| 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 | 42.2 | Very low | 36.6 | Very low | 253 Ų | 253 | 149.4 Ų | 149.4 | 100% | 1.246 | 88% | 0.88 | S | S | * | * | 0 | 96.1 | 0 | -67.5 | 172.6 | 177.9 | 0 | 0 | 107.1 | |||||
| 2 | A | 36.4 | Very low | 36.2 | Very low | 100 Ų | 100 | 145.4 Ų | 145.4 | 83% | 0.826 | 87% | 0.866 | S | S | * | * | trans | -125 | 122.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 3 | L | 38.3 | Very low | 36 | Very low | 183 Ų | 183 | 145 Ų | 145 | 96% | 0.958 | 87% | 0.865 | S | S | * | * | trans | -81.1 | 128.1 | -179.7 | -70.6 | 169.1 | 0 | 0 | 0 | 109.6 | ||||
| 4 | S | 35.3 | Very low | 35.8 | Very low | 113 Ų | 113 | 148.4 Ų | 148.4 | 79% | 0.79 | 86% | 0.864 | S | S | * | * | trans | -76.7 | 126.9 | 174.8 | 28.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 5 | G | 35 | Very low | 36.2 | Very low | 81 Ų | 81 | 146.2 Ų | 146.2 | 84% | 0.835 | 86% | 0.86 | S | S | * | * | trans | -104.7 | 115.1 | 164.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 6 | V | 39.7 | Very low | 36.4 | Very low | 139 Ų | 139 | 144.1 Ų | 144.1 | 84% | 0.842 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -88.9 | 132.2 | -175.2 | 176.4 | 0 | 0 | 0 | 0 | 110.3 | ||
| 7 | M | 34.6 | Very low | 36.2 | Very low | 182 Ų | 182 | 145.2 Ų | 145.2 | 90% | 0.897 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 144.6 | 170.8 | -81.2 | -163.5 | 169.1 | 0 | 0 | 112.3 | ||
| 8 | L | 37.7 | Very low | 36.1 | Very low | 169 Ų | 169 | 149.7 Ų | 149.7 | 89% | 0.885 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 147.5 | 172.3 | -63 | 163.6 | 0 | 0 | 0 | 112.2 | ||
| 9 | P | 37.8 | Very low | 36.4 | Very low | 103 Ų | 103 | 148.3 Ų | 148.3 | 67% | 0.669 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -97 | 134.1 | 164.4 | 33.9 | -26.5 | 0 | 0 | 0 | 112.3 | F11 | P9-F11 HydrophobicContact CG-CE2 4.34Š|
| 10 | S | 35.8 | Very low | 36.3 | Very low | 124 Ų | 124 | 147.8 Ų | 147.8 | 87% | 0.867 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 128.2 | 167.1 | -52.9 | 0 | 0 | 0 | 0 | 110.9 | ||
| 11 | F | 29.8 | Very low | 36 | Very low | 196 Ų | 196 | 144.6 Ų | 144.6 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -106.2 | 117.2 | 171.3 | -90.5 | -90.5 | 0 | 0 | 0 | 110.7 | P9 | P9-F11 HydrophobicContact CG-CE2 4.34Š| ||
| 12 | S | 32.1 | Very low | 35.8 | Very low | 102 Ų | 102 | 139.7 Ų | 139.7 | 71% | 0.713 | 77% | 0.77 | S | S | * | * | trans | -133.4 | 144 | 158.8 | 60.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 13 | T | 33.4 | Very low | 35.6 | Very low | 140 Ų | 140 | 139.8 Ų | 139.8 | 86% | 0.859 | 75% | 0.754 | S | S | * | * | trans | 88.5 | 87.4 | 171.5 | 68 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 14 | F | 32.9 | Very low | 35.4 | Very low | 193 Ų | 193 | 136.7 Ų | 136.7 | 85% | 0.846 | 74% | 0.738 | S | S | * | * | trans | -135.9 | 77 | 157.8 | -159.8 | -88.8 | 0 | 0 | 0 | 109.3 | ||||
| 15 | S | 42.3 | Very low | 35.3 | Very low | 115 Ų | 115 | 141 Ų | 141 | 80% | 0.804 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -166.1 | 59.4 | 167.6 | -80.7 | 0 | 0 | 0 | 0 | 110.9 | ||
| 16 | N | 38.9 | Very low | 35.4 | Very low | 112 Ų | 112 | 145.9 Ų | 145.9 | 60% | 0.599 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -156.1 | 12.7 | 166.5 | -117.5 | -58.6 | 0 | 0 | 0 | 114.9 | ||
| 17 | Q | 32.7 | Very low | 35.2 | Very low | 164 Ų | 164 | 147 Ų | 147 | 77% | 0.766 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -97.3 | -20.5 | 178.6 | -142.1 | 99.6 | 11.5 | 0 | 0 | 113.1 | ||
| 18 | R | 35.1 | Very low | 35 | Very low | 225 Ų | 225 | 140.6 Ų | 140.6 | 85% | 0.849 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -82 | -26.4 | -174.6 | -154.6 | 174.4 | -138 | -117.1 | 2.5 | 113.1 | ||
| 19 | E | 41.4 | Very low | 34.8 | Very low | 123 Ų | 123 | 138.5 Ų | 138.5 | 58% | 0.575 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -73.6 | -47 | -179.3 | -69.8 | -175.8 | 163.6 | 0 | 0 | 112.2 | S21 W22 | E19-S21 PolarHBondContact O-N 3.42Å; E19-S21 VanDerWaalsContact O-N 3.16Å; E19-W22 VanDerWaalsContact CA-CD1 3.47Å; E19-W22 PolarHBondContact O-N 3.07Å; E19-W22 PolarHBondContact O-NE1 3.21Å |
| 20 | K | 33.7 | Very low | 34.5 | Very low | 139 Ų | 139 | 140.3 Ų | 140.3 | 60% | 0.604 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -70.2 | -16.3 | 178.5 | -62.2 | 178.4 | -176.4 | 177.3 | 0 | 113.7 | N24 | K20-N24 PolarHBondContact O-ND2 2.92Å |
| 21 | S | 30.3 | Very low | 34.5 | Very low | 81 Ų | 81 | 141.4 Ų | 141.4 | 57% | 0.566 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -81.1 | -23.9 | -179.9 | -174 | 0 | 0 | 0 | 0 | 113.1 | E19 | E19-S21 PolarHBondContact O-N 3.42Å; E19-S21 VanDerWaalsContact O-N 3.16Å |
| 22 | W | 37.8 | Very low | 34.8 | Very low | 149 Ų | 149 | 140.5 Ų | 140.5 | 56% | 0.564 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -85.4 | -38.8 | 178.1 | 68.3 | -101.3 | 0 | 0 | 0 | 111.4 | E19 N24 R25 | E19-W22 VanDerWaalsContact CA-CD1 3.47Å; E19-W22 PolarHBondContact O-N 3.07Å; E19-W22 PolarHBondContact O-NE1 3.21Å; W22-N24 PolarHBondContact O-N 3.18Å; W22-R25 PolarHBondContact O-N 2.85Å |
| 23 | E | 33.5 | Very low | 34.8 | Very low | 102 Ų | 102 | 142.6 Ų | 142.6 | 48% | 0.477 | 69% | 0.69 | S | S | . | * | H | α-helix | trans | -62.1 | -38.4 | 177.6 | -76.7 | 168.2 | 137.4 | 0 | 0 | 113.1 | ||
| 24 | N | 32.9 | Very low | 34.7 | Very low | 118 Ų | 118 | 140.7 Ų | 140.7 | 63% | 0.631 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -79.4 | -21.7 | -176.2 | -71 | -44.2 | 0 | 0 | 0 | 114.2 | K20 W22 | K20-N24 PolarHBondContact O-ND2 2.92Å; W22-N24 PolarHBondContact O-N 3.18Å |
| 25 | R | 34 | Very low | 34.8 | Very low | 205 Ų | 205 | 137.8 Ų | 137.8 | 77% | 0.774 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -78.4 | -27.2 | 176.6 | 178.2 | 163.5 | -106 | 169.4 | -5.1 | 112.4 | W22 | W22-R25 PolarHBondContact O-N 2.85Å |
| 26 | W | 37.2 | Very low | 34.2 | Very low | 183 Ų | 183 | 138.2 Ų | 138.2 | 69% | 0.693 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -84 | -25.6 | 179.3 | -82 | 81.4 | 0 | 0 | 0 | 113.8 | ||
| 27 | K | 36 | Very low | 33.7 | Very low | 162 Ų | 162 | 138.2 Ų | 138.2 | 70% | 0.704 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -74 | -26.5 | -177.2 | -145.8 | 167.2 | -173 | 169.2 | 0 | 113.7 | ||
| 28 | G | 30.5 | Very low | 33.4 | Very low | 48 Ų | 48 | 136.5 Ų | 136.5 | 50% | 0.495 | 69% | 0.692 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.2 | -14.8 | -176.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 29 | D | 32.6 | Very low | 33 | Very low | 124 Ų | 124 | 131.2 Ų | 131.2 | 66% | 0.663 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -94.2 | -11.8 | -179.3 | -87.4 | -47 | 0 | 0 | 0 | 113.5 | ||
| 30 | M | 31.3 | Very low | 32.4 | Very low | 142 Ų | 142 | 134.4 Ų | 134.4 | 70% | 0.7 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -80.3 | -16.2 | 179 | -75.7 | -71.7 | 168.8 | 0 | 0 | 114 | K32 | M30-K32 VanDerWaalsContact C-N 3.29Å; M30-K32 PolarHBondContact O-N 2.66Å |
| 31 | D | 36 | Very low | 32.5 | Very low | 147 Ų | 147 | 135.5 Ų | 135.5 | 79% | 0.786 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -85.9 | 14.8 | -176.7 | -72.2 | -43.8 | 0 | 0 | 0 | 114.2 | ||
| 32 | K | 36.7 | Very low | 32.3 | Very low | 177 Ų | 177 | 140.7 Ų | 140.7 | 77% | 0.77 | 73% | 0.733 | S | S | * | * | G | 310 helix | trans | -127.2 | 13.5 | -174.7 | -69.2 | -170.2 | -178.7 | -175.1 | 0 | 116.7 | M30 | M30-K32 VanDerWaalsContact C-N 3.29Å; M30-K32 PolarHBondContact O-N 2.66Å |
| 33 | L | 31.6 | Very low | 31.9 | Very low | 146 Ų | 146 | 140.4 Ų | 140.4 | 76% | 0.764 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -110.1 | 137.1 | 175.2 | -72.7 | 164.2 | 0 | 0 | 0 | 111.4 | ||
| 34 | P | 30.8 | Very low | 31.7 | Very low | 100 Ų | 100 | 142.6 Ų | 142.6 | 65% | 0.649 | 76% | 0.762 | S | S | * | * | trans | -72.5 | 153.8 | -174.7 | 30.2 | -34.3 | 0 | 0 | 0 | 112 | T36 | P34-T36 PolarHBondContact O-N 3.21Š| ||
| 35 | P | 34.8 | Very low | 31.7 | Very low | 132 Ų | 132 | 144.5 Ų | 144.5 | 86% | 0.857 | 77% | 0.768 | S | S | * | * | trans | -79.6 | 107.2 | -178.5 | 32.1 | -29.8 | 0 | 0 | 0 | 109.2 | ||||
| 36 | T | 30.8 | Very low | 31.4 | Very low | 123 Ų | 123 | 140.7 Ų | 140.7 | 76% | 0.755 | 77% | 0.767 | S | S | * | * | trans | -116.1 | 121.7 | 165.5 | 52.6 | 0 | 0 | 0 | 0 | 110.9 | P34 | P34-T36 PolarHBondContact O-N 3.21Š| ||
| 37 | S | 28.1 | Very low | 31 | Very low | 113 Ų | 113 | 140.5 Ų | 140.5 | 79% | 0.79 | 78% | 0.779 | S | S | * | * | trans | 69.1 | 92.1 | 166.7 | 59.5 | 0 | 0 | 0 | 0 | 118.8 | S39 | S37-S39 PolarHBondContact O-N 2.82Š| ||
| 38 | C | 27 | Very low | 30.9 | Very low | 128 Ų | 128 | 139.8 Ų | 139.8 | 87% | 0.865 | 78% | 0.782 | S | S | * | * | -46.3 | 125 | 129.5 | -82.9 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 39 | S | 26.3 | Very low | 30.7 | Very low | 114 Ų | 114 | 143.5 Ų | 143.5 | 80% | 0.797 | 80% | 0.8 | S | S | * | * | trans | -178.6 | 91.3 | 134 | -79.7 | 0 | 0 | 0 | 0 | 109.2 | S37 | S37-S39 PolarHBondContact O-N 2.82Š| ||
| 40 | M | 29.4 | Very low | 30.5 | Very low | 189 Ų | 189 | 146 Ų | 146 | 93% | 0.931 | 81% | 0.807 | S | S | * | * | trans | -130.1 | 40.3 | 165.3 | -91.9 | -82.7 | -77.8 | 0 | 0 | 109.2 | ||||
| 41 | L | 35.2 | Very low | 30.7 | Very low | 162 Ų | 162 | 144.7 Ų | 144.7 | 85% | 0.848 | 81% | 0.812 | S | S | * | * | trans | -142.1 | 135.8 | 169.8 | -74.2 | 175.6 | 0 | 0 | 0 | 109.8 | ||||
| 42 | E | 26.7 | Very low | 30.3 | Very low | 190 Ų | 190 | 146.5 Ų | 146.5 | 89% | 0.888 | 81% | 0.813 | S | S | * | * | trans | 84 | 96.6 | 179 | -54.1 | -157.2 | 132.5 | 0 | 0 | 117.2 | ||||
| 43 | L | 29 | Very low | 30.2 | Very low | 143 Ų | 143 | 147.7 Ų | 147.7 | 75% | 0.749 | 82% | 0.818 | S | S | * | * | 172.5 | 98 | 98.1 | -151.1 | 100.2 | 0 | 0 | 0 | 111.5 | |||||
| 44 | V | 29.7 | Very low | 29.9 | Very low | 148 Ų | 148 | 146.7 Ų | 146.7 | 90% | 0.897 | 81% | 0.814 | S | S | * | * | trans | -142.5 | 111 | 133.7 | -179.9 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 45 | Q | 32.8 | Very low | 30 | Very low | 159 Ų | 159 | 148.5 Ų | 148.5 | 74% | 0.743 | 82% | 0.818 | S | S | * | * | trans | -71.8 | 131 | 173.7 | -77.8 | 172.9 | -25.2 | 0 | 0 | 110.8 | ||||
| 46 | T | 27.4 | Very low | 30.2 | Very low | 124 Ų | 124 | 150.5 Ų | 150.5 | 76% | 0.761 | 82% | 0.816 | S | S | * | * | trans | 51.2 | 97.6 | 141.5 | 59.9 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 47 | L | 27.8 | Very low | 30.3 | Very low | 179 Ų | 179 | 148.6 Ų | 148.6 | 94% | 0.937 | 80% | 0.801 | S | S | * | * | -137.2 | 127.9 | 125.5 | -80.2 | 177 | 0 | 0 | 0 | 108.7 | |||||
| 48 | D | 34 | Very low | 30.9 | Very low | 147 Ų | 147 | 149.9 Ų | 149.9 | 79% | 0.786 | 80% | 0.798 | S | S | * | * | trans | -41.8 | 130.8 | 176.5 | -99 | -75.2 | 0 | 0 | 0 | 114.2 | ||||
| 49 | C | 26.1 | Very low | 31.2 | Very low | 127 Ų | 127 | 147.8 Ų | 147.8 | 86% | 0.858 | 79% | 0.785 | S | S | * | * | -168.3 | 113.4 | 128.8 | -102.4 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 50 | Q | 29.7 | Very low | 31.6 | Very low | 175 Ų | 175 | 148.7 Ų | 148.7 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -21.1 | 122.9 | 162.3 | -69.6 | 155.2 | 2.5 | 0 | 0 | 117 | ||||
| 51 | S | 34.3 | Very low | 31.9 | Very low | 115 Ų | 115 | 145.3 Ų | 145.3 | 80% | 0.804 | 76% | 0.761 | S | S | * | * | trans | 20.6 | 101.7 | 134.1 | -168.1 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 52 | K | 27.8 | Very low | 31.9 | Very low | 185 Ų | 185 | 145.7 Ų | 145.7 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | trans | -136.1 | 115.2 | 140.9 | -93.3 | 175 | -173.2 | 159 | 0 | 109.2 | D54 | K52-D54 VanDerWaalsContact C-N 3.31Å; K52-D54 PolarHBondContact O-N 2.72Å; K52-D54 VanDerWaalsContact O-N 3.1Å | ||
| 53 | K | 34.1 | Very low | 32.5 | Very low | 202 Ų | 202 | 140.4 Ų | 140.4 | 88% | 0.878 | 74% | 0.741 | S | S | * | * | trans | -75.5 | 84.2 | 175.5 | -159.1 | -175.7 | -167.5 | 92.6 | 0 | 106.3 | ||||
| 54 | D | 25.9 | Very low | 33.1 | Very low | 125 Ų | 125 | 136.2 Ų | 136.2 | 67% | 0.668 | 72% | 0.719 | S | S | * | * | trans | -91.3 | 124.6 | 171.2 | -68.3 | -33.5 | 0 | 0 | 0 | 107.9 | K52 E56 | K52-D54 VanDerWaalsContact C-N 3.31Å; K52-D54 PolarHBondContact O-N 2.72Å; K52-D54 VanDerWaalsContact O-N 3.1Å; D54-E56 PolarHBondContact O-N 2.92Å | ||
| 55 | D | 34.3 | Very low | 33.6 | Very low | 139 Ų | 139 | 137.1 Ų | 137.1 | 74% | 0.743 | 72% | 0.719 | S | S | * | * | trans | -51.5 | 104.8 | -176.8 | -61.7 | -71 | 0 | 0 | 0 | 111.6 | D57 | D55-D57 PolarHBondContact O-N 2.77Š| ||
| 56 | E | 37.1 | Very low | 33.7 | Very low | 174 Ų | 174 | 135.6 Ų | 135.6 | 81% | 0.813 | 71% | 0.71 | S | S | * | * | trans | -65.1 | 86.3 | 164 | -69.5 | -67.6 | 134.1 | 0 | 0 | 107.9 | D54 L58 | D54-E56 PolarHBondContact O-N 2.92Å; E56-L58 VanDerWaalsContact C-N 3.25Å; E56-L58 PolarHBondContact O-N 2.85Å | ||
| 57 | D | 33.2 | Very low | 34.3 | Very low | 82 Ų | 82 | 132.4 Ų | 132.4 | 44% | 0.439 | 69% | 0.688 | S | S | . | * | trans | -62.5 | 90.9 | 170 | -82 | -37.5 | 0 | 0 | 0 | 108.6 | D55 S59 K314 | D55-D57 PolarHBondContact O-N 2.77Å; D57-S59 PolarHBondContact O-N 2.77Å; D57-K314 IonicContact OD2-NZ 3Å; D57-K314 PolarHBondContact OD2-NZ 2.82Å | ||
| 58 | L | 40.3 | Very low | 34.4 | Very low | 140 Ų | 140 | 131.7 Ų | 131.7 | 73% | 0.733 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | 39.9 | 170.7 | -130.7 | 133.3 | 0 | 0 | 0 | 111.9 | E56 F61 | E56-L58 VanDerWaalsContact C-N 3.25Å; E56-L58 PolarHBondContact O-N 2.85Å; L58-F61 HydrophobicContact CD2-CD2 4.33Å; L58-F61 HydrophobicContact CG-CD2 4.14Å |
| 59 | S | 33.9 | Very low | 34.5 | Very low | 85 Ų | 85 | 128.9 Ų | 128.9 | 59% | 0.594 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.2 | -1.6 | -175.4 | 67.7 | 0 | 0 | 0 | 0 | 114.7 | D57 | D57-S59 PolarHBondContact O-N 2.77Š|
| 60 | D | 34.2 | Very low | 34.7 | Very low | 132 Ų | 132 | 129.5 Ų | 129.5 | 71% | 0.706 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -103.2 | 9.1 | 177.2 | -68.2 | -14.7 | 0 | 0 | 0 | 112.8 | ||
