | 55 | 88.1 Ų | 88.1 | 26% | 0.257 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -59.7 | -48.7 | 176.5 | -170.1 | 164.6 | -111.2 | 0 | 0 | 112.1 | Y255 K259 R287 R288 K293 F294 V295 | Y255-E291 WeakPolarHBondContact CE1-OE1 3.45Å; Y255-E291 PolarHBondContact OH-OE2 2.88Å; K259-E291 IonicContact NZ-OE1 3.59Å; K259-E291 PolarHBondContact NZ-OE1 3Å; K259-E291 IonicContact NZ-OE2 2.74Å; R287-E291 IonicContact NH1-OE1 2.75Å; R287-E291 WeakPolarHBondContact O-CB 3.48Å; R287-E291 PolarHBondContact O-N 3.31Å; R288-E291 PolarHBondContact O-N 2.86Å; E291-K293 VanDerWaalsContact C-N 3.31Å; E291-K293 PolarHBondContact O-N 2.72Å; E291-F294 PolarHBondContact O-N 3.34Å; E291-F294 VanDerWaalsContact O-N 3.13Å; E291-V295 WeakPolarHBondContact O-CG2 3.42Å; E291-V295 PolarHBondContact O-N 3.21Å |
| 292 | K | 95.4 | Very high | 86.2 | Confident | 151 Ų | 151 | 93.9 Ų | 93.9 | 66% | 0.657 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -56.5 | -44.3 | 176.3 | -169.7 | 174.7 | 75.8 | 165.4 | 0 | 111.9 | R288 F294 V295 S296 | R288-K292 PolarHBondContact O-N 3.37Å; K292-F294 VanDerWaalsContact C-N 3.35Å; K292-F294 PolarHBondContact O-N 3.04Å; K292-V295 PolarHBondContact O-N 3.34Å; K292-S296 PolarHBondContact O-N 3Å; K292-S296 PolarHBondContact O-OG 3.31Å |
| 293 | K | 93.9 | Very high | 84.2 | Confident | 144 Ų | 144 | 96.7 Ų | 96.7 | 63% | 0.626 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -61.1 | -40.2 | 177.5 | -76.1 | 178.1 | 175.3 | -170.2 | 0 | 112.6 | V289 K290 E291 K297 | V289-K293 HydrophobicContact CG1-CD 4.37Å; V289-K293 WeakPolarHBondContact O-CG 3.37Å; V289-K293 PolarHBondContact O-N 3.15Å; V289-K293 VanDerWaalsContact O-N 3.08Å; K290-K293 PolarHBondContact O-N 3.22Å; E291-K293 VanDerWaalsContact C-N 3.31Å; E291-K293 PolarHBondContact O-N 2.72Å; K293-K297 WeakPolarHBondContact O-CB 3.23Å; K293-K297 PolarHBondContact O-N 3.31Å; K293-K297 VanDerWaalsContact O-N 3.08Å |
| 294 | F | 91.1 | Very high | 82.1 | Confident | 125 Ų | 125 | 103.2 Ų | 103.2 | 55% | 0.548 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.7 | -45.6 | 176.1 | -72.1 | -55.1 | 0 | 0 | 0 | 112.1 | K290 E291 K292 S296 K297 S298 | K290-F294 HydrophobicContact CD-CE2 3.86Å; K290-F294 HydrophobicContact CG-CD2 3.81Å; K290-F294 HydrophobicContact CG-CE2 3.35Å; K290-F294 HydrophobicContact CG-CZ 4.29Å; K290-F294 WeakPolarHBondContact O-CD2 3.44Å; K290-F294 PolarHBondContact O-N 2.82Å; K290-F294 VanDerWaalsContact O-N 3.1Å; E291-F294 PolarHBondContact O-N 3.34Å; E291-F294 VanDerWaalsContact O-N 3.13Å; K292-F294 VanDerWaalsContact C-N 3.35Å; K292-F294 PolarHBondContact O-N 3.04Å; F294-S296 VanDerWaalsContact C-N 3.35Å; F294-S296 PolarHBondContact O-N 3.35Å; F294-K297 PolarHBondContact O-N 2.96Å; F294-S298 PolarHBondContact O-N 3.11Å; F294-S298 PolarHBondContact O-OG 3.43Å; F294-S298 VanDerWaalsContact O-OG 3.11Å |
| 295 | V | 87.1 | Confident | 79.6 | Confident | 78 Ų | 78 | 108.4 Ų | 108.4 | 47% | 0.473 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -59.7 | -43.9 | 177.3 | 175.4 | 0 | 0 | 0 | 0 | 111.6 | E291 K292 K299 | E291-V295 WeakPolarHBondContact O-CG2 3.42Å; E291-V295 PolarHBondContact O-N 3.21Å; K292-V295 PolarHBondContact O-N 3.34Å; V295-K299 PolarHBondContact O-N 3.4Å |
| 296 | S | 82.5 | Confident | 76.9 | Confident | 73 Ų | 73 | 113.3 Ų | 113.3 | 51% | 0.51 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.1 | -41.9 | 175.7 | -64.6 | 0 | 0 | 0 | 0 | 112.7 | K292 F294 K299 N300 | K292-S296 PolarHBondContact O-N 3Å; K292-S296 PolarHBondContact O-OG 3.31Å; F294-S296 VanDerWaalsContact C-N 3.35Å; F294-S296 PolarHBondContact O-N 3.35Å; S296-K299 PolarHBondContact O-N 3.28Å; S296-N300 PolarHBondContact O-N 3.07Å |