| 61 | F | 36.6 | Very low | 34.8 | Very low | 118 Ų | 118 | 127.3 Ų | 127.3 | 52% | 0.518 | 67% | 0.669 | S | S | . | * | trans | -95.3 | 0.6 | -169 | -82.3 | -84.3 | 0 | 0 | 0 | 117 | L58 D63 L64 | L58-F61 HydrophobicContact CD2-CD2 4.33Å; L58-F61 HydrophobicContact CG-CD2 4.14Å; F61-D63 PolarHBondContact O-N 2.89Å; F61-L64 HydrophobicContact CD1-CB 4.18Å; F61-L64 HydrophobicContact CD1-CD1 3.31Å; F61-L64 HydrophobicContact CD1-CG 4.36Å; F61-L64 HydrophobicContact CE1-CD1 3.46Å; F61-L64 VanDerWaalsContact CE1-CD1 3.46Å; F61-L64 HydrophobicContact CG-CD1 4.12Å; F61-L64 HydrophobicContact CZ-CD1 4.36Å; F61-L64 PolarHBondContact O-N 3.43Å | ||
| 62 | L | 34.3 | Very low | 34.6 | Very low | 171 Ų | 171 | 128.8 Ų | 128.8 | 90% | 0.895 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | 14.9 | -174.7 | -64.2 | -179.1 | 0 | 0 | 0 | 116 | ||
| 63 | D | 39.5 | Very low | 34.6 | Very low | 78 Ų | 78 | 123.7 Ų | 123.7 | 42% | 0.417 | 67% | 0.674 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -139.6 | 10.9 | 175.5 | -85.1 | -65.6 | 0 | 0 | 0 | 113.2 | F61 T349 R353 | F61-D63 PolarHBondContact O-N 2.89Å; D63-T349 HydrophobicContact CB-CG2 4.07Å; D63-R353 IonicContact OD1-NH2 3.51Å; D63-R353 PolarHBondContact OD1-NH2 3.18Å; D63-R353 IonicContact OD2-CZ 2.85Å; D63-R353 IonicContact OD2-NH2 2.67Å; D63-R353 PolarHBondContact OD2-NH2 2.79Å |
| 64 | L | 42.1 | Very low | 34.4 | Very low | 56 Ų | 56 | 119.6 Ų | 119.6 | 29% | 0.293 | 67% | 0.67 | S | S | . | * | G | 310 helix | trans | -92.1 | -9 | -169.3 | -91.4 | 165.1 | 0 | 0 | 0 | 115.7 | F61 F66 | F61-L64 HydrophobicContact CD1-CB 4.18Å; F61-L64 HydrophobicContact CD1-CD1 3.31Å; F61-L64 HydrophobicContact CD1-CG 4.36Å; F61-L64 HydrophobicContact CE1-CD1 3.46Å; F61-L64 VanDerWaalsContact CE1-CD1 3.46Å; F61-L64 HydrophobicContact CG-CD1 4.12Å; F61-L64 HydrophobicContact CZ-CD1 4.36Å; F61-L64 PolarHBondContact O-N 3.43Å; L64-F66 PolarHBondContact O-N 3.2Å; L64-F66 VanDerWaalsContact O-N 3.09Å |
| 65 | D | 40.2 | Very low | 34.5 | Very low | 166 Ų | 166 | 120.2 Ų | 120.2 | 89% | 0.888 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -69.7 | -6 | 180 | -71.6 | -33.2 | 0 | 0 | 0 | 114.1 | ||
| 66 | F | 34.5 | Very low | 34.2 | Very low | 128 Ų | 128 | 119.1 Ų | 119.1 | 56% | 0.561 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -93.5 | -18.4 | -174.7 | -172.4 | -88.7 | 0 | 0 | 0 | 114.6 | L64 F352 T356 | L64-F66 PolarHBondContact O-N 3.2Å; L64-F66 VanDerWaalsContact O-N 3.09Å; F66-F352 HydrophobicContact CD1-CD1 4.11Å; F66-F352 HydrophobicContact CD1-CE1 4.19Å; F66-F352 AromaticContact CE1-CD1 3.38Å; F66-F352 HydrophobicContact CE1-CD1 3.38Å; F66-F352 AromaticContact CE1-CE1 3.08Å; F66-F352 HydrophobicContact CE1-CE1 3.08Å; F66-F352 HydrophobicContact CE1-CE2 4.42Å; F66-F352 HydrophobicContact CE1-CG 4.2Å; F66-F352 AromaticContact CE1-CZ 3.65Å; F66-F352 HydrophobicContact CE1-CZ 3.65Å; F66-F352 HydrophobicContact CZ-CD1 4.08Å; F66-F352 AromaticContact CZ-CE1 3.52Å; F66-F352 HydrophobicContact CZ-CE1 3.52Å; F66-F352 HydrophobicContact CZ-CZ 4.21Å; F66-T356 HydrophobicContact CZ-CG2 4.38Å |
| 67 | I | 40.2 | Very low | 33.7 | Very low | 56 Ų | 56 | 116.5 Ų | 116.5 | 29% | 0.287 | 67% | 0.673 | S | S | . | * | S | Bend | trans | -99.1 | -14.5 | -165.9 | -59.9 | -174.9 | 0 | 0 | 0 | 114.7 | S69 L348 | I67-S69 PolarHBondContact O-N 2.92Å; I67-L348 HydrophobicContact CD1-CD2 4.11Å; I67-L348 HydrophobicContact CD1-CG 4.24Å; I67-L348 HydrophobicContact CG2-CD2 4.42Å |
| 68 | L | 31.1 | Very low | 33.6 | Very low | 164 Ų | 164 | 119.5 Ų | 119.5 | 86% | 0.859 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | 10.8 | -171.1 | -80.4 | 166.9 | 0 | 0 | 0 | 116.7 | ||
| 69 | S | 34.8 | Very low | 33 | Very low | 88 Ų | 88 | 121.3 Ų | 121.3 | 62% | 0.615 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | -4.4 | -169.2 | -43.2 | 0 | 0 | 0 | 0 | 117.5 | I67 | I67-S69 PolarHBondContact O-N 2.92Š|
| 70 | N | 30.4 | Very low | 32.6 | Very low | 141 Ų | 141 | 127.8 Ų | 127.8 | 75% | 0.754 | 71% | 0.712 | S | S | * | * | trans | -140.8 | 85 | -176 | -82.7 | -10.8 | 0 | 0 | 0 | 113 | ||||
| 71 | T | 31.4 | Very low | 32.4 | Very low | 128 Ų | 128 | 127.8 Ų | 127.8 | 79% | 0.785 | 72% | 0.716 | S | S | * | * | trans | -137.1 | 92 | 156.7 | 57.8 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 72 | T | 30.6 | Very low | 32.1 | Very low | 146 Ų | 146 | 124.1 Ų | 124.1 | 90% | 0.896 | 71% | 0.712 | S | S | * | * | trans | -143.3 | 115.8 | 161.1 | 51.5 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 73 | G | 28.2 | Very low | 31.8 | Very low | 78 Ų | 78 | 122.6 Ų | 122.6 | 80% | 0.804 | 71% | 0.71 | S | S | * | * | trans | 102.3 | 105.9 | 139.4 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 74 | S | 29.8 | Very low | 31.2 | Very low | 116 Ų | 116 | 123.2 Ų | 123.2 | 81% | 0.811 | 73% | 0.726 | S | S | * | * | 166 | 100.9 | 117.8 | 62.3 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 75 | D | 27.6 | Very low | 30.7 | Very low | 138 Ų | 138 | 128.4 Ų | 128.4 | 74% | 0.738 | 75% | 0.754 | S | S | * | * | 76.8 | 117.7 | 86.9 | -162.5 | 19.1 | 0 | 0 | 0 | 114.1 | |||||
| 76 | S | 27.6 | Very low | 31 | Very low | 116 Ų | 116 | 125.7 Ų | 125.7 | 81% | 0.811 | 75% | 0.745 | S | S | * | * | trans | -161.5 | 98.5 | 160.9 | -65.4 | 0 | 0 | 0 | 0 | 107 | ||||
| 77 | T | 28.1 | Very low | 30.8 | Very low | 120 Ų | 120 | 127.1 Ų | 127.1 | 74% | 0.736 | 76% | 0.759 | S | S | * | * | trans | -53.5 | 132.5 | 169.4 | 45.8 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 78 | V | 31.1 | Very low | 30.3 | Very low | 144 Ų | 144 | 132.3 Ų | 132.3 | 87% | 0.873 | 78% | 0.784 | S | S | * | * | trans | -134 | 124 | 154.6 | -174.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 79 | E | 27.6 | Very low | 30.2 | Very low | 179 Ų | 179 | 135.1 Ų | 135.1 | 84% | 0.836 | 79% | 0.785 | S | S | * | * | trans | -63.3 | 146 | -175.5 | -62.9 | -179.1 | 144.4 | 0 | 0 | 112.6 | ||||
| 80 | Y | 24.8 | Very low | 29.9 | Very low | 220 Ų | 220 | 136.6 Ų | 136.6 | 86% | 0.863 | 79% | 0.79 | S | S | * | * | trans | -95.1 | 125.5 | 171.1 | -166 | -91.1 | 0 | 0 | 0 | 108.6 | ||||
| 81 | V | 31 | Very low | 29.8 | Very low | 132 Ų | 132 | 135.1 Ų | 135.1 | 80% | 0.8 | 79% | 0.786 | S | S | * | * | trans | -133.1 | 123.4 | 158.4 | -176.8 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 82 | G | 29 | Very low | 29.7 | Very low | 41 Ų | 41 | 135.4 Ų | 135.4 | 42% | 0.423 | 79% | 0.788 | S | S | . | * | trans | -65.3 | 176.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 83 | T | 27.8 | Very low | 29.6 | Very low | 140 Ų | 140 | 131.9 Ų | 131.9 | 86% | 0.859 | 78% | 0.78 | S | S | * | * | cis | -169.2 | 165.8 | 39 | 39.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 84 | A | 27.9 | Very low | 29.8 | Very low | 90 Ų | 90 | 136.2 Ų | 136.2 | 74% | 0.744 | 79% | 0.785 | S | S | * | * | trans | 76.2 | 94.2 | 149.5 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 85 | D | 31.3 | Very low | 29.8 | Very low | 165 Ų | 165 | 136.3 Ų | 136.3 | 88% | 0.882 | 79% | 0.786 | S | S | * | * | 29.1 | 156.7 | 115.7 | -82.3 | -20.1 | 0 | 0 | 0 | 123.9 | |||||
| 86 | P | 46.3 | Very low | 30.1 | Very low | 109 Ų | 109 | 136.2 Ų | 136.2 | 71% | 0.708 | 79% | 0.79 | S | S | * | * | trans | -105.6 | 162.7 | -138.9 | 40.1 | -34.2 | 0 | 0 | 0 | 114 | ||||
| 87 | N | 30.8 | Very low | 30.7 | Very low | 159 Ų | 159 | 135.5 Ų | 135.5 | 85% | 0.85 | 78% | 0.782 | S | S | * | * | trans | -154.3 | 143.2 | 154.2 | -118.6 | -26.6 | 0 | 0 | 0 | 116.3 | ||||
| 88 | M | 28.6 | Very low | 30.7 | Very low | 165 Ų | 165 | 138.4 Ų | 138.4 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | trans | -55.5 | 146.2 | 174 | -79.4 | -175.9 | 140 | 0 | 0 | 114.6 | ||||
| 89 | Y | 29.9 | Very low | 30.7 | Very low | 223 Ų | 223 | 142.2 Ų | 142.2 | 88% | 0.875 | 79% | 0.788 | S | S | * | * | -159.5 | 155 | 125.1 | 34.8 | -97.9 | 0 | 0 | 0 | 112.1 | |||||
| 90 | T | 28.7 | Very low | 31.4 | Very low | 118 Ų | 118 | 139.5 Ų | 139.5 | 72% | 0.724 | 79% | 0.786 | S | S | * | * | trans | -86 | 176.1 | -165.4 | 48.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 91 | T | 28.5 | Very low | 31.6 | Very low | 111 Ų | 111 | 132.9 Ų | 132.9 | 68% | 0.681 | 78% | 0.776 | S | S | * | * | trans | 108.9 | 103.2 | 137.9 | -58 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 92 | T | 29.3 | Very low | 31.6 | Very low | 134 Ų | 134 | 134.4 Ų | 134.4 | 82% | 0.822 | 78% | 0.775 | S | S | * | * | trans | 45.7 | 143.1 | 134.2 | 68.3 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 93 | G | 27.8 | Very low | 31.6 | Very low | 71 Ų | 71 | 138.5 Ų | 138.5 | 73% | 0.732 | 79% | 0.787 | S | S | * | * | trans | 141.5 | 105.2 | 132.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 94 | N | 31.8 | Very low | 31.9 | Very low | 170 Ų | 170 | 140.5 Ų | 140.5 | 91% | 0.909 | 79% | 0.786 | S | S | * | * | trans | -54 | 141.1 | 166.1 | -74.8 | -31.8 | 0 | 0 | 0 | 112.4 | ||||
| 95 | S | 30.7 | Very low | 32.1 | Very low | 117 Ų | 117 | 147.8 Ų | 147.8 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -164 | 126 | 139.1 | 40.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 96 | V | 32.8 | Very low | 32.2 | Very low | 136 Ų | 136 | 145.4 Ų | 145.4 | 82% | 0.824 | 79% | 0.791 | S | S | * | * | trans | -77.9 | 142.8 | 159.4 | 170.6 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 97 | P | 40.3 | Very low | 32.1 | Very low | 101 Ų | 101 | 145.6 Ų | 145.6 | 66% | 0.656 | 79% | 0.792 | S | S | * | * | -157.1 | 164.4 | 83.8 | 39.2 | -16.4 | 0 | 0 | 0 | 119.9 | |||||
| 98 | Q | 28.2 | Very low | 32.6 | Very low | 181 Ų | 181 | 143.7 Ų | 143.7 | 85% | 0.846 | 79% | 0.789 | S | S | * | * | trans | 74.7 | 121.6 | 143.7 | -82.9 | 162.3 | -41.8 | 0 | 0 | 121.6 | ||||
| 99 | Y | 30.5 | Very low | 33.1 | Very low | 224 Ų | 224 | 141.5 Ų | 141.5 | 88% | 0.878 | 79% | 0.786 | S | S | * | * | trans | -67.4 | 159.6 | 160.1 | -65.4 | -86.3 | 0 | 0 | 0 | 111.6 | ||||
| 100 | P | 43.6 | Very low | 33.9 | Very low | 122 Ų | 122 | 136.7 Ų | 136.7 | 79% | 0.792 | 78% | 0.783 | S | S | * | * | -145.5 | 146.7 | 85.6 | 35 | -16.1 | 0 | 0 | 0 | 116.9 | |||||
| 101 | A | 29.6 | Very low | 34.4 | Very low | 81 Ų | 81 | 142.4 Ų | 142.4 | 67% | 0.669 | 79% | 0.793 | S | S | * | * | trans | 54.1 | 145.3 | 133.4 | 0 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 102 | E | 30.3 | Very low | 34.4 | Very low | 165 Ų | 165 | 141.1 Ų | 141.1 | 77% | 0.771 | 80% | 0.802 | S | S | * | * | trans | 89.1 | 112.6 | 156.6 | -48.2 | -56 | 95 | 0 | 0 | 121.6 | ||||
| 103 | D | 29.1 | Very low | 34.7 | Very low | 127 Ų | 127 | 139.5 Ų | 139.5 | 68% | 0.679 | 80% | 0.802 | S | S | * | * | trans | 40.1 | 119.1 | 135.7 | -86.2 | -35.2 | 0 | 0 | 0 | 121.6 | ||||
| 104 | H | 34.6 | Very low | 34.9 | Very low | 181 Ų | 181 | 142.3 Ų | 142.3 | 84% | 0.838 | 81% | 0.81 | S | S | * | * | -179.1 | 104.1 | 107.3 | -87.7 | -59.6 | 0 | 0 | 0 | 110.2 | |||||
| 105 | R | 32.4 | Very low | 34.8 | Very low | 243 Ų | 243 | 141.5 Ų | 141.5 | 92% | 0.917 | 81% | 0.805 | S | S | * | * | trans | -77.8 | 128.6 | 157.2 | -109.8 | 177.4 | -178.3 | 171.9 | 1.5 | 108.1 | ||||
| 106 | S | 32.9 | Very low | 34.8 | Very low | 116 Ų | 116 | 144.6 Ų | 144.6 | 81% | 0.811 | 81% | 0.809 | S | S | * | * | trans | -145.5 | 140.4 | 147.5 | -84.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 107 | P | 43.8 | Very low | 34.8 | Very low | 113 Ų | 113 | 144.5 Ų | 144.5 | 73% | 0.734 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -90.5 | 167.5 | -170 | 37.2 | -36.7 | 0 | 0 | 0 | 113.5 | ||
| 108 | P | 41 | Very low | 34.4 | Very low | 119 Ų | 119 | 148 Ų | 148 | 77% | 0.773 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 155.1 | 170 | 32.4 | -33.4 | 0 | 0 | 0 | 112.8 | ||
| 109 | P | 40.2 | Very low | 34.5 | Very low | 118 Ų | 118 | 145.3 Ų | 145.3 | 77% | 0.766 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 155 | -166.3 | 32.2 | -36 | 0 | 0 | 0 | 115 | ||
| 110 | P | 46.2 | Very low | 34.6 | Very low | 122 Ų | 122 | 143.3 Ų | 143.3 | 79% | 0.792 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -89.7 | 148.7 | 175.1 | 34.9 | -31.6 | 0 | 0 | 0 | 113.3 | ||
| 111 | Y | 38.3 | Very low | 34.1 | Very low | 239 Ų | 239 | 148.3 Ų | 148.3 | 94% | 0.937 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 134.7 | 173 | -73.5 | -93.1 | 0 | 0 | 0 | 111.9 | ||
| 112 | G | 29.9 | Very low | 34.1 | Very low | 84 Ų | 84 | 149.4 Ų | 149.4 | 87% | 0.866 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 138.8 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 113 | A | 33.7 | Very low | 34.2 | Very low | 100 Ų | 100 | 149 Ų | 149 | 83% | 0.826 | 82% | 0.819 | S | S | * | * | trans | -124.9 | 134.7 | 154.6 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 114 | S | 32.2 | Very low | 34.2 | Very low | 129 Ų | 129 | 146.2 Ų | 146.2 | 90% | 0.902 | 82% | 0.821 | S | S | * | * | trans | -68.2 | 137.7 | -167.1 | -160.5 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 115 | L | 30.1 | Very low | 34.7 | Very low | 154 Ų | 154 | 143.8 Ų | 143.8 | 81% | 0.806 | 82% | 0.821 | S | S | * | * | trans | -76.2 | 136.1 | 171 | -79.9 | 157.2 | 0 | 0 | 0 | 111.2 | ||||
| 116 | M | 31.3 | Very low | 34.6 | Very low | 182 Ų | 182 | 136.4 Ų | 136.4 | 90% | 0.897 | 81% | 0.812 | S | S | * | * | trans | -152.3 | 102.2 | 137.2 | -86.9 | -58.7 | 179.1 | 0 | 0 | 107.7 | ||||
| 117 | T | 32.3 | Very low | 34.4 | Very low | 134 Ų | 134 | 133.5 Ų | 133.5 | 82% | 0.822 | 80% | 0.8 | S | S | * | * | trans | -170.8 | 107.8 | 141.9 | -59.2 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 118 | E | 32 | Very low | 33.8 | Very low | 175 Ų | 175 | 138.7 Ų | 138.7 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | trans | -89.9 | 114.9 | 161.9 | -91.7 | -114.6 | 107.4 | 0 | 0 | 109.5 | ||||
| 119 | L | 31.4 | Very low | 33.2 | Very low | 123 Ų | 123 | 136.7 Ų | 136.7 | 64% | 0.644 | 81% | 0.808 | S | S | * | * | trans | 19.6 | 128 | 134.2 | -61.4 | 168.7 | 0 | 0 | 0 | 119.9 | ||||
| 120 | L | 32.7 | Very low | 32.8 | Very low | 182 Ų | 182 | 137.7 Ų | 137.7 | 95% | 0.953 | 81% | 0.812 | S | S | * | * | -135.7 | 130.2 | 121.7 | -86.4 | 174.7 | 0 | 0 | 0 | 110.1 | |||||
| 121 | R | 31.4 | Very low | 32.2 | Very low | 228 Ų | 228 | 137.8 Ų | 137.8 | 86% | 0.86 | 81% | 0.81 | S | S | * | * | trans | -85.7 | 153.2 | 175.3 | -89.5 | 177 | 171.7 | -176 | -2.2 | 111.3 | ||||
| 122 | S | 30.3 | Very low | 31.9 | Very low | 104 Ų | 104 | 138.4 Ų | 138.4 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | trans | 149.3 | 134.5 | 145.4 | 44.4 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 123 | D | 31.4 | Very low | 31.9 | Very low | 156 Ų | 156 | 142 Ų | 142 | 83% | 0.834 | 81% | 0.81 | S | S | * | * | cis | -155.8 | 155.9 | 2.4 | -89.4 | -49.7 | 0 | 0 | 0 | 106.2 | ||||
| 124 | G | 29.1 | Very low | 32.3 | Very low | 69 Ų | 69 | 142.8 Ų | 142.8 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | trans | -74 | -164.5 | 166 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 125 | P | 46 | Very low | 32.1 | Very low | 130 Ų | 130 | 140 Ų | 140 | 84% | 0.844 | 80% | 0.798 | S | S | * | * | cis | -145.5 | -157.3 | 9.7 | 40.9 | -18.5 | 0 | 0 | 0 | 114.2 | ||||
| 126 | A | 31.2 | Very low | 32.3 | Very low | 88 Ų | 88 | 139.8 Ų | 139.8 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | trans | 92.1 | 105.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 127 | G | 28.2 | Very low | 32.5 | Very low | 55 Ų | 55 | 140.4 Ų | 140.4 | 57% | 0.567 | 80% | 0.804 | S | S | * | * | 84.1 | 125.2 | 85.4 | 0 | 0 | 0 | 0 | 0 | 106.3 | |||||
| 128 | Y | 30.5 | Very low | 32.4 | Very low | 221 Ų | 221 | 137.2 Ų | 137.2 | 87% | 0.867 | 80% | 0.798 | S | S | * | * | -169.9 | 138 | 55.1 | -0.8 | -91.8 | 0 | 0 | 0 | 105.7 | |||||
| 129 | G | 28.3 | Very low | 32.6 | Very low | 78 Ų | 78 | 139.9 Ų | 139.9 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | trans | -76.5 | 137.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 130 | V | 32.9 | Very low | 32.4 | Very low | 138 Ų | 138 | 143.7 Ų | 143.7 | 84% | 0.836 | 81% | 0.812 | S | S | * | * | trans | -143.6 | 120.2 | 151.9 | 179.5 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 131 | T | 33 | Very low | 32.3 | Very low | 125 Ų | 125 | 143.9 Ų | 143.9 | 77% | 0.767 | 81% | 0.806 | S | S | * | * | trans | -72 | 138.5 | 165.1 | 46.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 132 | R | 31.8 | Very low | 32.4 | Very low | 251 Ų | 251 | 139.8 Ų | 139.8 | 95% | 0.947 | 81% | 0.805 | S | S | * | * | trans | -177.4 | 152.6 | 138.9 | -99.4 | 162.9 | -170.3 | -157.4 | 3.4 | 112.6 | ||||
| 133 | N | 30.6 | Very low | 32.2 | Very low | 160 Ų | 160 | 141.8 Ų | 141.8 | 86% | 0.856 | 81% | 0.808 | S | S | * | * | trans | -74.4 | 173.1 | -159 | -112.4 | -29.4 | 0 | 0 | 0 | 115.6 | ||||
| 134 | P | 41.4 | Very low | 32.3 | Very low | 116 Ų | 116 | 141.4 Ų | 141.4 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | trans | -86.4 | 158.4 | -168.2 | 36.8 | -36.1 | 0 | 0 | 0 | 113.2 | ||||
| 135 | G | 28.1 | Very low | 32.3 | Very low | 70 Ų | 70 | 142.5 Ų | 142.5 | 72% | 0.722 | 81% | 0.814 | S | S | * | * | trans | 127.6 | 110.7 | 161.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 136 | V | 34.5 | Very low | 32.2 | Very low | 150 Ų | 150 | 141.2 Ų | 141.2 | 91% | 0.909 | 81% | 0.805 | S | S | * | * | 163.7 | 134.7 | 123.7 | 169 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 137 | Q | 34.8 | Very low | 32 | Very low | 195 Ų | 195 | 145.3 Ų | 145.3 | 91% | 0.911 | 81% | 0.807 | S | S | * | * | trans | -65.3 | 147.6 | -178.7 | -63.4 | 165.4 | -2.5 | 0 | 0 | 112.2 | ||||
| 138 | G | 30.7 | Very low | 32.4 | Very low | 67 Ų | 67 | 148.4 Ų | 148.4 | 69% | 0.691 | 82% | 0.817 | S | S | * | * | trans | -175.2 | 102.5 | 166.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 139 | R | 35.6 | Very low | 32.6 | Very low | 232 Ų | 232 | 147.2 Ų | 147.2 | 88% | 0.875 | 81% | 0.811 | S | S | * | * | trans | -71.5 | 128.5 | 165.1 | -84.7 | 175.7 | 160.5 | 171.1 | -5.7 | 108.9 | ||||
| 140 | F | 28.5 | Very low | 32.9 | Very low | 203 Ų | 203 | 149.7 Ų | 149.7 | 89% | 0.89 | 81% | 0.813 | S | S | * | * | trans | -131.9 | 125.5 | 158.1 | -84.1 | -85.2 | 0 | 0 | 0 | 109.5 | ||||
| 141 | F | 30 | Very low | 32.8 | Very low | 186 Ų | 186 | 149.2 Ų | 149.2 | 82% | 0.816 | 81% | 0.806 | S | S | * | * | trans | -85.2 | 137.3 | 167 | -86.3 | -96 | 0 | 0 | 0 | 108.9 | ||||
| 142 | V | 33.6 | Very low | 32.7 | Very low | 141 Ų | 141 | 150.6 Ų | 150.6 | 86% | 0.855 | 81% | 0.809 | S | S | * | * | trans | -139.4 | 128.6 | 152.9 | -163.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 143 | N | 27.2 | Very low | 32.7 | Very low | 147 Ų | 147 | 146.3 Ų | 146.3 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | trans | -76.7 | 142.6 | 177.6 | -82.5 | -53.7 | 0 | 0 | 0 | 112 | ||||
| 144 | T | 31.6 | Very low | 32.7 | Very low | 148 Ų | 148 | 147.3 Ų | 147.3 | 91% | 0.908 | 80% | 0.8 | S | S | * | * | trans | -153.9 | 130.5 | 143.7 | 14 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 145 | A | 30 | Very low | 32.4 | Very low | 92 Ų | 92 | 149.2 Ų | 149.2 | 76% | 0.76 | 80% | 0.802 | S | S | * | * | trans | -96.2 | -169.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 146 | P | 43.5 | Very low | 32.4 | Very low | 102 Ų | 102 | 152.8 Ų | 152.8 | 66% | 0.662 | 80% | 0.799 | S | S | * | * | -133.6 | 173.9 | -72.3 | 36.2 | -18.2 | 0 | 0 | 0 | 115.8 | |||||
| 147 | F | 27.3 | Very low | 32.4 | Very low | 174 Ų | 174 | 151.3 Ų | 151.3 | 76% | 0.763 | 79% | 0.793 | S | S | * | * | trans | 80 | 156.2 | 159.4 | -70.4 | -69.7 | 0 | 0 | 0 | 120.7 | ||||
| 148 | P | 36.8 | Very low | 32.1 | Very low | 120 Ų | 120 | 146.8 Ų | 146.8 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | cis | -127.4 | 163.2 | 12.5 | 35.1 | -15.4 | 0 | 0 | 0 | 117.8 | ||||
| 149 | R | 33.6 | Very low | 32.2 | Very low | 196 Ų | 196 | 151.7 Ų | 151.7 | 74% | 0.74 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 152.2 | 167 | -61.9 | 177.7 | 177.1 | -158.1 | -1.7 | 110.2 | ||
| 150 | P | 35.2 | Very low | 32.2 | Very low | 130 Ų | 130 | 147.9 Ų | 147.9 | 84% | 0.844 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -97.9 | 122.2 | 151.5 | 11.5 | 7.1 | 0 | 0 | 0 | 110 | ||
| 151 | D | 30.5 | Very low | 32.3 | Very low | 129 Ų | 129 | 143.4 Ų | 143.4 | 69% | 0.69 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 156.6 | 173.9 | -71.2 | -47.7 | 0 | 0 | 0 | 112.7 | ||
| 152 | N | 30.9 | Very low | 32.6 | Very low | 154 Ų | 154 | 144.8 Ų | 144.8 | 82% | 0.824 | 79% | 0.788 | S | S | * | * | trans | 69.7 | 87.5 | 157.1 | -70.2 | -29 | 0 | 0 | 0 | 119.1 | ||||
| 153 | I | 33.2 | Very low | 32.4 | Very low | 160 Ų | 160 | 141.1 Ų | 141.1 | 82% | 0.821 | 78% | 0.779 | S | S | * | * | trans | -118.3 | 114.6 | 140.2 | -61.5 | 176.5 | 0 | 0 | 0 | 108 | I155 | I153-I155 PolarHBondContact O-N 3.13Š| ||
| 154 | K | 30.7 | Very low | 33 | Very low | 182 Ų | 182 | 140.2 Ų | 140.2 | 79% | 0.791 | 78% | 0.781 | S | S | * | * | trans | -64.1 | 105 | 173.6 | -170.3 | 175.6 | -178.8 | -170.5 | 0 | 108.4 | ||||
| 155 | I | 33.3 | Very low | 33.2 | Very low | 156 Ų | 156 | 139.9 Ų | 139.9 | 80% | 0.8 | 78% | 0.779 | S | S | * | * | trans | -92.7 | 102.3 | 170.8 | -57.2 | 176.2 | 0 | 0 | 0 | 106.9 | I153 | I153-I155 PolarHBondContact O-N 3.13Š| ||
| 156 | E | 27.9 | Very low | 33.3 | Very low | 144 Ų | 144 | 144.1 Ų | 144.1 | 67% | 0.673 | 79% | 0.785 | S | S | * | * | trans | -66.7 | 144 | 162 | -64 | -162.9 | 157.9 | 0 | 0 | 109.4 | A158 | E156-A158 PolarHBondContact O-N 3.26Å; E156-A158 VanDerWaalsContact O-N 3.12Å | ||
| 157 | P | 35.5 | Very low | 32.8 | Very low | 120 Ų | 120 | 142.2 Ų | 142.2 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | trans | -70 | 112.1 | 179.9 | 27.3 | -31.7 | 0 | 0 | 0 | 110.1 | M159 | P157-M159 PolarHBondContact O-N 2.74Å; P157-M159 VanDerWaalsContact O-N 3.17Å | ||
| 158 | A | 29 | Very low | 33 | Very low | 99 Ų | 99 | 143 Ų | 143 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -60.6 | 116.1 | 169 | 0 | 0 | 0 | 0 | 0 | 109.4 | E156 | E156-A158 PolarHBondContact O-N 3.26Å; E156-A158 VanDerWaalsContact O-N 3.12Å | ||
| 159 | M | 33.3 | Very low | 32.8 | Very low | 170 Ų | 170 | 143 Ų | 143 | 84% | 0.837 | 79% | 0.79 | S | S | * | * | trans | -62.3 | 130 | 169 | -71.8 | -93.2 | 170.4 | 0 | 0 | 109.3 | P157 S161 | P157-M159 PolarHBondContact O-N 2.74Å; P157-M159 VanDerWaalsContact O-N 3.17Å; M159-S161 PolarHBondContact O-N 3.15Å | ||
| 160 | D | 33.7 | Very low | 32.7 | Very low | 152 Ų | 152 | 139.6 Ų | 139.6 | 81% | 0.813 | 79% | 0.793 | S | S | * | * | trans | -63.7 | 82.6 | 165.2 | -73.2 | -49.6 | 0 | 0 | 0 | 109.5 | Y162 | D160-Y162 PolarHBondContact O-N 3.3Š| ||
| 161 | S | 30.5 | Very low | 32.7 | Very low | 110 Ų | 110 | 142 Ų | 142 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | -86.9 | 82.6 | 172.4 | 64.4 | 0 | 0 | 0 | 0 | 110.1 | M159 G163 | M159-S161 PolarHBondContact O-N 3.15Å; S161-G163 PolarHBondContact O-N 3.35Å | ||
| 162 | Y | 37.7 | Very low | 32.8 | Very low | 215 Ų | 215 | 140.8 Ų | 140.8 | 84% | 0.843 | 79% | 0.794 | S | S | * | * | trans | -77.4 | 105.1 | 156.9 | -76.6 | -81 | 0 | 0 | 0 | 107.9 | D160 | D160-Y162 PolarHBondContact O-N 3.3Š| ||
| 163 | G | 29.6 | Very low | 32.5 | Very low | 64 Ų | 64 | 139.9 Ų | 139.9 | 66% | 0.66 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 147.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | S161 | S161-G163 PolarHBondContact O-N 3.35Š|
| 164 | P | 39.8 | Very low | 32.5 | Very low | 127 Ų | 127 | 137 Ų | 137 | 83% | 0.825 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 137.2 | -178.1 | 28.8 | -31.9 | 0 | 0 | 0 | 111.9 | M166 | P164-M166 PolarHBondContact O-N 3.19Š|
| 165 | V | 34.8 | Very low | 32.4 | Very low | 142 Ų | 142 | 138.4 Ų | 138.4 | 86% | 0.861 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 126.7 | 167.4 | 175.9 | 0 | 0 | 0 | 0 | 109 | G167 | V165-G167 PolarHBondContact O-N 2.77Š|
| 166 | M | 33.2 | Very low | 32.4 | Very low | 181 Ų | 181 | 138.2 Ų | 138.2 | 89% | 0.892 | 80% | 0.798 | S | S | * | * | trans | -59.6 | 94.6 | 172.6 | -76.9 | -83 | -91.4 | 0 | 0 | 110 | P164 | P164-M166 PolarHBondContact O-N 3.19Š| ||
| 167 | G | 31.4 | Very low | 32.5 | Very low | 62 Ų | 62 | 139.5 Ų | 139.5 | 64% | 0.639 | 80% | 0.801 | S | S | * | * | trans | -76.7 | 112.6 | 158.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | V165 V169 | V165-G167 PolarHBondContact O-N 2.77Å; G167-V169 PolarHBondContact O-N 3.47Å; G167-V169 VanDerWaalsContact O-N 3.12Å | ||
| 168 | M | 31.5 | Very low | 32.5 | Very low | 191 Ų | 191 | 142.4 Ų | 142.4 | 94% | 0.941 | 80% | 0.804 | S | S | * | * | trans | -64.4 | 108.7 | 165.1 | -71.8 | -178.5 | 166.8 | 0 | 0 | 108.4 | ||||
| 169 | V | 32.6 | Very low | 32.7 | Very low | 120 Ų | 120 | 145.3 Ų | 145.3 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | trans | -87.7 | 124.1 | 164.9 | 177.4 | 0 | 0 | 0 | 0 | 107.1 | G167 Q171 | G167-V169 PolarHBondContact O-N 3.47Å; G167-V169 VanDerWaalsContact O-N 3.12Å; V169-Q171 PolarHBondContact O-N 3.19Å | ||
| 170 | P | 32.5 | Very low | 32.7 | Very low | 123 Ų | 123 | 140.7 Ų | 140.7 | 80% | 0.799 | 80% | 0.797 | S | S | * | * | trans | -71 | 114.8 | 168.1 | 27 | -28.3 | 0 | 0 | 0 | 108.4 | ||||
| 171 | Q | 34.7 | Very low | 32.5 | Very low | 182 Ų | 182 | 141.5 Ų | 141.5 | 85% | 0.85 | 80% | 0.802 | S | S | * | * | trans | -69.4 | 138.4 | 172 | -74.7 | -175.6 | -7.3 | 0 | 0 | 110.6 | V169 | V169-Q171 PolarHBondContact O-N 3.19Š| ||
| 172 | S | 31.8 | Very low | 32.7 | Very low | 102 Ų | 102 | 142.9 Ų | 142.9 | 71% | 0.713 | 81% | 0.805 | S | S | * | * | trans | -40.3 | 127.5 | 175 | 48 | 0 | 0 | 0 | 0 | 115.2 | S174 | S172-S174 PolarHBondContact O-N 3.32Š| ||
| 173 | C | 25.4 | Very low | 32.2 | Very low | 136 Ų | 136 | 137.4 Ų | 137.4 | 92% | 0.919 | 80% | 0.798 | S | S | * | * | trans | -73.7 | 111.4 | 168.1 | -159.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 174 | S | 33.6 | Very low | 32 | Very low | 100 Ų | 100 | 139.7 Ų | 139.7 | 70% | 0.699 | 80% | 0.803 | S | S | * | * | trans | -89.8 | 124.7 | 170.8 | -63 | 0 | 0 | 0 | 0 | 109.3 | S172 I176 | S172-S174 PolarHBondContact O-N 3.32Å; S174-I176 PolarHBondContact O-N 3.21Å | ||
| 175 | K | 29 | Very low | 31.5 | Very low | 210 Ų | 210 | 141.9 Ų | 141.9 | 91% | 0.913 | 80% | 0.804 | S | S | * | * | trans | -49.1 | 123.3 | 174.2 | -86 | 165.9 | 172.9 | 166.9 | 0 | 111.6 | ||||
| 176 | I | 32.3 | Very low | 31.4 | Very low | 153 Ų | 153 | 142.7 Ų | 142.7 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | -125.4 | 117.7 | 149.1 | -60.1 | 177.5 | 0 | 0 | 0 | 106.9 | S174 Q178 | S174-I176 PolarHBondContact O-N 3.21Å; I176-Q178 HydrophobicContact CG2-CG 4.42Å | ||
| 177 | K | 30.8 | Very low | 31.2 | Very low | 171 Ų | 171 | 139.4 Ų | 139.4 | 74% | 0.743 | 80% | 0.795 | S | S | * | * | trans | -80.8 | 114.8 | 174.3 | -167.5 | -173.7 | -176 | -144 | 0 | 106.7 | E179 | K177-E179 WeakPolarHBondContact CE-OE1 3.49Å; K177-E179 IonicContact NZ-OE1 3.45Å; K177-E179 PolarHBondContact NZ-OE1 3.47Å | ||
| 178 | Q | 36 | Very low | 31.2 | Very low | 181 Ų | 181 | 145.6 Ų | 145.6 | 85% | 0.846 | 81% | 0.805 | S | S | * | * | trans | -130 | 122.8 | 156.8 | -73.1 | -153.7 | -7.4 | 0 | 0 | 109.4 | I176 | I176-Q178 HydrophobicContact CG2-CG 4.42Š| ||
| 179 | E | 31.6 | Very low | 31.1 | Very low | 159 Ų | 159 | 145.6 Ų | 145.6 | 74% | 0.743 | 80% | 0.803 | S | S | * | * | trans | -79.3 | 131.4 | 175.1 | -61.6 | 173.7 | 176.1 | 0 | 0 | 107.2 | K177 | K177-E179 WeakPolarHBondContact CE-OE1 3.49Å; K177-E179 IonicContact NZ-OE1 3.45Å; K177-E179 PolarHBondContact NZ-OE1 3.47Å | ||
| 180 | G | 33.8 | Very low | 31.4 | Very low | 74 Ų | 74 | 148.3 Ų | 148.3 | 76% | 0.763 | 81% | 0.807 | S | S | * | * | trans | 152.1 | 99.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | V182 | G180-V182 PolarHBondContact O-N 3.39Š| ||
| 181 | N | 30.7 | Very low | 31.5 | Very low | 169 Ų | 169 | 148.4 Ų | 148.4 | 90% | 0.904 | 81% | 0.808 | S | S | * | * | trans | -69 | 113.8 | 177.6 | -160.7 | 4 | 0 | 0 | 0 | 110.2 | ||||
| 182 | V | 33.4 | Very low | 31.3 | Very low | 139 Ų | 139 | 151.3 Ų | 151.3 | 84% | 0.842 | 81% | 0.811 | S | S | * | * | trans | -144.4 | 132.4 | 158.2 | -160.8 | 0 | 0 | 0 | 0 | 110.9 | G180 | G180-V182 PolarHBondContact O-N 3.39Š| ||
| 183 | S | 27.8 | Very low | 31.4 | Very low | 99 Ų | 99 | 153.1 Ų | 153.1 | 69% | 0.692 | 82% | 0.818 | S | S | * | * | trans | -40.7 | 143.4 | -174.1 | -155.4 | 0 | 0 | 0 | 0 | 118 | M185 | S183-M185 PolarHBondContact O-N 3.19Š| ||