| 297 | K | 77.2 | Confident | 75.9 | Confident | 140 Ų | 140 | 114 Ų | 114 | 61% | 0.609 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -69 | -38.3 | -179.9 | -169.9 | 167.5 | -177.3 | 175.8 | 0 | 112.3 | K293 F294 K299 N300 N301 | K293-K297 WeakPolarHBondContact O-CB 3.23Å; K293-K297 PolarHBondContact O-N 3.31Å; K293-K297 VanDerWaalsContact O-N 3.08Å; F294-K297 PolarHBondContact O-N 2.96Å; K297-K299 PolarHBondContact O-N 3.16Å; K297-N300 PolarHBondContact O-N 2.93Å; K297-N301 PolarHBondContact O-N 3.45Å |
| 298 | S | 70.7 | Confident | 74.7 | Confident | 81 Ų | 81 | 116.9 Ų | 116.9 | 57% | 0.566 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -64.7 | -37 | 177.1 | -60.5 | 0 | 0 | 0 | 0 | 112.8 | F294 N301 | F294-S298 PolarHBondContact O-N 3.11Å; F294-S298 PolarHBondContact O-OG 3.43Å; F294-S298 VanDerWaalsContact O-OG 3.11Å; S298-N301 PolarHBondContact O-N 3.4Å |
| 299 | K | 64.1 | Low | 73.4 | Confident | 148 Ų | 148 | 118.5 Ų | 118.5 | 64% | 0.643 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -65.4 | -39.2 | 177 | -73.8 | -173.9 | 175.7 | -166.7 | 0 | 113 | V295 S296 K297 N301 H302 | V295-K299 PolarHBondContact O-N 3.4Å; S296-K299 PolarHBondContact O-N 3.28Å; K297-K299 PolarHBondContact O-N 3.16Å; K299-N301 VanDerWaalsContact C-N 3.33Å; K299-N301 PolarHBondContact O-N 3.04Å; K299-H302 PolarHBondContact O-N 3.17Å |
| 300 | N | 59 | Low | 72 | Confident | 101 Ų | 101 | 121.1 Ų | 121.1 | 54% | 0.54 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -67.4 | -32.1 | 178.3 | -111.4 | 49.4 | 0 | 0 | 0 | 113.2 | S296 K297 H302 I303 | S296-N300 PolarHBondContact O-N 3.07Å; K297-N300 PolarHBondContact O-N 2.93Å; N300-H302 VanDerWaalsContact C-N 3.27Å; N300-H302 PolarHBondContact O-N 2.81Å; N300-I303 PolarHBondContact O-N 3.09Å |
| 301 | N | 57.7 | Low | 70.5 | Confident | 104 Ų | 104 | 121.3 Ų | 121.3 | 56% | 0.556 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -69 | -23.6 | -179.9 | -71.3 | -10.3 | 0 | 0 | 0 | 113.2 | K297 S298 K299 T305 | K297-N301 PolarHBondContact O-N 3.45Å; S298-N301 PolarHBondContact O-N 3.4Å; K299-N301 VanDerWaalsContact C-N 3.33Å; K299-N301 PolarHBondContact O-N 3.04Å; N301-T305 PolarHBondContact O-OG1 3.41Å |
| 302 | H | 53.9 | Low | 68.8 | Low | 153 Ų | 153 | 125.7 Ų | 125.7 | 71% | 0.708 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.8 | -17.3 | -178.5 | -167.9 | 38.9 | 0 | 0 | 0 | 113.5 | K299 N300 | K299-H302 PolarHBondContact O-N 3.17Å; N300-H302 VanDerWaalsContact C-N 3.27Å; N300-H302 PolarHBondContact O-N 2.81Å |
| 303 | I | 57.8 | Low | 66.9 | Low | 122 Ų | 122 | 123.9 Ų | 123.9 | 63% | 0.626 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.5 | -14.2 | -176 | -59.2 | 172.4 | 0 | 0 | 0 | 111.8 | N300 | N300-I303 PolarHBondContact O-N 3.09Š|
| 304 | H | 52.9 | Low | 64.8 | Low | 158 Ų | 158 | 122.4 Ų | 122.4 | 73% | 0.731 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.5 | 31.4 | 179.9 | -66.9 | -71 | 0 | 0 | 0 | 112.9 | ||
| 305 | T | 45.9 | Very low | 62.6 | Low | 112 Ų | 112 | 122.2 Ų | 122.2 | 69% | 0.687 | 65% | 0.654 | S | S | * | * | trans | -136.8 | 39.5 | -177.7 | -36.9 | 0 | 0 | 0 | 0 | 112.3 | N301 | N301-T305 PolarHBondContact O-OG1 3.41Š| ||
| 306 | T | 42.9 | Very low | 60.4 | Low | 196 Ų | 196 | 126.2 Ų | 126.2 | 100% | 1.202 | 67% | 0.671 | S | S | * | * | trans | -138.8 | 0 | 171.1 | 56.7 | 0 | 0 | 0 | 0 | 108.7 |
Retrieved 306 of 306 residues in 79.8 ms
(Link to these results)