| 184 | C | 26 | Very low | 31.5 | Very low | 113 Ų | 113 | 151.2 Ų | 151.2 | 76% | 0.764 | 81% | 0.811 | S | S | * | * | trans | -64.4 | 122.3 | 160.2 | -168.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 185 | M | 29.5 | Very low | 31.6 | Very low | 173 Ų | 173 | 154.5 Ų | 154.5 | 85% | 0.852 | 82% | 0.819 | S | S | * | * | trans | -139.9 | 120.5 | 152 | -75.8 | -155.8 | 170.4 | 0 | 0 | 108.8 | S183 | S183-M185 PolarHBondContact O-N 3.19Š| ||
| 186 | M | 32.1 | Very low | 31.7 | Very low | 159 Ų | 159 | 149.7 Ų | 149.7 | 78% | 0.783 | 81% | 0.812 | S | S | * | * | trans | -60.3 | 132.3 | 165.5 | -70.2 | -101.4 | 169.2 | 0 | 0 | 109.1 | F188 | M186-F188 HydrophobicContact SD-CE2 4.48Š| ||
| 187 | S | 29.2 | Very low | 32.5 | Very low | 112 Ų | 112 | 147.9 Ų | 147.9 | 78% | 0.783 | 81% | 0.81 | S | S | * | * | trans | -145.5 | 109.5 | 157.4 | -74.5 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 188 | F | 30.7 | Very low | 32.5 | Very low | 191 Ų | 191 | 152 Ų | 152 | 84% | 0.838 | 82% | 0.821 | S | S | * | * | trans | -71.9 | 115.8 | 166.5 | -84.9 | -98.4 | 0 | 0 | 0 | 108.1 | M186 | M186-F188 HydrophobicContact SD-CE2 4.48Š| ||
| 189 | E | 29.6 | Very low | 32.3 | Very low | 192 Ų | 192 | 148.1 Ų | 148.1 | 90% | 0.897 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -103 | 122 | 158.9 | -80.4 | -172.1 | 115.7 | 0 | 0 | 108.5 | ||
| 190 | Q | 38.3 | Very low | 32.2 | Very low | 177 Ų | 177 | 144.8 Ų | 144.8 | 83% | 0.827 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -96.1 | 148.9 | 160.6 | -77.1 | -157.6 | -7.9 | 0 | 0 | 110.1 | ||
| 191 | P | 36.3 | Very low | 32.1 | Very low | 124 Ų | 124 | 147 Ų | 147 | 81% | 0.805 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 141.9 | -168.6 | 29.5 | -33.9 | 0 | 0 | 0 | 113.8 | ||
| 192 | R | 30.2 | Very low | 32.2 | Very low | 244 Ų | 244 | 143.9 Ų | 143.9 | 92% | 0.921 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 132.6 | 170.6 | -68.1 | 177.9 | 171.5 | -173.6 | -2.5 | 111.3 | ||
| 193 | V | 33.1 | Very low | 32.2 | Very low | 140 Ų | 140 | 145.9 Ų | 145.9 | 85% | 0.848 | 82% | 0.817 | S | S | * | * | trans | -131.2 | 124.3 | 148.1 | 179.2 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 194 | A | 28.7 | Very low | 32.4 | Very low | 95 Ų | 95 | 147.3 Ų | 147.3 | 79% | 0.785 | 82% | 0.822 | S | S | * | * | trans | -93.5 | 128.4 | -178.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 195 | I | 35 | Very low | 33.6 | Very low | 170 Ų | 170 | 147.1 Ų | 147.1 | 87% | 0.872 | 82% | 0.819 | S | S | * | * | trans | -139.5 | 130.8 | 150.3 | -56 | -178.5 | 0 | 0 | 0 | 107.1 | ||||
| 196 | S | 31.1 | Very low | 34.9 | Very low | 109 Ų | 109 | 143.5 Ų | 143.5 | 76% | 0.762 | 81% | 0.809 | S | S | * | * | trans | -96.6 | -176.9 | -172.8 | -145.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 197 | P | 48.5 | Very low | 34.7 | Very low | 114 Ų | 114 | 143.4 Ų | 143.4 | 74% | 0.74 | 81% | 0.81 | S | S | * | * | -123.1 | 168.8 | -107 | 34.1 | -14 | 0 | 0 | 0 | 113.9 | |||||
| 198 | R | 31.2 | Very low | 34.8 | Very low | 259 Ų | 259 | 142.9 Ų | 142.9 | 98% | 0.977 | 81% | 0.807 | S | S | * | * | trans | -155.9 | 146.2 | 151 | -129.1 | 173.6 | 177.5 | -168.6 | -2 | 113.2 | ||||
| 199 | A | 31.5 | Very low | 35.5 | Very low | 99 Ų | 99 | 138.6 Ų | 138.6 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -94.2 | 156.6 | -155.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 200 | A | 29.8 | Very low | 35.6 | Very low | 89 Ų | 89 | 137.4 Ų | 137.4 | 74% | 0.736 | 80% | 0.798 | S | S | * | * | trans | 169.5 | 108.5 | 134.8 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 201 | S | 32.4 | Very low | 35.3 | Very low | 121 Ų | 121 | 135.2 Ų | 135.2 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | 50.4 | 128.5 | 99.4 | -60.1 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 202 | S | 31.3 | Very low | 35.2 | Very low | 103 Ų | 103 | 136.7 Ų | 136.7 | 72% | 0.72 | 79% | 0.788 | S | S | * | * | cis | 178 | 144 | 21.7 | 41.9 | 0 | 0 | 0 | 0 | 103.7 | ||||
| 203 | M | 33.5 | Very low | 35.4 | Very low | 181 Ų | 181 | 132.7 Ų | 132.7 | 89% | 0.892 | 78% | 0.78 | S | S | * | * | 179.8 | 136.9 | 83 | -82 | -174.2 | 144.4 | 0 | 0 | 108.9 | |||||
| 204 | T | 33.4 | Very low | 35.4 | Very low | 129 Ų | 129 | 130.8 Ų | 130.8 | 79% | 0.791 | 78% | 0.779 | S | S | * | * | trans | -81.3 | -172.7 | 162.7 | 48.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 205 | P | 50.7 | Low | 35.8 | Very low | 109 Ų | 109 | 131.6 Ų | 131.6 | 71% | 0.708 | 77% | 0.774 | S | S | * | * | cis | -135.9 | -133.3 | -49.9 | 36.2 | -13.5 | 0 | 0 | 0 | 109.9 | ||||
| 206 | P | 55.7 | Low | 35.6 | Very low | 97 Ų | 97 | 130 Ų | 130 | 63% | 0.63 | 77% | 0.767 | S | S | * | * | -126.6 | -161.8 | -75.7 | 30.2 | -7.3 | 0 | 0 | 0 | 112.9 | |||||
| 207 | L | 28.8 | Very low | 35.4 | Very low | 156 Ų | 156 | 131.3 Ų | 131.3 | 82% | 0.817 | 78% | 0.775 | S | S | * | * | trans | 116.5 | 140.6 | 146.5 | -62.5 | 166.5 | 0 | 0 | 0 | 113.6 | ||||
| 208 | S | 30.2 | Very low | 34.8 | Very low | 102 Ų | 102 | 134.5 Ų | 134.5 | 71% | 0.713 | 78% | 0.78 | S | S | * | * | cis | -178 | -172.9 | -20.3 | -133.9 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 209 | P | 47.3 | Very low | 35 | Very low | 101 Ų | 101 | 126.5 Ų | 126.5 | 66% | 0.656 | 77% | 0.769 | S | S | * | * | trans | -105.9 | -179.8 | -134.7 | 41 | -24.7 | 0 | 0 | 0 | 114.4 | ||||
| 210 | D | 30 | Very low | 35.5 | Very low | 166 Ų | 166 | 130.2 Ų | 130.2 | 89% | 0.888 | 77% | 0.77 | S | S | * | * | trans | -155.4 | 146.3 | 144.4 | -100.7 | -40.1 | 0 | 0 | 0 | 112.9 | ||||
| 211 | D | 32.1 | Very low | 35.9 | Very low | 132 Ų | 132 | 133.7 Ų | 133.7 | 71% | 0.706 | 78% | 0.775 | S | S | * | * | trans | -85.9 | 164.3 | -160.7 | -78.4 | -60 | 0 | 0 | 0 | 116.3 | ||||
| 212 | Q | 34.3 | Very low | 36 | Very low | 155 Ų | 155 | 133.1 Ų | 133.1 | 72% | 0.724 | 77% | 0.77 | S | S | * | * | 120.7 | 123.4 | 120.9 | -142.4 | 62.8 | 46.5 | 0 | 0 | 118.3 | |||||
| 213 | Q | 35.4 | Very low | 35.9 | Very low | 159 Ų | 159 | 138.1 Ų | 138.1 | 74% | 0.743 | 78% | 0.779 | S | S | * | * | trans | -69.1 | 158.4 | 178.6 | -60.4 | 160.6 | 4.4 | 0 | 0 | 113.4 | ||||
| 214 | A | 32.9 | Very low | 36.1 | Very low | 101 Ų | 101 | 136.6 Ų | 136.6 | 84% | 0.835 | 77% | 0.77 | S | S | * | * | trans | -130.7 | 108.8 | 147.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 215 | T | 36 | Very low | 36.4 | Very low | 111 Ų | 111 | 138.8 Ų | 138.8 | 68% | 0.681 | 77% | 0.771 | S | S | * | * | trans | -57.7 | 166.6 | 153.3 | 45.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 216 | D | 32.1 | Very low | 35.8 | Very low | 136 Ų | 136 | 140.9 Ų | 140.9 | 73% | 0.727 | 77% | 0.769 | S | S | * | * | cis | -172.9 | 147.9 | 24.6 | -122.5 | -34.5 | 0 | 0 | 0 | 106.4 | ||||
| 217 | C | 25.7 | Very low | 35 | Very low | 138 Ų | 138 | 145.3 Ų | 145.3 | 93% | 0.932 | 78% | 0.775 | S | S | * | * | trans | -165.4 | 112.9 | 138.5 | -155.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 218 | Q | 37.4 | Very low | 35.3 | Very low | 180 Ų | 180 | 146.4 Ų | 146.4 | 84% | 0.841 | 78% | 0.775 | S | S | * | * | trans | -126.5 | 130.7 | -177.7 | -164.7 | -177.6 | 30.9 | 0 | 0 | 108.3 | ||||
| 219 | A | 35.5 | Very low | 35.4 | Very low | 91 Ų | 91 | 148.4 Ų | 148.4 | 75% | 0.752 | 78% | 0.783 | S | S | * | * | trans | 175.5 | 103.7 | 148.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 220 | Q | 42 | Very low | 34.8 | Very low | 177 Ų | 177 | 148.1 Ų | 148.1 | 83% | 0.827 | 79% | 0.789 | S | S | * | * | 69.8 | 115.3 | 96 | -73.8 | -145.6 | -27.8 | 0 | 0 | 115.5 | |||||
| 221 | L | 38.1 | Very low | 34.8 | Very low | 162 Ų | 162 | 145 Ų | 145 | 85% | 0.848 | 79% | 0.786 | S | S | * | * | 178.3 | 141.8 | 103 | -93.1 | 164.4 | 0 | 0 | 0 | 112.5 | |||||
| 222 | C | 34.1 | Very low | 34.7 | Very low | 109 Ų | 109 | 143.6 Ų | 143.6 | 74% | 0.736 | 79% | 0.787 | S | S | * | * | trans | -59 | 152.2 | 177.3 | -59.1 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 223 | F | 29.3 | Very low | 34.6 | Very low | 209 Ų | 209 | 144.5 Ų | 144.5 | 92% | 0.917 | 79% | 0.789 | S | S | * | * | -155.1 | 146.2 | 124.3 | -118 | -82.5 | 0 | 0 | 0 | 112.1 | |||||
| 224 | Q | 37.4 | Very low | 34.5 | Very low | 149 Ų | 149 | 143.8 Ų | 143.8 | 70% | 0.696 | 79% | 0.786 | S | S | * | * | trans | -74.4 | 151.2 | -162.3 | -71.7 | -178.4 | -11.7 | 0 | 0 | 116.4 | ||||
| 225 | Q | 40.4 | Very low | 34.5 | Very low | 174 Ų | 174 | 146.9 Ų | 146.9 | 81% | 0.813 | 78% | 0.783 | S | S | * | * | 10.8 | 133.6 | 123.8 | -94.9 | 172.4 | -3.8 | 0 | 0 | 118.3 | |||||
| 226 | K | 36.8 | Very low | 34.7 | Very low | 153 Ų | 153 | 149.8 Ų | 149.8 | 67% | 0.665 | 79% | 0.788 | S | S | * | * | trans | 157.8 | 129.6 | 143.6 | -94.8 | 165.6 | 176 | -163.8 | 0 | 108.8 | ||||
| 227 | Y | 39.2 | Very low | 35.1 | Very low | 191 Ų | 191 | 149 Ų | 149 | 75% | 0.749 | 79% | 0.79 | S | S | * | * | cis | -154 | 151.4 | 17.5 | -78.4 | -80.4 | 0 | 0 | 0 | 109.9 | ||||
| 228 | H | 35.1 | Very low | 35.6 | Very low | 178 Ų | 178 | 151.2 Ų | 151.2 | 82% | 0.824 | 79% | 0.787 | S | S | * | * | trans | -64.1 | 153.1 | 160.1 | -80.6 | -107.8 | 0 | 0 | 0 | 111.8 | ||||
| 229 | T | 31.4 | Very low | 35.6 | Very low | 145 Ų | 145 | 146.9 Ų | 146.9 | 89% | 0.89 | 78% | 0.782 | S | S | * | * | -158.5 | 120.7 | 121.1 | -9.3 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 230 | A | 35.2 | Very low | 35.7 | Very low | 94 Ų | 94 | 148.6 Ų | 148.6 | 78% | 0.777 | 79% | 0.785 | S | S | * | * | trans | -98.5 | 136.8 | 157.9 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 231 | A | 29.7 | Very low | 35.4 | Very low | 100 Ų | 100 | 148.9 Ų | 148.9 | 83% | 0.826 | 79% | 0.786 | S | S | * | * | trans | -155.9 | 125.1 | 155.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 232 | S | 31.7 | Very low | 35.1 | Very low | 104 Ų | 104 | 150.2 Ų | 150.2 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | -64.8 | 155.4 | 166.4 | -70.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 233 | F | 30.2 | Very low | 35.1 | Very low | 174 Ų | 174 | 153.6 Ų | 153.6 | 76% | 0.763 | 80% | 0.796 | S | S | * | * | 166.4 | 129.7 | 112.8 | -102.5 | -95.2 | 0 | 0 | 0 | 111.8 | |||||
| 234 | Q | 34.3 | Very low | 35.4 | Very low | 143 Ų | 143 | 151.8 Ų | 151.8 | 67% | 0.668 | 79% | 0.792 | S | S | * | * | trans | 46.4 | 115.8 | 142.7 | -68.7 | 174.7 | -20.2 | 0 | 0 | 121.5 | ||||
| 235 | H | 33.2 | Very low | 35.6 | Very low | 167 Ų | 167 | 150.4 Ų | 150.4 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | 158.9 | 136.9 | 106 | -93.5 | -71.4 | 0 | 0 | 0 | 111.7 | |||||
| 236 | H | 39.9 | Very low | 35.4 | Very low | 172 Ų | 172 | 152.5 Ų | 152.5 | 80% | 0.796 | 80% | 0.798 | S | S | * | * | trans | -45.8 | 153.1 | 164.2 | -112.9 | -72.7 | 0 | 0 | 0 | 113 | ||||
| 237 | P | 39.8 | Very low | 35.3 | Very low | 119 Ų | 119 | 153.8 Ų | 153.8 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | -128.5 | 160.8 | 124.1 | 18.8 | 0.1 | 0 | 0 | 0 | 113.4 | |||||
| 238 | Q | 36.2 | Very low | 35.1 | Very low | 185 Ų | 185 | 149 Ų | 149 | 86% | 0.864 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -73 | 147.9 | -168.3 | -71.9 | 155.5 | -47.1 | 0 | 0 | 113.7 | ||
| 239 | A | 37.5 | Very low | 35.4 | Very low | 88 Ų | 88 | 146.6 Ų | 146.6 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 144.4 | 162.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 240 | P | 37.8 | Very low | 35.7 | Very low | 127 Ų | 127 | 148.4 Ų | 148.4 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 138.6 | 173.9 | 29.9 | -31 | 0 | 0 | 0 | 110.8 | ||
| 241 | Q | 36.1 | Very low | 36 | Very low | 183 Ų | 183 | 149.7 Ų | 149.7 | 86% | 0.855 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 127.7 | 178.8 | -58.5 | -140.7 | -24.1 | 0 | 0 | 111.1 | ||
| 242 | M | 33 | Very low | 36.2 | Very low | 190 Ų | 190 | 148.5 Ų | 148.5 | 94% | 0.936 | 80% | 0.802 | S | S | * | * | trans | -95.3 | 112.3 | 163.1 | -81.6 | -161.4 | 153.4 | 0 | 0 | 109.6 | ||||
| 243 | Q | 33.4 | Very low | 36.4 | Very low | 180 Ų | 180 | 154.1 Ų | 154.1 | 84% | 0.841 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 133.7 | 166.1 | -77.7 | 164.8 | -15.8 | 0 | 0 | 109.7 | ||
| 244 | M | 34.9 | Very low | 36.5 | Very low | 172 Ų | 172 | 148.9 Ų | 148.9 | 85% | 0.847 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -82 | 127.6 | 169.8 | -69 | -83.3 | -76.6 | 0 | 0 | 109.9 | ||
| 245 | P | 42.8 | Very low | 36.3 | Very low | 120 Ų | 120 | 151.4 Ų | 151.4 | 78% | 0.779 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 132.3 | 158.7 | -6.5 | 25.5 | 0 | 0 | 0 | 110.7 | ||
| 246 | Y | 34.4 | Very low | 36.2 | Very low | 217 Ų | 217 | 153.9 Ų | 153.9 | 85% | 0.851 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 145 | 171.3 | -82.2 | -104.1 | 0 | 0 | 0 | 112.5 | ||
| 247 | H | 36.2 | Very low | 35.9 | Very low | 181 Ų | 181 | 152.8 Ų | 152.8 | 84% | 0.838 | 83% | 0.827 | S | S | * | * | trans | 6.3 | 132 | 159.6 | -70.6 | -74.9 | 0 | 0 | 0 | 121.5 | ||||
| 248 | A | 35.1 | Very low | 35.8 | Very low | 90 Ų | 90 | 156.1 Ų | 156.1 | 74% | 0.744 | 83% | 0.832 | S | S | * | * | trans | -136.9 | 138.8 | 137 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 249 | P | 41.8 | Very low | 35.6 | Very low | 127 Ų | 127 | 151.1 Ų | 151.1 | 83% | 0.825 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 146.9 | -173.2 | 32.4 | -33 | 0 | 0 | 0 | 113.3 | ||
| 250 | H | 36.2 | Very low | 35.4 | Very low | 184 Ų | 184 | 155.4 Ų | 155.4 | 85% | 0.852 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 148.5 | 173.4 | -75.6 | -91.2 | 0 | 0 | 0 | 112.5 | ||
| 251 | P | 42.3 | Very low | 35.1 | Very low | 120 Ų | 120 | 154.4 Ų | 154.4 | 78% | 0.779 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 134.5 | -176.3 | 31 | -32.3 | 0 | 0 | 0 | 112 | ||
| 252 | G | 32.8 | Very low | 35 | Very low | 76 Ų | 76 | 153.3 Ų | 153.3 | 78% | 0.784 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 142.5 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | G254 | G252-G254 PolarHBondContact O-N 3.39Š|
| 253 | F | 36.1 | Very low | 35.2 | Very low | 222 Ų | 222 | 152.9 Ų | 152.9 | 97% | 0.974 | 83% | 0.831 | S | S | * | * | trans | -71.1 | 106.6 | 163.9 | -87.1 | -98.4 | 0 | 0 | 0 | 109 | ||||
| 254 | G | 32.5 | Very low | 35.9 | Very low | 63 Ų | 63 | 149.8 Ų | 149.8 | 65% | 0.649 | 83% | 0.826 | S | S | * | * | trans | -117.9 | 116.2 | 167.2 | 0 | 0 | 0 | 0 | 0 | 109 | G252 | G252-G254 PolarHBondContact O-N 3.39Š| ||
| 255 | M | 30.1 | Very low | 35.8 | Very low | 197 Ų | 197 | 146.6 Ų | 146.6 | 97% | 0.97 | 83% | 0.827 | S | S | * | * | trans | -69.5 | 135.8 | 167.8 | -62.8 | -164.8 | 72 | 0 | 0 | 109 | ||||
| 256 | Y | 32.3 | Very low | 35.5 | Very low | 218 Ų | 218 | 144.7 Ų | 144.7 | 86% | 0.855 | 83% | 0.83 | S | S | * | * | trans | -114.1 | 140.1 | 167.3 | 54.9 | -94.6 | 0 | 0 | 0 | 109.5 | ||||
| 257 | D | 32.7 | Very low | 35.6 | Very low | 149 Ų | 149 | 139.3 Ų | 139.3 | 80% | 0.797 | 83% | 0.83 | S | S | * | * | trans | -85.8 | 145.5 | 172.9 | -86.2 | -52.3 | 0 | 0 | 0 | 112.1 | ||||
| 258 | E | 36.8 | Very low | 35.7 | Very low | 190 Ų | 190 | 140 Ų | 140 | 89% | 0.888 | 83% | 0.834 | S | S | * | * | trans | 45 | 127 | 144.3 | -54.8 | -161.8 | 122.4 | 0 | 0 | 123.5 | ||||
| 259 | G | 33.9 | Very low | 35.9 | Very low | 79 Ų | 79 | 146.9 Ų | 146.9 | 81% | 0.814 | 84% | 0.84 | S | S | * | * | trans | -151.5 | 122.1 | 159 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 260 | L | 32.8 | Very low | 35.7 | Very low | 179 Ų | 179 | 146.9 Ų | 146.9 | 94% | 0.937 | 84% | 0.838 | S | S | * | * | trans | -63.2 | 146 | -170.7 | -69.2 | 126.6 | 0 | 0 | 0 | 116.6 | ||||
| 261 | S | 31 | Very low | 35.7 | Very low | 105 Ų | 105 | 147 Ų | 147 | 73% | 0.734 | 84% | 0.841 | S | S | * | * | trans | -168.5 | 123.8 | 130.4 | -124.3 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 262 | L | 33.4 | Very low | 35.8 | Very low | 160 Ų | 160 | 148.7 Ų | 148.7 | 84% | 0.838 | 84% | 0.842 | S | S | * | * | trans | 69.1 | 109.2 | 141.3 | -62.8 | 164.1 | 0 | 0 | 0 | 122.5 | ||||
| 263 | Q | 37.1 | Very low | 36.5 | Very low | 181 Ų | 181 | 151 Ų | 151 | 85% | 0.846 | 84% | 0.841 | S | S | * | * | trans | -27.8 | -173 | 162.6 | -47.6 | -174.2 | 1 | 0 | 0 | 121.9 | ||||
| 264 | P | 47.8 | Very low | 37.2 | Very low | 115 Ų | 115 | 146.1 Ų | 146.1 | 75% | 0.747 | 83% | 0.832 | S | S | * | * | -134.7 | 168.5 | -63.2 | 39.1 | -21.9 | 0 | 0 | 0 | 113.2 | |||||
| 265 | A | 33.7 | Very low | 37.6 | Very low | 105 Ų | 105 | 149.2 Ų | 149.2 | 87% | 0.868 | 84% | 0.841 | S | S | * | * | trans | -153.3 | 136.8 | 152.7 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 266 | G | 35.7 | Very low | 38.4 | Very low | 81 Ų | 81 | 145.8 Ų | 145.8 | 84% | 0.835 | 84% | 0.836 | S | S | * | * | trans | -79.1 | 155.8 | -153.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 267 | A | 37 | Very low | 39 | Very low | 104 Ų | 104 | 139.7 Ų | 139.7 | 86% | 0.86 | 83% | 0.825 | S | S | * | * | trans | -158.5 | 124.4 | 141.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 268 | Q | 39 | Very low | 39.8 | Very low | 195 Ų | 195 | 138.8 Ų | 138.8 | 91% | 0.911 | 83% | 0.828 | S | S | * | * | trans | -69.1 | 138.5 | 179.9 | -63.6 | 168.6 | 28.6 | 0 | 0 | 110.8 | ||||
| 269 | R | 38.4 | Very low | 40.3 | Very low | 235 Ų | 235 | 136.9 Ų | 136.9 | 89% | 0.887 | 82% | 0.823 | S | S | * | * | trans | -162.5 | 110.3 | 140.5 | -123.2 | 171.6 | 165.9 | 166.8 | -4.7 | 112.5 | ||||
| 270 | V | 38.8 | Very low | 41.1 | Very low | 126 Ų | 126 | 140.7 Ų | 140.7 | 76% | 0.764 | 82% | 0.819 | S | S | * | * | trans | 29.1 | 98.9 | 142.5 | -167 | 0 | 0 | 0 | 0 | 116.4 | L272 | V270-L272 HydrophobicContact CG1-CG 4.48Å; V270-L272 PolarHBondContact O-N 2.84Å | ||
| 271 | M | 35.9 | Very low | 41.7 | Very low | 188 Ų | 188 | 140.4 Ų | 140.4 | 93% | 0.926 | 82% | 0.818 | S | S | * | * | trans | -78.1 | 105.8 | 161.2 | -71.2 | -90.2 | -174.7 | 0 | 0 | 108.4 | ||||
| 272 | L | 44.1 | Very low | 42.5 | Very low | 154 Ų | 154 | 143.5 Ų | 143.5 | 81% | 0.806 | 83% | 0.826 | S | S | * | * | trans | -74.8 | 140.5 | 156 | -72.3 | 167.8 | 0 | 0 | 0 | 108 | V270 | V270-L272 HydrophobicContact CG1-CG 4.48Å; V270-L272 PolarHBondContact O-N 2.84Å | ||
| 273 | T | 48.4 | Very low | 43.2 | Very low | 124 Ų | 124 | 142.1 Ų | 142.1 | 76% | 0.761 | 82% | 0.815 | S | S | * | * | trans | -45.8 | 141.3 | -178.9 | 51.9 | 0 | 0 | 0 | 0 | 114 | ||||
| 274 | P | 49.7 | Very low | 43.8 | Very low | 120 Ų | 120 | 138.3 Ų | 138.3 | 78% | 0.779 | 81% | 0.808 | S | S | * | * | trans | -74.6 | 133.2 | 174.5 | 29.5 | -31.6 | 0 | 0 | 0 | 111 | ||||
| 275 | P | 41.5 | Very low | 43.8 | Very low | 129 Ų | 129 | 142.2 Ų | 142.2 | 84% | 0.838 | 81% | 0.813 | S | S | * | * | trans | -75.7 | 126.9 | 172 | 28.6 | -30.9 | 0 | 0 | 0 | 111 | S277 | P275-S277 PolarHBondContact O-N 2.92Š| ||
| 276 | S | 45.8 | Very low | 44.4 | Very low | 124 Ų | 124 | 142.8 Ų | 142.8 | 87% | 0.867 | 81% | 0.808 | S | S | * | * | trans | -76.7 | 99.8 | 170.8 | 43.2 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 277 | S | 45 | Very low | 45.1 | Very low | 90 Ų | 90 | 148.5 Ų | 148.5 | 63% | 0.629 | 81% | 0.81 | S | S | * | * | trans | 162.9 | 128.2 | 146.8 | -179.7 | 0 | 0 | 0 | 0 | 111.2 | P275 L279 | P275-S277 PolarHBondContact O-N 2.92Å; S277-L279 VanDerWaalsContact C-N 3.34Å; S277-L279 PolarHBondContact O-N 3.1Å | ||
| 278 | P | 50 | Low | 45.7 | Very low | 131 Ų | 131 | 155.2 Ų | 155.2 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -89.3 | 53.2 | -179 | 36 | -34 | 0 | 0 | 0 | 113.1 | ||
| 279 | L | 47.6 | Very low | 46 | Very low | 150 Ų | 150 | 148.7 Ų | 148.7 | 79% | 0.785 | 80% | 0.798 | S | S | * | * | trans | -140 | 32.6 | -177.1 | -80.4 | -177.3 | 0 | 0 | 0 | 116.1 | S277 | S277-L279 VanDerWaalsContact C-N 3.34Å; S277-L279 PolarHBondContact O-N 3.1Å | ||
| 280 | E | 51 | Low | 46.4 | Very low | 158 Ų | 158 | 148.3 Ų | 148.3 | 74% | 0.738 | 80% | 0.796 | S | S | * | * | trans | -147.7 | 84.3 | 159 | -78.6 | -147.1 | 149.3 | 0 | 0 | 111.2 | ||||
| 281 | L | 44.3 | Very low | 47 | Very low | 173 Ų | 173 | 152.5 Ų | 152.5 | 91% | 0.906 | 80% | 0.798 | S | S | * | * | trans | -145 | 55.9 | 159.8 | -153.6 | 82.9 | 0 | 0 | 0 | 110.1 | ||||
| 282 | L | 48.7 | Very low | 48 | Very low | 171 Ų | 171 | 149 Ų | 149 | 90% | 0.895 | 79% | 0.788 | S | S | * | * | trans | -122.1 | 20.8 | 166.3 | -99.8 | 148.3 | 0 | 0 | 0 | 111.7 | S284 | L282-S284 PolarHBondContact O-N 3.42Š| ||
| 283 | E | 46.6 | Very low | 47.9 | Very low | 131 Ų | 131 | 151.3 Ų | 151.3 | 61% | 0.612 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -77.3 | 101.6 | 164.4 | -84.4 | 71.8 | -156.3 | 0 | 0 | 111.6 | ||
| 284 | S | 51.7 | Low | 48 | Very low | 100 Ų | 100 | 150.4 Ų | 150.4 | 70% | 0.699 | 78% | 0.782 | S | S | * | * | trans | 59.7 | 84.4 | 143.1 | 68.2 | 0 | 0 | 0 | 0 | 117.1 | L282 P286 | L282-S284 PolarHBondContact O-N 3.42Å; S284-P286 WeakPolarHBondContact O-CD 3.42Å; S284-P286 VanDerWaalsContact O-N 3.14Å | ||
| 285 | K | 46.4 | Very low | 48.5 | Very low | 197 Ų | 197 | 153.4 Ų | 153.4 | 86% | 0.857 | 78% | 0.778 | S | S | * | * | trans | -50.2 | 122.8 | 146.5 | -76.5 | 166.7 | 177.5 | 168.3 | 0 | 106.8 | K287 | K285-K287 PolarHBondContact O-N 3.18Š| ||
| 286 | P | 47.8 | Very low | 49.4 | Very low | 117 Ų | 117 | 155.8 Ų | 155.8 | 76% | 0.76 | 78% | 0.775 | S | S | * | * | trans | -58.5 | 112.9 | 172.2 | 23.1 | -30.2 | 0 | 0 | 0 | 105.5 | S284 R288 | S284-P286 WeakPolarHBondContact O-CD 3.42Å; S284-P286 VanDerWaalsContact O-N 3.14Å; P286-R288 PolarHBondContact O-N 3.43Å | ||
| 287 | K | 48.4 | Very low | 50.4 | Low | 201 Ų | 201 | 157.1 Ų | 157.1 | 87% | 0.874 | 76% | 0.761 | S | S | * | * | trans | -49.1 | 111.6 | 169.2 | -74 | 177.3 | 178.5 | 173.3 | 0 | 103.9 | K285 G289 | K285-K287 PolarHBondContact O-N 3.18Å; K287-G289 PolarHBondContact O-N 3.4Å | ||
| 288 | R | 49.5 | Very low | 52.1 | Low | 246 Ų | 246 | 157.7 Ų | 157.7 | 93% | 0.928 | 76% | 0.761 | S | S | * | * | trans | -57.4 | 95.4 | 170.1 | -73.8 | -175.9 | -169.8 | -136.4 | 1.2 | 104.3 | P286 R290 | P286-R288 PolarHBondContact O-N 3.43Å; R288-R290 PolarHBondContact O-N 3.17Å | ||
| 289 | G | 46.3 | Very low | 53.7 | Low | 57 Ų | 57 | 153.5 Ų | 153.5 | 59% | 0.588 | 74% | 0.737 | S | S | * | * | trans | -52.7 | 130.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 105.3 | K287 R291 | K287-G289 PolarHBondContact O-N 3.4Å; G289-R291 PolarHBondContact O-N 3.27Å | ||
| 290 | R | 47.9 | Very low | 55.6 | Low | 228 Ų | 228 | 150.8 Ų | 150.8 | 86% | 0.86 | 73% | 0.727 | S | S | * | * | trans | -49.5 | 112.6 | 166.5 | -83.1 | -175.5 | -172.1 | -102.5 | 1.6 | 105 | R288 T292 | R288-R290 PolarHBondContact O-N 3.17Å; R290-T292 HydrophobicContact CB-CG2 4.08Å; R290-T292 PolarHBondContact O-N 3.23Å | ||
| 291 | R | 51.1 | Low | 57.4 | Low | 213 Ų | 213 | 146.2 Ų | 146.2 | 80% | 0.804 | 71% | 0.706 | S | S | * | * | trans | -65.2 | 83.9 | 166.1 | -73.1 | -172 | -77.7 | -149.9 | -1.2 | 105.4 | G289 W293 | G289-R291 PolarHBondContact O-N 3.27Å; R291-W293 PolarHBondContact O-N 3.29Å | ||
| 292 | T | 55.9 | Low | 59.6 | Low | 116 Ų | 116 | 141.8 Ų | 141.8 | 71% | 0.712 | 69% | 0.686 | S | S | * | * | trans | -74.1 | 77 | 167.8 | 55.6 | 0 | 0 | 0 | 0 | 105.2 | R290 P294 | R290-T292 HydrophobicContact CB-CG2 4.08Å; R290-T292 PolarHBondContact O-N 3.23Å; T292-P294 WeakPolarHBondContact O-CD 3.15Å; T292-P294 VanDerWaalsContact O-N 3.17Å | ||
| 293 | W | 43.2 | Very low | 61.8 | Low | 202 Ų | 202 | 134.1 Ų | 134.1 | 77% | 0.765 | 65% | 0.647 | S | S | * | * | trans | -60.7 | 117.1 | 163.3 | -71 | 99.5 | 0 | 0 | 0 | 105.9 | R291 R295 | R291-W293 PolarHBondContact O-N 3.29Å; W293-R295 PolarHBondContact O-N 3.42Å | ||
| 294 | P | 50.3 | Low | 63.9 | Low | 105 Ų | 105 | 134 Ų | 134 | 68% | 0.682 | 66% | 0.655 | S | S | * | * | trans | -70.7 | 83.1 | 170.4 | 29.9 | -30.3 | 0 | 0 | 0 | 106.5 | T292 K296 | T292-P294 WeakPolarHBondContact O-CD 3.15Å; T292-P294 VanDerWaalsContact O-N 3.17Å; P294-K296 PolarHBondContact O-N 2.88Å | ||
| 295 | R | 58.5 | Low | 65.7 | Low | 182 Ų | 182 | 134.3 Ų | 134.3 | 69% | 0.687 | 64% | 0.644 | S | S | * | * | trans | -68.3 | 74.9 | 161.5 | -100.9 | 179.8 | 145.5 | -166.7 | -6.6 | 106.1 | W293 R297 | W293-R295 PolarHBondContact O-N 3.42Å; R295-R297 PolarHBondContact O-N 3.25Å | ||
| 296 | K | 61.7 | Low | 67.9 | Low | 179 Ų | 179 | 129.3 Ų | 129.3 | 78% | 0.778 | 64% | 0.639 | S | S | * | * | trans | -65.5 | 87.8 | 160.4 | -68.6 | -176.3 | -176.4 | -178.7 | 0 | 104.7 | P294 T298 | P294-K296 PolarHBondContact O-N 2.88Å; K296-T298 PolarHBondContact O-N 3.09Å | ||
| 297 | R | 66.8 | Low | 69.8 | Low | 153 Ų | 153 | 128.1 Ų | 128.1 | 58% | 0.577 | 65% | 0.648 | S | S | * | * | trans | -68.4 | 92.6 | 171 | -61.8 | -171.4 | -160.5 | -154.9 | 5.4 | 105.6 | R295 A299 T313 | R295-R297 PolarHBondContact O-N 3.25Å; R297-A299 PolarHBondContact O-N 3.45Å; R297-T313 HydrophobicContact CB-CG2 3.78Å | ||
| 298 | T | 81 | Confident | 71.8 | Confident | 101 Ų | 101 | 119.8 Ų | 119.8 | 62% | 0.62 | 62% | 0.615 | S | S | * | * | trans | -69.3 | 125.7 | 174.7 | 44.9 | 0 | 0 | 0 | 0 | 107.5 | K296 T300 | K296-T298 PolarHBondContact O-N 3.09Å; T298-T300 PolarHBondContact O-N 3.5Å; T298-T300 VanDerWaalsContact O-N 3.13Å | ||
| 299 | A | 82.6 | Confident | 73.7 | Confident | 43 Ų | 43 | 111 Ų | 111 | 36% | 0.355 | 60% | 0.601 | S | S | . | * | trans | -74.5 | 102.3 | 176 | 0 | 0 | 0 | 0 | 0 | 108.4 | R297 T311 Y312 T313 | R297-A299 PolarHBondContact O-N 3.45Å; A299-T311 WeakPolarHBondContact CB-OG1 3.41Å; A299-Y312 CarbonylContact C-O 3.5Å; A299-Y312 WeakPolarHBondContact CA-O 3.34Å; A299-T313 HydrophobicContact CB-CG2 4.04Å | ||
| 300 | T | 87.1 | Confident | 75.8 | Confident | 93 Ų | 93 | 113.6 Ų | 113.6 | 57% | 0.571 | 60% | 0.596 | S | S | * | * | trans | -92.8 | -19.7 | -176.7 | 49.5 | 0 | 0 | 0 | 0 | 112.8 | T298 Y312 | T298-T300 PolarHBondContact O-N 3.5Å; T298-T300 VanDerWaalsContact O-N 3.13Å; T300-Y312 PolarHBondContact N-O 3.46Å | ||
| 301 | H | 89.3 | Confident | 78 | Confident | 63 Ų | 63 | 106.3 Ų | 106.3 | 29% | 0.292 | 58% | 0.577 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -100.7 | 101.3 | -172.7 | -60.3 | -68.5 | 0 | 0 | 0 | 111.2 | T311 Y312 K314 S315 L318 | H301-T311 CarbonylContact O-C 3.45Å; H301-T311 WeakPolarHBondContact O-CA 3.33Å; H301-Y312 WeakPolarHBondContact CB-O 3.35Å; H301-Y312 PolarHBondContact N-O 3.13Å; H301-Y312 PolarHBondContact O-N 3.12Å; H301-K314 VanDerWaalsContact CD2-C 3.41Å; H301-S315 PolarHBondContact CD2-N 3.04Å; H301-S315 VanDerWaalsContact CD2-N 3.29Å; H301-S315 PolarHBondContact NE2-N 3.45Å; H301-L318 HydrophobicContact CB-CB 4.02Å; H301-L318 HydrophobicContact CB-CD2 3.81Å; H301-L318 HydrophobicContact CB-CG 4.5Å |
| 302 | T | 91.8 | Very high | 79.9 | Confident | 80 Ų | 80 | 98.6 Ų | 98.6 | 49% | 0.491 | 55% | 0.548 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.9 | 140.2 | -179.2 | 60.2 | 0 | 0 | 0 | 0 | 111.8 | T304 K310 T311 | T302-T304 PolarHBondContact O-N 2.83Å; T302-K310 CarbonylContact C-O 3.49Å; T302-T311 HydrophobicContact CG2-CG2 3.37Å |
| 303 | C | 93.6 | Very high | 81.6 | Confident | 10 Ų | 10 | 95.7 Ų | 95.7 | 7% | 0.068 | 53% | 0.53 | C | S | . | . | trans | -70.8 | 126.2 | 172.8 | -174.1 | 0 | 0 | 0 | 0 | 110.6 | F305 C308 K310 L318 H321 | C303-F305 VanDerWaalsContact C-N 3.34Å; C303-C308 HydrophobicContact CB-CB 4.31Å; C303-K310 HydrophobicContact CB-CB 4.46Å; C303-K310 WeakPolarHBondContact CB-O 3.49Å; C303-K310 PolarHBondContact N-O 2.84Å; C303-L318 HydrophobicContact CB-CD1 3.96Å; C303-H321 PolarHBondContact SG-NE2 2.92Å | ||
| 304 | T | 91 | Very high | 83.8 | Confident | 129 Ų | 129 | 89.1 Ų | 89.1 | 79% | 0.791 | 51% | 0.507 | S | S | * | . | trans | -86.6 | -4 | -179.2 | 51.2 | 0 | 0 | 0 | 0 | 113.3 | T302 | T302-T304 PolarHBondContact O-N 2.83Š| ||
| 305 | F | 90.1 | Very high | 85.7 | Confident | 106 Ų | 106 | 87.8 Ų | 87.8 | 47% | 0.465 | 50% | 0.5 | S | S | . | . | S | Bend | trans | -69.1 | 136.3 | 179.9 | -160.5 | -93.4 | 0 | 0 | 0 | 111.4 | C303 G307 C308 H325 | C303-F305 VanDerWaalsContact C-N 3.34Å; F305-G307 PolarHBondContact O-N 2.94Å; F305-C308 HydrophobicContact CB-CB 4.2Å; F305-C308 WeakPolarHBondContact O-CB 3.39Å; F305-C308 PolarHBondContact O-N 3.49Å; F305-C308 VanDerWaalsContact O-N 3.07Å; F305-H325 HydrophobicContact CD1-CB 4.3Å; F305-H325 AromaticContact CD1-CE1 3.55Å; F305-H325 AromaticContact CD1-CG 3.72Å; F305-H325 AromaticContact CD1-ND1 3.24Å; F305-H325 WeakPolarHBondContact CD1-ND1 3.49Å; F305-H325 HydrophobicContact CD2-CB 3.62Å; F305-H325 AromaticContact CD2-CG 3.78Å; F305-H325 HydrophobicContact CE1-CB 4.43Å; F305-H325 AromaticContact CE1-ND1 3.59Å; F305-H325 HydrophobicContact CE2-CB 3.77Å; F305-H325 HydrophobicContact CG-CB 3.9Å; F305-H325 AromaticContact CG-CD2 3.82Å; F305-H325 AromaticContact CG-CE1 3.88Å; F305-H325 AromaticContact CG-CG 3.48Å; F305-H325 VanDerWaalsContact CG-CG 3.48Å; F305-H325 AromaticContact CG-ND1 3.54Å; F305-H325 HydrophobicContact CZ-CB 4.17Å |
| 306 | A | 91.3 | Very high | 87 | Confident | 91 Ų | 91 | 82.1 Ų | 82.1 | 75% | 0.752 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.2 | 122.8 | -176.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | C308 | A306-C308 VanDerWaalsContact C-N 3.34Å; A306-C308 PolarHBondContact O-N 2.61Å |
| 307 | G | 88.8 | Confident | 88.4 | Confident | 92 Ų | 92 | 77.6 Ų | 77.6 | 95% | 0.948 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.7 | 4.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | F305 | F305-G307 PolarHBondContact O-N 2.94Š|
| 308 | C | 91.2 | Very high | 89.5 | Confident | 27 Ų | 27 | 71.6 Ų | 71.6 | 18% | 0.182 | 45% | 0.449 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.7 | -54 | -179.9 | -173.1 | 0 | 0 | 0 | 0 | 113.6 | C303 F305 A306 K310 H321 H325 | C303-C308 HydrophobicContact CB-CB 4.31Å; F305-C308 HydrophobicContact CB-CB 4.2Å; F305-C308 WeakPolarHBondContact O-CB 3.39Å; F305-C308 PolarHBondContact O-N 3.49Å; F305-C308 VanDerWaalsContact O-N 3.07Å; A306-C308 VanDerWaalsContact C-N 3.34Å; A306-C308 PolarHBondContact O-N 2.61Å; C308-K310 PolarHBondContact O-N 3.16Å; C308-H321 VanDerWaalsContact SG-CE1 3.54Å; C308-H321 PolarHBondContact SG-NE2 2.87Å; C308-H325 PolarHBondContact SG-NE2 3.39Å |
| 309 | G | 88.1 | Confident | 89.8 | Confident | 61 Ų | 61 | 73.4 Ų | 73.4 | 63% | 0.629 | 45% | 0.449 | S | S | * | . | trans | 61 | 4.4 | 177 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 310 | K | 91.6 | Very high | 90.1 | Very high | 112 Ų | 112 | 72.3 Ų | 72.3 | 49% | 0.487 | 44% | 0.439 | S | S | . | . | trans | -69.3 | 139.5 | -178.1 | -69.1 | 179 | -171.3 | 176.3 | 0 | 111.4 | T302 C303 C308 Y312 | T302-K310 CarbonylContact C-O 3.49Å; C303-K310 HydrophobicContact CB-CB 4.46Å; C303-K310 WeakPolarHBondContact CB-O 3.49Å; C303-K310 PolarHBondContact N-O 2.84Å; C308-K310 PolarHBondContact O-N 3.16Å; K310-Y312 HydrophobicContact CB-CE2 3.79Å | ||
| 311 | T | 92.6 | Very high | 90.1 | Very high | 75 Ų | 75 | 68.4 Ų | 68.4 | 46% | 0.46 | 42% | 0.415 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 145.4 | -179 | 67 | 0 | 0 | 0 | 0 | 111.6 | A299 H301 T302 | A299-T311 WeakPolarHBondContact CB-OG1 3.41Å; H301-T311 CarbonylContact O-C 3.45Å; H301-T311 WeakPolarHBondContact O-CA 3.33Å; T302-T311 HydrophobicContact CG2-CG2 3.37Å |
| 312 | Y | 91.7 | Very high | 90.1 | Very high | 50 Ų | 50 | 68.1 Ų | 68.1 | 20% | 0.196 | 42% | 0.415 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.8 | 147.9 | -173.2 | -60.9 | -85.6 | 0 | 0 | 0 | 110.5 | A299 T300 H301 K310 H317 L318 H321 | A299-Y312 CarbonylContact C-O 3.5Å; A299-Y312 WeakPolarHBondContact CA-O 3.34Å; T300-Y312 PolarHBondContact N-O 3.46Å; H301-Y312 WeakPolarHBondContact CB-O 3.35Å; H301-Y312 PolarHBondContact N-O 3.13Å; H301-Y312 PolarHBondContact O-N 3.12Å; K310-Y312 HydrophobicContact CB-CE2 3.79Å; Y312-H317 HydrophobicContact CD1-CB 3.64Å; Y312-H317 HydrophobicContact CE1-CB 4.47Å; Y312-H317 HydrophobicContact CG-CB 4.1Å; Y312-L318 HydrophobicContact CD2-CB 3.94Å; Y312-L318 HydrophobicContact CD2-CD1 3.83Å; Y312-L318 HydrophobicContact CE2-CD1 4.13Å; Y312-L318 HydrophobicContact CG-CB 4.29Å; Y312-H321 HydrophobicContact CE1-CB 4.14Å; Y312-H321 HydrophobicContact CE2-CB 3.74Å; Y312-H321 AromaticContact CE2-CD2 3.34Å; Y312-H321 WeakPolarHBondContact CE2-CD2 3.37Å; Y312-H321 AromaticContact CE2-CG 3.59Å; Y312-H321 VanDerWaalsContact CZ-CB 3.47Å; Y312-H321 AromaticContact CZ-CD2 3.67Å; Y312-H321 AromaticContact CZ-CG 3.44Å; Y312-H321 VanDerWaalsContact CZ-CG 3.44Å; Y312-H321 WeakPolarHBondContact OH-CB 3.41Å; Y312-H321 PolarHBondContact OH-CD2 3.13Å; Y312-H321 PolarHBondContact OH-ND1 3.25Å |
| 313 | T | 91.7 | Very high | 90 | Very high | 55 Ų | 55 | 66.1 Ų | 66.1 | 34% | 0.337 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -85.9 | -18.4 | 177.4 | 51.7 | 0 | 0 | 0 | 0 | 113.1 | R297 A299 | R297-T313 HydrophobicContact CB-CG2 3.78Å; A299-T313 HydrophobicContact CB-CG2 4.04Å |
| 314 | K | 89.6 | Confident | 89.7 | Confident | 65 Ų | 65 | 70.1 Ų | 70.1 | 28% | 0.283 | 42% | 0.423 | S | S | . | . | S | Bend | trans | -123.6 | 139.3 | 177.2 | -63.5 | -168.5 | 172.1 | -163 | 0 | 109.6 | D57 H301 S316 H317 L318 | D57-K314 IonicContact OD2-NZ 3Å; D57-K314 PolarHBondContact OD2-NZ 2.82Å; H301-K314 VanDerWaalsContact CD2-C 3.41Å; K314-S316 VanDerWaalsContact C-N 3.27Å; K314-S316 PolarHBondContact O-N 2.99Å; K314-H317 HydrophobicContact CB-CB 4.48Å; K314-H317 PolarHBondContact O-N 3.03Å; K314-L318 PolarHBondContact O-N 2.93Å |
| 315 | S | 89.3 | Confident | 89.5 | Confident | 76 Ų | 76 | 66.7 Ų | 66.7 | 53% | 0.531 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -61.3 | -36.5 | 175.3 | 59.1 | 0 | 0 | 0 | 0 | 111.9 | H301 H317 L318 K319 | H301-S315 PolarHBondContact CD2-N 3.04Å; H301-S315 VanDerWaalsContact CD2-N 3.29Å; H301-S315 PolarHBondContact NE2-N 3.45Å; S315-H317 VanDerWaalsContact C-N 3.31Å; S315-H317 PolarHBondContact O-N 3Å; S315-L318 PolarHBondContact O-N 2.97Å; S315-L318 VanDerWaalsContact O-N 3.17Å; S315-K319 PolarHBondContact O-N 3.38Å |
| 316 | S | 87.4 | Confident | 89.3 | Confident | 64 Ų | 64 | 65.8 Ų | 65.8 | 45% | 0.448 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -59.6 | -39.3 | 175.6 | 59.2 | 0 | 0 | 0 | 0 | 112.7 | K314 K319 A320 | K314-S316 VanDerWaalsContact C-N 3.27Å; K314-S316 PolarHBondContact O-N 2.99Å; S316-K319 PolarHBondContact O-N 3.37Å; S316-A320 WeakPolarHBondContact O-CB 3.24Å; S316-A320 PolarHBondContact O-N 2.86Å |
| 317 | H | 89.5 | Confident | 89 | Confident | 83 Ų | 83 | 63.9 Ų | 63.9 | 38% | 0.384 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -68.8 | -39.4 | 175.4 | -65.3 | 167 | 0 | 0 | 0 | 112.1 | Y312 K314 S315 A320 H321 | Y312-H317 HydrophobicContact CD1-CB 3.64Å; Y312-H317 HydrophobicContact CE1-CB 4.47Å; Y312-H317 HydrophobicContact CG-CB 4.1Å; K314-H317 HydrophobicContact CB-CB 4.48Å; K314-H317 PolarHBondContact O-N 3.03Å; S315-H317 VanDerWaalsContact C-N 3.31Å; S315-H317 PolarHBondContact O-N 3Å; H317-A320 PolarHBondContact O-N 3.1Å; H317-H321 VanDerWaalsContact O-CB 3.28Å; H317-H321 WeakPolarHBondContact O-CB 3.39Å; H317-H321 PolarHBondContact O-N 2.9Å |
| 318 | L | 90.6 | Very high | 88.9 | Confident | 28 Ų | 28 | 65 Ų | 65 | 15% | 0.147 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -62.2 | -46.6 | 173 | 174.3 | 62.3 | 0 | 0 | 0 | 110.5 | H301 C303 Y312 K314 S315 A320 H321 L322 | H301-L318 HydrophobicContact CB-CB 4.02Å; H301-L318 HydrophobicContact CB-CD2 3.81Å; H301-L318 HydrophobicContact CB-CG 4.5Å; C303-L318 HydrophobicContact CB-CD1 3.96Å; Y312-L318 HydrophobicContact CD2-CB 3.94Å; Y312-L318 HydrophobicContact CD2-CD1 3.83Å; Y312-L318 HydrophobicContact CE2-CD1 4.13Å; Y312-L318 HydrophobicContact CG-CB 4.29Å; K314-L318 PolarHBondContact O-N 2.93Å; S315-L318 PolarHBondContact O-N 2.97Å; S315-L318 VanDerWaalsContact O-N 3.17Å; L318-A320 PolarHBondContact O-N 3.2Å; L318-H321 CarbonylContact O-C 3.6Å; L318-H321 WeakPolarHBondContact O-CA 3.28Å; L318-H321 WeakPolarHBondContact O-CB 3.48Å; L318-H321 PolarHBondContact O-N 3.36Å; L318-H321 VanDerWaalsContact O-N 3.09Å; L318-L322 HydrophobicContact CD1-CD2 4.47Å; L318-L322 HydrophobicContact CD1-CG 4.21Å; L318-L322 HydrophobicContact CG-CD1 4.32Å; L318-L322 HydrophobicContact CG-CG 4.42Å; L318-L322 WeakPolarHBondContact O-CG 3.47Å; L318-L322 PolarHBondContact O-N 3.28Å |
| 319 | K | 87.8 | Confident | 88.9 | Confident | 139 Ų | 139 | 69.6 Ų | 69.6 | 60% | 0.604 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -60.1 | -44.9 | 178 | -172.5 | 174 | -176.3 | 174.6 | 0 | 112.1 | S315 S316 H321 L322 | S315-K319 PolarHBondContact O-N 3.38Å; S316-K319 PolarHBondContact O-N 3.37Å; K319-H321 VanDerWaalsContact C-N 3.29Å; K319-H321 PolarHBondContact O-N 2.67Å; K319-L322 PolarHBondContact O-N 3.44Å |
| 320 | A | 87.4 | Confident | 88.8 | Confident | 19 Ų | 19 | 69.7 Ų | 69.7 | 16% | 0.157 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -63.2 | -36.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112 | S316 H317 L318 R323 R344 | S316-A320 WeakPolarHBondContact O-CB 3.24Å; S316-A320 PolarHBondContact O-N 2.86Å; H317-A320 PolarHBondContact O-N 3.1Å; L318-A320 PolarHBondContact O-N 3.2Å; A320-R323 WeakPolarHBondContact O-CB 3.41Å; A320-R323 PolarHBondContact O-N 3.43Å; A320-R344 HydrophobicContact CB-CG 4.27Å |
| 321 | H | 88.7 | Confident | 88.8 | Confident | 12 Ų | 12 | 67.8 Ų | 67.8 | 6% | 0.056 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -67.7 | -40.2 | 175.2 | 167.1 | 54.9 | 0 | 0 | 0 | 112.7 | C303 C308 Y312 H317 L318 K319 R323 T324 H325 | C303-H321 PolarHBondContact SG-NE2 2.92Å; C308-H321 VanDerWaalsContact SG-CE1 3.54Å; C308-H321 PolarHBondContact SG-NE2 2.87Å; Y312-H321 HydrophobicContact CE1-CB 4.14Å; Y312-H321 HydrophobicContact CE2-CB 3.74Å; Y312-H321 AromaticContact CE2-CD2 3.34Å; Y312-H321 WeakPolarHBondContact CE2-CD2 3.37Å; Y312-H321 AromaticContact CE2-CG 3.59Å; Y312-H321 VanDerWaalsContact CZ-CB 3.47Å; Y312-H321 AromaticContact CZ-CD2 3.67Å; Y312-H321 AromaticContact CZ-CG 3.44Å; Y312-H321 VanDerWaalsContact CZ-CG 3.44Å; Y312-H321 WeakPolarHBondContact OH-CB 3.41Å; Y312-H321 PolarHBondContact OH-CD2 3.13Å; Y312-H321 PolarHBondContact OH-ND1 3.25Å; H317-H321 VanDerWaalsContact O-CB 3.28Å; H317-H321 WeakPolarHBondContact O-CB 3.39Å; H317-H321 PolarHBondContact O-N 2.9Å; L318-H321 CarbonylContact O-C 3.6Å; L318-H321 WeakPolarHBondContact O-CA 3.28Å; L318-H321 WeakPolarHBondContact O-CB 3.48Å; L318-H321 PolarHBondContact O-N 3.36Å; L318-H321 VanDerWaalsContact O-N 3.09Å; K319-H321 VanDerWaalsContact C-N 3.29Å; K319-H321 PolarHBondContact O-N 2.67Å; H321-R323 PolarHBondContact O-N 2.74Å; H321-R323 VanDerWaalsContact O-N 3.13Å; H321-T324 PolarHBondContact CE1-OG1 3.41Å; H321-T324 PolarHBondContact ND1-OG1 3.39Å; H321-T324 VanDerWaalsContact O-CB 3.3Å; H321-T324 WeakPolarHBondContact O-CB 3.29Å; H321-T324 WeakPolarHBondContact O-CG2 3.27Å; H321-T324 PolarHBondContact O-N 3.34Å; H321-T324 PolarHBondContact O-OG1 2.89Å; H321-H325 AromaticContact CE1-CD2 3.88Å; H321-H325 AromaticContact CE1-NE2 3.32Å; H321-H325 PolarHBondContact CE1-NE2 3.45Å; H321-H325 VanDerWaalsContact CE1-NE2 3.32Å; H321-H325 AromaticContact NE2-CD2 3.77Å; H321-H325 AromaticContact NE2-NE2 3.26Å; H321-H325 PolarHBondContact NE2-NE2 3.17Å |
| 322 | L | 89.3 | Confident | 88.8 | Confident | 57 Ų | 57 | 69.2 Ų | 69.2 | 30% | 0.298 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -57.5 | -29.9 | 178.7 | -72.7 | 172.8 | 0 | 0 | 0 | 112.4 | L318 K319 T324 H325 T326 | L318-L322 HydrophobicContact CD1-CD2 4.47Å; L318-L322 HydrophobicContact CD1-CG 4.21Å; L318-L322 HydrophobicContact CG-CD1 4.32Å; L318-L322 HydrophobicContact CG-CG 4.42Å; L318-L322 WeakPolarHBondContact O-CG 3.47Å; L318-L322 PolarHBondContact O-N 3.28Å; K319-L322 PolarHBondContact O-N 3.44Å; L322-T324 PolarHBondContact O-N 3.45Å; L322-T324 VanDerWaalsContact O-N 3.16Å; L322-H325 WeakPolarHBondContact O-CB 3.47Å; L322-H325 PolarHBondContact O-N 3.32Å; L322-T326 PolarHBondContact O-N 3.12Å; L322-T326 VanDerWaalsContact O-N 3.12Å; L322-T326 PolarHBondContact O-OG1 3.43Å |
| 323 | R | 89.4 | Confident | 88.9 | Confident | 38 Ų | 38 | 67.3 Ų | 67.3 | 14% | 0.143 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -60.2 | -23 | 172.5 | -62.7 | 178.4 | -178.1 | 139.1 | 0.8 | 114 | A320 H321 H325 T326 G327 E328 A343 | A320-R323 WeakPolarHBondContact O-CB 3.41Å; A320-R323 PolarHBondContact O-N 3.43Å; H321-R323 PolarHBondContact O-N 2.74Å; H321-R323 VanDerWaalsContact O-N 3.13Å; R323-H325 VanDerWaalsContact C-N 3.26Å; R323-H325 PolarHBondContact O-N 3.49Å; R323-T326 WeakPolarHBondContact CA-OG1 3.3Å; R323-G327 VanDerWaalsContact O-CA 3.31Å; R323-G327 WeakPolarHBondContact O-CA 3.44Å; R323-G327 PolarHBondContact O-N 3.41Å; R323-E328 HydrophobicContact CB-CB 4.49Å; R323-E328 HydrophobicContact CG-CB 4.29Å; R323-E328 PolarHBondContact O-N 3.49Å; R323-A343 HydrophobicContact CB-CB 4.07Å; R323-A343 WeakPolarHBondContact CD-O 3.42Å; R323-A343 PolarHBondContact NH1-O 2.88Å |
| 324 | T | 87 | Confident | 89 | Confident | 94 Ų | 94 | 67.8 Ų | 67.8 | 58% | 0.577 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -72.7 | -21.7 | 174.2 | 68.3 | 0 | 0 | 0 | 0 | 112.8 | H321 L322 | H321-T324 PolarHBondContact CE1-OG1 3.41Å; H321-T324 PolarHBondContact ND1-OG1 3.39Å; H321-T324 VanDerWaalsContact O-CB 3.3Å; H321-T324 WeakPolarHBondContact O-CB 3.29Å; H321-T324 WeakPolarHBondContact O-CG2 3.27Å; H321-T324 PolarHBondContact O-N 3.34Å; H321-T324 PolarHBondContact O-OG1 2.89Å; L322-T324 PolarHBondContact O-N 3.45Å; L322-T324 VanDerWaalsContact O-N 3.16Å |
| 325 | H | 87.1 | Confident | 89.1 | Confident | 57 Ų | 57 | 70 Ų | 70 | 26% | 0.264 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -90.5 | -41.6 | 175 | -67.3 | -60.9 | 0 | 0 | 0 | 112.1 | F305 C308 H321 L322 R323 G327 | F305-H325 HydrophobicContact CD1-CB 4.3Å; F305-H325 AromaticContact CD1-CE1 3.55Å; F305-H325 AromaticContact CD1-CG 3.72Å; F305-H325 AromaticContact CD1-ND1 3.24Å; F305-H325 WeakPolarHBondContact CD1-ND1 3.49Å; F305-H325 HydrophobicContact CD2-CB 3.62Å; F305-H325 AromaticContact CD2-CG 3.78Å; F305-H325 HydrophobicContact CE1-CB 4.43Å; F305-H325 AromaticContact CE1-ND1 3.59Å; F305-H325 HydrophobicContact CE2-CB 3.77Å; F305-H325 HydrophobicContact CG-CB 3.9Å; F305-H325 AromaticContact CG-CD2 3.82Å; F305-H325 AromaticContact CG-CE1 3.88Å; F305-H325 AromaticContact CG-CG 3.48Å; F305-H325 VanDerWaalsContact CG-CG 3.48Å; F305-H325 AromaticContact CG-ND1 3.54Å; F305-H325 HydrophobicContact CZ-CB 4.17Å; C308-H325 PolarHBondContact SG-NE2 3.39Å; H321-H325 AromaticContact CE1-CD2 3.88Å; H321-H325 AromaticContact CE1-NE2 3.32Å; H321-H325 PolarHBondContact CE1-NE2 3.45Å; H321-H325 VanDerWaalsContact CE1-NE2 3.32Å; H321-H325 AromaticContact NE2-CD2 3.77Å; H321-H325 AromaticContact NE2-NE2 3.26Å; H321-H325 PolarHBondContact NE2-NE2 3.17Å; L322-H325 WeakPolarHBondContact O-CB 3.47Å; L322-H325 PolarHBondContact O-N 3.32Å; R323-H325 VanDerWaalsContact C-N 3.26Å; R323-H325 PolarHBondContact O-N 3.49Å; H325-G327 VanDerWaalsContact C-N 3.34Å |
| 326 | T | 85.3 | Confident | 89.2 | Confident | 87 Ų | 87 | 74.7 Ų | 74.7 | 53% | 0.534 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -80.4 | -17.2 | 179.6 | 59.5 | 0 | 0 | 0 | 0 | 113 | L322 R323 E328 | L322-T326 PolarHBondContact O-N 3.12Å; L322-T326 VanDerWaalsContact O-N 3.12Å; L322-T326 PolarHBondContact O-OG1 3.43Å; R323-T326 WeakPolarHBondContact CA-OG1 3.3Å; T326-E328 PolarHBondContact O-N 2.84Å; T326-E328 WeakPolarHBondContact OG1-CG 3.32Å; T326-E328 PolarHBondContact OG1-N 2.82Å |
| 327 | G | 86.1 | Confident | 89.4 | Confident | 51 Ų | 51 | 75.8 Ų | 75.8 | 53% | 0.526 | 41% | 0.41 | S | S | . | . | trans | 72.4 | 8.1 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | R323 H325 K329 | R323-G327 VanDerWaalsContact O-CA 3.31Å; R323-G327 WeakPolarHBondContact O-CA 3.44Å; R323-G327 PolarHBondContact O-N 3.41Å; H325-G327 VanDerWaalsContact C-N 3.34Å; G327-K329 PolarHBondContact O-N 3.19Å | ||
| 328 | E | 86.4 | Confident | 89.5 | Confident | 114 Ų | 114 | 72.8 Ų | 72.8 | 53% | 0.533 | 40% | 0.398 | S | S | . | . | trans | -63.6 | 129.3 | 179.8 | -75.2 | 178.3 | -174.7 | 0 | 0 | 111.4 | R323 T326 | R323-E328 HydrophobicContact CB-CB 4.49Å; R323-E328 HydrophobicContact CG-CB 4.29Å; R323-E328 PolarHBondContact O-N 3.49Å; T326-E328 PolarHBondContact O-N 2.84Å; T326-E328 WeakPolarHBondContact OG1-CG 3.32Å; T326-E328 PolarHBondContact OG1-N 2.82Å | ||
| 329 | K | 89.8 | Confident | 89.5 | Confident | 124 Ų | 124 | 74.8 Ų | 74.8 | 54% | 0.539 | 43% | 0.425 | S | S | . | . | trans | -127.8 | 81.6 | 177.8 | -68.7 | 171.4 | 172.7 | -167.6 | 0 | 109.7 | G327 Y331 K341 F342 | G327-K329 PolarHBondContact O-N 3.19Å; K329-Y331 PolarHBondContact O-N 2.86Å; K329-K341 HydrophobicContact CB-CB 3.68Å; K329-K341 HydrophobicContact CD-CB 4.06Å; K329-K341 WeakPolarHBondContact CD-O 3.43Å; K329-K341 HydrophobicContact CG-CB 4.48Å; K329-F342 CarbonylContact C-O 3.56Å; K329-F342 VanDerWaalsContact C-O 3.28Å; K329-F342 VanDerWaalsContact CA-O 3.22Å; K329-F342 WeakPolarHBondContact CA-O 3.31Å | ||
| 330 | P | 87.8 | Confident | 89.8 | Confident | 64 Ų | 64 | 76.1 Ų | 76.1 | 42% | 0.416 | 43% | 0.427 | S | S | . | . | trans | -67.6 | -25 | -174.7 | -19.9 | 33.2 | 0 | 0 | 0 | 113.1 | ||||
| 331 | Y | 90.9 | Very high | 90 | Very high | 71 Ų | 71 | 81.2 Ų | 81.2 | 28% | 0.278 | 45% | 0.445 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.2 | 109.9 | -170.9 | -54.6 | -81.1 | 0 | 0 | 0 | 109.9 | K329 K341 F342 A343 | K329-Y331 PolarHBondContact O-N 2.86Å; Y331-K341 CarbonylContact O-C 3.5Å; Y331-K341 WeakPolarHBondContact O-CA 3.34Å; Y331-F342 WeakPolarHBondContact CD2-O 3.44Å; Y331-F342 PolarHBondContact N-O 3.29Å; Y331-F342 VanDerWaalsContact N-O 3.15Å; Y331-F342 PolarHBondContact O-N 2.92Å; Y331-A343 WeakPolarHBondContact CE2-O 3.42Å |
| 332 | H | 92.6 | Very high | 90.1 | Very high | 105 Ų | 105 | 81.9 Ų | 81.9 | 49% | 0.486 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 147.4 | 178.6 | 52.9 | -92.6 | 0 | 0 | 0 | 111 | K341 L348 | H332-K341 HydrophobicContact CB-CG 4.32Å; H332-L348 WeakPolarHBondContact O-CD1 3.5Å; H332-L348 WeakPolarHBondContact O-CD2 3.27Å |
| 333 | C | 94.6 | Very high | 90.1 | Very high | 10 Ų | 10 | 79.9 Ų | 79.9 | 7% | 0.068 | 44% | 0.44 | C | S | . | . | trans | -76.3 | 126.1 | 169 | -169.5 | 0 | 0 | 0 | 0 | 109.9 | W335 C338 W340 L348 | C333-W335 VanDerWaalsContact C-N 3.27Å; C333-W335 VanDerWaalsContact SG-CB 3.56Å; C333-C338 HydrophobicContact CB-CB 4.25Å; C333-W340 WeakPolarHBondContact CB-O 3.32Å; C333-W340 PolarHBondContact N-O 2.98Å; C333-L348 HydrophobicContact CB-CD1 4.08Å | ||
| 334 | S | 92.3 | Very high | 90 | Very high | 66 Ų | 66 | 82.9 Ų | 82.9 | 46% | 0.462 | 45% | 0.451 | S | S | . | . | trans | -88.4 | 10.4 | 176.2 | -42.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 335 | W | 91.8 | Very high | 90.1 | Very high | 110 Ų | 110 | 80.5 Ų | 80.5 | 42% | 0.417 | 44% | 0.438 | S | S | . | . | S | Bend | trans | -77.8 | 130.1 | 178.2 | -169 | -83.2 | 0 | 0 | 0 | 110 | C333 G337 C338 F352 H355 T356 | C333-W335 VanDerWaalsContact C-N 3.27Å; C333-W335 VanDerWaalsContact SG-CB 3.56Å; W335-G337 PolarHBondContact O-N 2.98Å; W335-C338 HydrophobicContact CB-CB 3.88Å; W335-C338 WeakPolarHBondContact O-CA 3.01Å; W335-C338 WeakPolarHBondContact O-CB 3.41Å; W335-C338 PolarHBondContact O-N 2.79Å; W335-F352 HydrophobicContact CE3-CE1 4.11Å; W335-F352 HydrophobicContact CE3-CE2 4.36Å; W335-F352 AromaticContact CE3-CZ 3.72Å; W335-F352 HydrophobicContact CE3-CZ 3.72Å; W335-F352 HydrophobicContact CZ3-CE1 4.28Å; W335-F352 HydrophobicContact CZ3-CZ 4.24Å; W335-H355 AromaticContact CD1-CE1 3.64Å; W335-H355 AromaticContact CD1-ND1 3.45Å; W335-H355 HydrophobicContact CD2-CB 3.53Å; W335-H355 AromaticContact CD2-CG 3.56Å; W335-H355 AromaticContact CD2-ND1 3.71Å; W335-H355 AromaticContact CE2-ND1 3.82Å; W335-H355 HydrophobicContact CE3-CB 3.45Å; W335-H355 VanDerWaalsContact CE3-CB 3.45Å; W335-H355 AromaticContact CE3-CG 3.92Å; W335-H355 HydrophobicContact CG-CB 4.12Å; W335-H355 AromaticContact CG-CD2 3.88Å; W335-H355 AromaticContact CG-CE1 3.72Å; W335-H355 AromaticContact CG-CG 3.58Å; W335-H355 AromaticContact CG-ND1 3.47Å; W335-H355 AromaticContact CG-NE2 3.99Å; W335-H355 HydrophobicContact CH2-CB 4.06Å; W335-H355 HydrophobicContact CZ2-CB 4.14Å; W335-H355 HydrophobicContact CZ3-CB 3.72Å; W335-H355 AromaticContact NE1-ND1 3.66Å; W335-T356 HydrophobicContact CZ3-CG2 4.37Å |
| 336 | E | 92.2 | Very high | 90.2 | Very high | 175 Ų | 175 | 81.2 Ų | 81.2 | 82% | 0.818 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.5 | 128.3 | -178.9 | -68.6 | -58.8 | 141.8 | 0 | 0 | 111.9 | C338 | E336-C338 PolarHBondContact O-N 3.06Š|
| 337 | G | 90.6 | Very high | 90.4 | Very high | 88 Ų | 88 | 79.7 Ų | 79.7 | 91% | 0.907 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76.5 | -0.3 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | W335 | W335-G337 PolarHBondContact O-N 2.98Š|
| 338 | C | 91.6 | Very high | 90.8 | Very high | 20 Ų | 20 | 77.7 Ų | 77.7 | 14% | 0.135 | 41% | 0.408 | C | S | . | . | trans | -97.2 | 107.7 | 175.4 | -166.8 | 0 | 0 | 0 | 0 | 111.6 | C333 W335 E336 W340 H351 H355 | C333-C338 HydrophobicContact CB-CB 4.25Å; W335-C338 HydrophobicContact CB-CB 3.88Å; W335-C338 WeakPolarHBondContact O-CA 3.01Å; W335-C338 WeakPolarHBondContact O-CB 3.41Å; W335-C338 PolarHBondContact O-N 2.79Å; E336-C338 PolarHBondContact O-N 3.06Å; C338-W340 VanDerWaalsContact C-N 3.32Å; C338-W340 PolarHBondContact O-N 3.4Å; C338-W340 VanDerWaalsContact SG-CD1 3.6Å; C338-H351 PolarHBondContact SG-NE2 3Å; C338-H355 PolarHBondContact SG-NE2 2.91Å; C338-H355 VanDerWaalsContact SG-NE2 3.37Å | ||
| 339 | G | 90.8 | Very high | 91 | Very high | 69 Ų | 69 | 73.2 Ų | 73.2 | 71% | 0.711 | 39% | 0.389 | S | S | * | . | trans | -87.4 | 13.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 340 | W | 93.6 | Very high | 91.1 | Very high | 168 Ų | 168 | 71.9 Ų | 71.9 | 64% | 0.636 | 38% | 0.38 | S | S | * | . | trans | -77.8 | 134.2 | -171.1 | -76.5 | 69.1 | 0 | 0 | 0 | 112.4 | C333 C338 F342 H351 | C333-W340 WeakPolarHBondContact CB-O 3.32Å; C333-W340 PolarHBondContact N-O 2.98Å; C338-W340 VanDerWaalsContact C-N 3.32Å; C338-W340 PolarHBondContact O-N 3.4Å; C338-W340 VanDerWaalsContact SG-CD1 3.6Å; W340-F342 HydrophobicContact CB-CE2 3.88Å; W340-F342 HydrophobicContact CB-CZ 3.85Å; W340-F342 HydrophobicContact CE3-CE1 4.24Å; W340-F342 HydrophobicContact CE3-CZ 4.04Å; W340-H351 AromaticContact CG-CE1 3.8Å | ||
| 341 | K | 93.1 | Very high | 91.4 | Very high | 125 Ų | 125 | 69.6 Ų | 69.6 | 54% | 0.543 | 36% | 0.364 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.4 | 144.9 | 177.7 | -54.2 | -177.6 | -178.2 | 179.5 | 0 | 110.9 | K329 Y331 H332 | K329-K341 HydrophobicContact CB-CB 3.68Å; K329-K341 HydrophobicContact CD-CB 4.06Å; K329-K341 WeakPolarHBondContact CD-O 3.43Å; K329-K341 HydrophobicContact CG-CB 4.48Å; Y331-K341 CarbonylContact O-C 3.5Å; Y331-K341 WeakPolarHBondContact O-CA 3.34Å; H332-K341 HydrophobicContact CB-CG 4.32Å |
| 342 | F | 90.7 | Very high | 91.4 | Very high | 26 Ų | 26 | 67.7 Ų | 67.7 | 11% | 0.114 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.9 | 151.2 | -172.8 | -57.9 | -79.9 | 0 | 0 | 0 | 111.7 | K329 Y331 W340 E347 L348 H351 | K329-F342 CarbonylContact C-O 3.56Å; K329-F342 VanDerWaalsContact C-O 3.28Å; K329-F342 VanDerWaalsContact CA-O 3.22Å; K329-F342 WeakPolarHBondContact CA-O 3.31Å; Y331-F342 WeakPolarHBondContact CD2-O 3.44Å; Y331-F342 PolarHBondContact N-O 3.29Å; Y331-F342 VanDerWaalsContact N-O 3.15Å; Y331-F342 PolarHBondContact O-N 2.92Å; W340-F342 HydrophobicContact CB-CE2 3.88Å; W340-F342 HydrophobicContact CB-CZ 3.85Å; W340-F342 HydrophobicContact CE3-CE1 4.24Å; W340-F342 HydrophobicContact CE3-CZ 4.04Å; F342-E347 HydrophobicContact CB-CB 3.94Å; F342-E347 HydrophobicContact CD1-CB 3.78Å; F342-E347 HydrophobicContact CG-CB 4.05Å; F342-L348 HydrophobicContact CB-CB 4.42Å; F342-L348 HydrophobicContact CD2-CB 3.88Å; F342-L348 HydrophobicContact CD2-CD1 3.85Å; F342-L348 HydrophobicContact CD2-CG 4.49Å; F342-L348 HydrophobicContact CE2-CD1 4.04Å; F342-L348 HydrophobicContact CG-CB 4.36Å; F342-H351 HydrophobicContact CE1-CB 4.05Å; F342-H351 HydrophobicContact CE2-CB 3.68Å; F342-H351 AromaticContact CE2-CD2 3.54Å; F342-H351 AromaticContact CE2-CG 3.53Å; F342-H351 HydrophobicContact CZ-CB 3.36Å; F342-H351 AromaticContact CZ-CD2 3.72Å; F342-H351 AromaticContact CZ-CG 3.24Å; F342-H351 AromaticContact CZ-ND1 3.49Å; F342-H351 WeakPolarHBondContact CZ-ND1 3.46Å |
| 343 | A | 89.2 | Confident | 91.5 | Very high | 15 Ų | 15 | 64 Ų | 64 | 12% | 0.124 | 34% | 0.339 | C | S | . | . | S | Bend | trans | -86.2 | -16.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | R323 Y331 E347 | R323-A343 HydrophobicContact CB-CB 4.07Å; R323-A343 WeakPolarHBondContact CD-O 3.42Å; R323-A343 PolarHBondContact NH1-O 2.88Å; Y331-A343 WeakPolarHBondContact CE2-O 3.42Å; A343-E347 PolarHBondContact N-OE2 2.75Å |
| 344 | R | 87.4 | Confident | 91.3 | Very high | 101 Ų | 101 | 71.4 Ų | 71.4 | 38% | 0.381 | 37% | 0.37 | S | S | . | . | S | Bend | trans | -132.1 | 153.3 | 179.6 | -57.7 | 167.5 | 45.7 | 146.6 | -3.4 | 111.9 | A320 D346 E347 L348 | A320-R344 HydrophobicContact CB-CG 4.27Å; R344-D346 WeakPolarHBondContact CB-OD1 3.32Å; R344-D346 IonicContact CZ-OD1 3.53Å; R344-D346 IonicContact CZ-OD2 3.6Å; R344-D346 IonicContact NE-OD1 3.91Å; R344-D346 PolarHBondContact NE-OD1 3.01Å; R344-D346 IonicContact NE-OD2 2.84Å; R344-D346 IonicContact NH2-OD1 3.4Å; R344-D346 PolarHBondContact NH2-OD1 2.83Å; R344-D346 VanDerWaalsContact NH2-OD1 3.13Å; R344-D346 IonicContact NH2-OD2 2.9Å; R344-D346 PolarHBondContact NH2-OD2 3.15Å; R344-E347 HydrophobicContact CB-CB 4.45Å; R344-E347 HydrophobicContact CB-CG 4.03Å; R344-E347 PolarHBondContact N-OE2 3.47Å; R344-L348 PolarHBondContact O-N 3.15Å |
| 345 | S | 89.1 | Confident | 91.2 | Very high | 44 Ų | 44 | 70.9 Ų | 70.9 | 31% | 0.308 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -68.4 | -42.2 | 179.3 | 49.4 | 0 | 0 | 0 | 0 | 112.7 | E347 L348 T349 | S345-E347 PolarHBondContact O-N 2.86Å; S345-L348 WeakPolarHBondContact O-CA 3.42Å; S345-L348 WeakPolarHBondContact O-CB 3.46Å; S345-L348 PolarHBondContact O-N 3.13Å; S345-T349 PolarHBondContact O-N 3.02Å; S345-T349 PolarHBondContact O-OG1 3.32Å |
| 346 | D | 87.6 | Confident | 91.2 | Very high | 72 Ų | 72 | 68.7 Ų | 68.7 | 39% | 0.385 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62.8 | -31.1 | 178.5 | 64.2 | -54.5 | 0 | 0 | 0 | 112.6 | R344 R350 | R344-D346 WeakPolarHBondContact CB-OD1 3.32Å; R344-D346 IonicContact CZ-OD1 3.53Å; R344-D346 IonicContact CZ-OD2 3.6Å; R344-D346 IonicContact NE-OD1 3.91Å; R344-D346 PolarHBondContact NE-OD1 3.01Å; R344-D346 IonicContact NE-OD2 2.84Å; R344-D346 IonicContact NH2-OD1 3.4Å; R344-D346 PolarHBondContact NH2-OD1 2.83Å; R344-D346 VanDerWaalsContact NH2-OD1 3.13Å; R344-D346 IonicContact NH2-OD2 2.9Å; R344-D346 PolarHBondContact NH2-OD2 3.15Å; D346-R350 VanDerWaalsContact O-CB 3.27Å; D346-R350 WeakPolarHBondContact O-CB 3.09Å; D346-R350 PolarHBondContact O-N 2.75Å |
| 347 | E | 91.1 | Very high | 91.1 | Very high | 55 Ų | 55 | 62.8 Ų | 62.8 | 26% | 0.257 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -66.1 | -43.3 | 172.4 | -67.2 | 175.1 | 167.7 | 0 | 0 | 111.7 | F342 A343 R344 S345 H351 | F342-E347 HydrophobicContact CB-CB 3.94Å; F342-E347 HydrophobicContact CD1-CB 3.78Å; F342-E347 HydrophobicContact CG-CB 4.05Å; A343-E347 PolarHBondContact N-OE2 2.75Å; R344-E347 HydrophobicContact CB-CB 4.45Å; R344-E347 HydrophobicContact CB-CG 4.03Å; R344-E347 PolarHBondContact N-OE2 3.47Å; S345-E347 PolarHBondContact O-N 2.86Å; E347-H351 VanDerWaalsContact O-CB 3.32Å; E347-H351 WeakPolarHBondContact O-CB 3.29Å; E347-H351 PolarHBondContact O-N 3.46Å |
| 348 | L | 93.5 | Very high | 91.2 | Very high | 9 Ų | 9 | 63.1 Ų | 63.1 | 5% | 0.047 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.3 | -48.4 | 174.7 | 172.7 | 62.6 | 0 | 0 | 0 | 110.9 | I67 H332 C333 F342 R344 S345 R350 H351 F352 | I67-L348 HydrophobicContact CD1-CD2 4.11Å; I67-L348 HydrophobicContact CD1-CG 4.24Å; I67-L348 HydrophobicContact CG2-CD2 4.42Å; H332-L348 WeakPolarHBondContact O-CD1 3.5Å; H332-L348 WeakPolarHBondContact O-CD2 3.27Å; C333-L348 HydrophobicContact CB-CD1 4.08Å; F342-L348 HydrophobicContact CB-CB 4.42Å; F342-L348 HydrophobicContact CD2-CB 3.88Å; F342-L348 HydrophobicContact CD2-CD1 3.85Å; F342-L348 HydrophobicContact CD2-CG 4.49Å; F342-L348 HydrophobicContact CE2-CD1 4.04Å; F342-L348 HydrophobicContact CG-CB 4.36Å; R344-L348 PolarHBondContact O-N 3.15Å; S345-L348 WeakPolarHBondContact O-CA 3.42Å; S345-L348 WeakPolarHBondContact O-CB 3.46Å; S345-L348 PolarHBondContact O-N 3.13Å; L348-R350 VanDerWaalsContact C-N 3.34Å; L348-R350 PolarHBondContact O-N 2.68Å; L348-H351 CarbonylContact O-C 3.56Å; L348-H351 WeakPolarHBondContact O-CA 3.32Å; L348-H351 WeakPolarHBondContact O-CB 3.37Å; L348-H351 PolarHBondContact O-N 2.84Å; L348-H351 VanDerWaalsContact O-N 3.1Å; L348-F352 WeakPolarHBondContact O-CB 3.42Å; L348-F352 PolarHBondContact O-N 3.28Å |
| 349 | T | 91.5 | Very high | 91.2 | Very high | 21 Ų | 21 | 69.3 Ų | 69.3 | 13% | 0.129 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -57.9 | -46.8 | 178.2 | -57.4 | 0 | 0 | 0 | 0 | 111.4 | D63 S345 H351 F352 R353 | D63-T349 HydrophobicContact CB-CG2 4.07Å; S345-T349 PolarHBondContact O-N 3.02Å; S345-T349 PolarHBondContact O-OG1 3.32Å; T349-H351 VanDerWaalsContact C-N 3.3Å; T349-H351 PolarHBondContact O-N 2.89Å; T349-F352 PolarHBondContact O-N 3.02Å; T349-R353 PolarHBondContact O-N 2.88Å; T349-R353 VanDerWaalsContact O-N 3.15Å |
| 350 | R | 90.8 | Very high | 91.2 | Very high | 95 Ų | 95 | 68.8 Ų | 68.8 | 36% | 0.358 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -62.7 | -38.1 | 176.4 | 179.1 | 179 | 61.5 | -178.8 | -4.4 | 112.2 | D346 L348 R372 | D346-R350 VanDerWaalsContact O-CB 3.27Å; D346-R350 WeakPolarHBondContact O-CB 3.09Å; D346-R350 PolarHBondContact O-N 2.75Å; L348-R350 VanDerWaalsContact C-N 3.34Å; L348-R350 PolarHBondContact O-N 2.68Å; R350-R372 HydrophobicContact CG-CG 4.34Å |
| 351 | H | 93.4 | Very high | 91.3 | Very high | 17 Ų | 17 | 63.7 Ų | 63.7 | 8% | 0.079 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -65.5 | -42.3 | 174.2 | 170.3 | 83.3 | 0 | 0 | 0 | 111.2 | C338 W340 F342 E347 L348 T349 R353 K354 H355 | C338-H351 PolarHBondContact SG-NE2 3Å; W340-H351 AromaticContact CG-CE1 3.8Å; F342-H351 HydrophobicContact CE1-CB 4.05Å; F342-H351 HydrophobicContact CE2-CB 3.68Å; F342-H351 AromaticContact CE2-CD2 3.54Å; F342-H351 AromaticContact CE2-CG 3.53Å; F342-H351 HydrophobicContact CZ-CB 3.36Å; F342-H351 AromaticContact CZ-CD2 3.72Å; F342-H351 AromaticContact CZ-CG 3.24Å; F342-H351 AromaticContact CZ-ND1 3.49Å; F342-H351 WeakPolarHBondContact CZ-ND1 3.46Å; E347-H351 VanDerWaalsContact O-CB 3.32Å; E347-H351 WeakPolarHBondContact O-CB 3.29Å; E347-H351 PolarHBondContact O-N 3.46Å; L348-H351 CarbonylContact O-C 3.56Å; L348-H351 WeakPolarHBondContact O-CA 3.32Å; L348-H351 WeakPolarHBondContact O-CB 3.37Å; L348-H351 PolarHBondContact O-N 2.84Å; L348-H351 VanDerWaalsContact O-N 3.1Å; T349-H351 VanDerWaalsContact C-N 3.3Å; T349-H351 PolarHBondContact O-N 2.89Å; H351-R353 PolarHBondContact O-N 3.08Å; H351-K354 WeakPolarHBondContact O-CB 3.49Å; H351-K354 WeakPolarHBondContact O-CG 3.22Å; H351-K354 PolarHBondContact O-N 3.41Å; H351-H355 AromaticContact CD2-NE2 3.93Å; H351-H355 AromaticContact CE1-NE2 3.78Å; H351-H355 AromaticContact NE2-CD2 3.88Å; H351-H355 AromaticContact NE2-NE2 3.2Å; H351-H355 PolarHBondContact NE2-NE2 3.23Å |
| 352 | F | 91.8 | Very high | 91.4 | Very high | 31 Ų | 31 | 64.1 Ų | 64.1 | 14% | 0.136 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -60.8 | -33.8 | 180 | -151.6 | -80.4 | 0 | 0 | 0 | 112.6 | F66 W335 L348 T349 K354 H355 T356 | F66-F352 HydrophobicContact CD1-CD1 4.11Å; F66-F352 HydrophobicContact CD1-CE1 4.19Å; F66-F352 AromaticContact CE1-CD1 3.38Å; F66-F352 HydrophobicContact CE1-CD1 3.38Å; F66-F352 AromaticContact CE1-CE1 3.08Å; F66-F352 HydrophobicContact CE1-CE1 3.08Å; F66-F352 HydrophobicContact CE1-CE2 4.42Å; F66-F352 HydrophobicContact CE1-CG 4.2Å; F66-F352 AromaticContact CE1-CZ 3.65Å; F66-F352 HydrophobicContact CE1-CZ 3.65Å; F66-F352 HydrophobicContact CZ-CD1 4.08Å; F66-F352 AromaticContact CZ-CE1 3.52Å; F66-F352 HydrophobicContact CZ-CE1 3.52Å; F66-F352 HydrophobicContact CZ-CZ 4.21Å; W335-F352 HydrophobicContact CE3-CE1 4.11Å; W335-F352 HydrophobicContact CE3-CE2 4.36Å; W335-F352 AromaticContact CE3-CZ 3.72Å; W335-F352 HydrophobicContact CE3-CZ 3.72Å; W335-F352 HydrophobicContact CZ3-CE1 4.28Å; W335-F352 HydrophobicContact CZ3-CZ 4.24Å; L348-F352 WeakPolarHBondContact O-CB 3.42Å; L348-F352 PolarHBondContact O-N 3.28Å; T349-F352 PolarHBondContact O-N 3.02Å; F352-K354 PolarHBondContact O-N 3.1Å; F352-K354 VanDerWaalsContact O-N 3.08Å; F352-H355 WeakPolarHBondContact O-CB 3.15Å; F352-H355 PolarHBondContact O-N 3.39Å; F352-T356 HydrophobicContact CD1-CG2 3.67Å; F352-T356 HydrophobicContact CE1-CG2 3.46Å; F352-T356 VanDerWaalsContact CE1-CG2 3.46Å; F352-T356 PolarHBondContact O-N 3.35Å; F352-T356 PolarHBondContact O-OG1 3.2Å |
| 353 | R | 93.9 | Very high | 91.7 | Very high | 28 Ų | 28 | 63.1 Ų | 63.1 | 11% | 0.106 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -57.8 | -21.5 | 171.7 | -66.5 | -179 | -178.2 | 161.6 | 2.7 | 113.8 | D63 T349 H351 G357 H358 S371 | D63-R353 IonicContact OD1-NH2 3.51Å; D63-R353 PolarHBondContact OD1-NH2 3.18Å; D63-R353 IonicContact OD2-CZ 2.85Å; D63-R353 IonicContact OD2-NH2 2.67Å; D63-R353 PolarHBondContact OD2-NH2 2.79Å; T349-R353 PolarHBondContact O-N 2.88Å; T349-R353 VanDerWaalsContact O-N 3.15Å; H351-R353 PolarHBondContact O-N 3.08Å; R353-G357 WeakPolarHBondContact O-CA 3.5Å; R353-G357 PolarHBondContact O-N 3.26Å; R353-H358 HydrophobicContact CG-CB 4.3Å; R353-H358 PolarHBondContact O-N 3.21Å; R353-S371 WeakPolarHBondContact CD-O 3.4Å; R353-S371 PolarHBondContact NH1-O 3.15Å |
| 354 | K | 91 | Very high | 91.9 | Very high | 165 Ų | 165 | 69.8 Ų | 69.8 | 72% | 0.717 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -73.3 | -33.5 | 174.1 | -59.5 | -177.4 | 175.9 | -173.1 | 0 | 112.2 | H351 F352 | H351-K354 WeakPolarHBondContact O-CB 3.49Å; H351-K354 WeakPolarHBondContact O-CG 3.22Å; H351-K354 PolarHBondContact O-N 3.41Å; F352-K354 PolarHBondContact O-N 3.1Å; F352-K354 VanDerWaalsContact O-N 3.08Å |
| 355 | H | 91.5 | Very high | 92.3 | Very high | 54 Ų | 54 | 69.7 Ų | 69.7 | 25% | 0.25 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -74.9 | -44.8 | 176.9 | -67.7 | -64.3 | 0 | 0 | 0 | 111.5 | W335 C338 H351 F352 G357 | W335-H355 AromaticContact CD1-CE1 3.64Å; W335-H355 AromaticContact CD1-ND1 3.45Å; W335-H355 HydrophobicContact CD2-CB 3.53Å; W335-H355 AromaticContact CD2-CG 3.56Å; W335-H355 AromaticContact CD2-ND1 3.71Å; W335-H355 AromaticContact CE2-ND1 3.82Å; W335-H355 HydrophobicContact CE3-CB 3.45Å; W335-H355 VanDerWaalsContact CE3-CB 3.45Å; W335-H355 AromaticContact CE3-CG 3.92Å; W335-H355 HydrophobicContact CG-CB 4.12Å; W335-H355 AromaticContact CG-CD2 3.88Å; W335-H355 AromaticContact CG-CE1 3.72Å; W335-H355 AromaticContact CG-CG 3.58Å; W335-H355 AromaticContact CG-ND1 3.47Å; W335-H355 AromaticContact CG-NE2 3.99Å; W335-H355 HydrophobicContact CH2-CB 4.06Å; W335-H355 HydrophobicContact CZ2-CB 4.14Å; W335-H355 HydrophobicContact CZ3-CB 3.72Å; W335-H355 AromaticContact NE1-ND1 3.66Å; C338-H355 PolarHBondContact SG-NE2 2.91Å; C338-H355 VanDerWaalsContact SG-NE2 3.37Å; H351-H355 AromaticContact CD2-NE2 3.93Å; H351-H355 AromaticContact CE1-NE2 3.78Å; H351-H355 AromaticContact NE2-CD2 3.88Å; H351-H355 AromaticContact NE2-NE2 3.2Å; H351-H355 PolarHBondContact NE2-NE2 3.23Å; F352-H355 WeakPolarHBondContact O-CB 3.15Å; F352-H355 PolarHBondContact O-N 3.39Å; H355-G357 VanDerWaalsContact C-N 3.34Å |
| 356 | T | 90.8 | Very high | 92.6 | Very high | 65 Ų | 65 | 69.5 Ų | 69.5 | 40% | 0.399 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -82 | -14.1 | -177.2 | 58 | 0 | 0 | 0 | 0 | 113.7 | F66 W335 F352 H358 | F66-T356 HydrophobicContact CZ-CG2 4.38Å; W335-T356 HydrophobicContact CZ3-CG2 4.37Å; F352-T356 HydrophobicContact CD1-CG2 3.67Å; F352-T356 HydrophobicContact CE1-CG2 3.46Å; F352-T356 VanDerWaalsContact CE1-CG2 3.46Å; F352-T356 PolarHBondContact O-N 3.35Å; F352-T356 PolarHBondContact O-OG1 3.2Å; T356-H358 PolarHBondContact O-N 2.92Å; T356-H358 VanDerWaalsContact OG1-CB 3.29Å; T356-H358 WeakPolarHBondContact OG1-CB 3.47Å; T356-H358 PolarHBondContact OG1-N 3.33Å |
| 357 | G | 91.1 | Very high | 92.9 | Very high | 51 Ų | 51 | 74.8 Ų | 74.8 | 53% | 0.526 | 37% | 0.366 | S | S | . | . | trans | 65.8 | 14.2 | -170.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | R353 H355 R359 | R353-G357 WeakPolarHBondContact O-CA 3.5Å; R353-G357 PolarHBondContact O-N 3.26Å; H355-G357 VanDerWaalsContact C-N 3.34Å; G357-R359 PolarHBondContact O-N 3.44Å | ||
| 358 | H | 92.1 | Very high | 93 | Very high | 95 Ų | 95 | 79.1 Ų | 79.1 | 44% | 0.44 | 38% | 0.38 | S | S | . | . | trans | -64.8 | 124.9 | -175 | -176.1 | -127.1 | 0 | 0 | 0 | 111.7 | R353 T356 | R353-H358 HydrophobicContact CG-CB 4.3Å; R353-H358 PolarHBondContact O-N 3.21Å; T356-H358 PolarHBondContact O-N 2.92Å; T356-H358 VanDerWaalsContact OG1-CB 3.29Å; T356-H358 WeakPolarHBondContact OG1-CB 3.47Å; T356-H358 PolarHBondContact OG1-N 3.33Å | ||
| 359 | R | 92.4 | Very high | 93.1 | Very high | 149 Ų | 149 | 79.8 Ų | 79.8 | 56% | 0.562 | 39% | 0.386 | S | S | * | . | trans | -131.1 | 79.9 | -175.5 | -73.6 | 175.6 | 140 | -163.9 | -7.1 | 110.9 | G357 F361 A369 F370 | G357-R359 PolarHBondContact O-N 3.44Å; R359-F361 VanDerWaalsContact C-N 3.25Å; R359-F361 PolarHBondContact O-N 3.46Å; R359-A369 HydrophobicContact CB-CB 3.86Å; R359-A369 WeakPolarHBondContact CD-O 3.17Å; R359-A369 PolarHBondContact NE-O 3.4Å; R359-A369 VanDerWaalsContact NE-O 3.13Å; R359-A369 PolarHBondContact NH1-O 3.09Å; R359-A369 VanDerWaalsContact NH1-O 3.15Å; R359-A369 PolarHBondContact NH2-O 3.17Å; R359-F370 CarbonylContact C-O 3.54Å; R359-F370 WeakPolarHBondContact CA-O 3.35Å | ||
| 360 | P | 90.7 | Very high | 93.2 | Very high | 58 Ų | 58 | 80.1 Ų | 80.1 | 38% | 0.377 | 39% | 0.386 | S | S | . | . | trans | -73.1 | -14.9 | -175 | 27.1 | -32.5 | 0 | 0 | 0 | 113.7 | ||||
| 361 | F | 94.4 | Very high | 93.3 | Very high | 62 Ų | 62 | 77.2 Ų | 77.2 | 27% | 0.272 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.6 | 92.7 | -173.7 | -57 | -76.3 | 0 | 0 | 0 | 111.5 | R359 A369 F370 R372 L376 | R359-F361 VanDerWaalsContact C-N 3.25Å; R359-F361 PolarHBondContact O-N 3.46Å; F361-A369 CarbonylContact O-C 3.33Å; F361-A369 WeakPolarHBondContact O-CA 3.42Å; F361-F370 HydrophobicContact CB-CB 4.29Å; F361-F370 WeakPolarHBondContact CB-O 3.44Å; F361-F370 PolarHBondContact N-O 3.37Å; F361-F370 PolarHBondContact O-N 2.95Å; F361-R372 VanDerWaalsContact CD2-CA 3.5Å; F361-L376 HydrophobicContact CB-CB 4.19Å; F361-L376 HydrophobicContact CB-CD2 3.98Å |
| 362 | Q | 95.3 | Very high | 93.2 | Very high | 134 Ų | 134 | 79.8 Ų | 79.8 | 63% | 0.626 | 39% | 0.389 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86.9 | 138.1 | 177.7 | -165.5 | 170.6 | 5.1 | 0 | 0 | 112.1 | A369 | Q362-A369 HydrophobicContact CB-CB 4.48Å |
| 363 | C | 96.6 | Very high | 93.3 | Very high | 5 Ų | 5 | 81.6 Ų | 81.6 | 3% | 0.034 | 41% | 0.406 | C | S | . | . | trans | -72.9 | 139.4 | 167.9 | -175.2 | 0 | 0 | 0 | 0 | 109.7 | L365 C366 R368 F370 L376 | C363-L365 PolarHBondContact SG-N 3.32Å; C363-L365 VanDerWaalsContact SG-N 3.45Å; C363-C366 CarbonylContact C-O 3.51Å; C363-C366 WeakPolarHBondContact CB-O 3.38Å; C363-R368 VanDerWaalsContact CB-O 3.29Å; C363-R368 WeakPolarHBondContact CB-O 3.34Å; C363-R368 PolarHBondContact N-O 3.35Å; C363-F370 HydrophobicContact CB-CE2 4.5Å; C363-L376 HydrophobicContact CB-CD1 3.85Å | ||
| 364 | H | 94.6 | Very high | 93.3 | Very high | 154 Ų | 154 | 83.3 Ų | 83.3 | 71% | 0.713 | 42% | 0.417 | S | S | * | . | S | Bend | trans | -90 | -13.1 | 177.7 | 60.2 | -86.9 | 0 | 0 | 0 | 113 | M380 | H364-M380 WeakPolarHBondContact CE1-CE 3.18Š|
| 365 | L | 94.7 | Very high | 93.5 | Very high | 99 Ų | 99 | 79.1 Ų | 79.1 | 52% | 0.518 | 40% | 0.4 | S | S | . | . | S | Bend | trans | -96 | -18.1 | 178.9 | -58.7 | 177.8 | 0 | 0 | 0 | 112.4 | C363 M380 H383 | C363-L365 PolarHBondContact SG-N 3.32Å; C363-L365 VanDerWaalsContact SG-N 3.45Å; L365-M380 HydrophobicContact CD1-CE 3.55Å; L365-M380 HydrophobicContact CG-CE 4.08Å; L365-H383 HydrophobicContact CD1-CB 3.47Å; L365-H383 VanDerWaalsContact CD1-CB 3.47Å |
| 366 | C | 95.5 | Very high | 93.7 | Very high | 40 Ų | 40 | 78.1 Ų | 78.1 | 27% | 0.27 | 40% | 0.396 | S | S | . | . | S | Bend | trans | -151.4 | 167.6 | 174.2 | 73 | 0 | 0 | 0 | 0 | 111 | C363 R368 H379 | C363-C366 CarbonylContact C-O 3.51Å; C363-C366 WeakPolarHBondContact CB-O 3.38Å; C366-R368 PolarHBondContact O-N 3.31Å; C366-H379 PolarHBondContact SG-NE2 3.39Å |
| 367 | E | 93.5 | Very high | 93.9 | Very high | 184 Ų | 184 | 77.7 Ų | 77.7 | 86% | 0.86 | 40% | 0.399 | S | S | * | . | S | Bend | trans | -75.4 | 8.7 | -174.8 | -60.8 | 178.4 | 175 | 0 | 0 | 114.5 | A369 | E367-A369 PolarHBondContact O-N 3.23Š|
| 368 | R | 94.4 | Very high | 94.2 | Very high | 146 Ų | 146 | 80.1 Ų | 80.1 | 55% | 0.551 | 40% | 0.4 | S | S | * | . | trans | -76.8 | 126.6 | -179.1 | -69.7 | -176.3 | 171.6 | 179.1 | -2.5 | 111.1 | C363 C366 F370 | C363-R368 VanDerWaalsContact CB-O 3.29Å; C363-R368 WeakPolarHBondContact CB-O 3.34Å; C363-R368 PolarHBondContact N-O 3.35Å; C366-R368 PolarHBondContact O-N 3.31Å; R368-F370 HydrophobicContact CB-CE2 3.91Å; R368-F370 HydrophobicContact CB-CZ 3.96Å | ||
| 369 | A | 94.7 | Very high | 94.3 | Very high | 22 Ų | 22 | 76 Ų | 76 | 18% | 0.182 | 38% | 0.38 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.3 | 150.5 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | R359 F361 Q362 E367 | R359-A369 HydrophobicContact CB-CB 3.86Å; R359-A369 WeakPolarHBondContact CD-O 3.17Å; R359-A369 PolarHBondContact NE-O 3.4Å; R359-A369 VanDerWaalsContact NE-O 3.13Å; R359-A369 PolarHBondContact NH1-O 3.09Å; R359-A369 VanDerWaalsContact NH1-O 3.15Å; R359-A369 PolarHBondContact NH2-O 3.17Å; F361-A369 CarbonylContact O-C 3.33Å; F361-A369 WeakPolarHBondContact O-CA 3.42Å; Q362-A369 HydrophobicContact CB-CB 4.48Å; E367-A369 PolarHBondContact O-N 3.23Å |
| 370 | F | 93.7 | Very high | 94.5 | Very high | 28 Ų | 28 | 70.7 Ų | 70.7 | 12% | 0.123 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129 | 149.6 | -174.9 | -58.1 | -89.5 | 0 | 0 | 0 | 110.6 | R359 F361 C363 R368 R372 H375 L376 H379 | R359-F370 CarbonylContact C-O 3.54Å; R359-F370 WeakPolarHBondContact CA-O 3.35Å; F361-F370 HydrophobicContact CB-CB 4.29Å; F361-F370 WeakPolarHBondContact CB-O 3.44Å; F361-F370 PolarHBondContact N-O 3.37Å; F361-F370 PolarHBondContact O-N 2.95Å; C363-F370 HydrophobicContact CB-CE2 4.5Å; R368-F370 HydrophobicContact CB-CE2 3.91Å; R368-F370 HydrophobicContact CB-CZ 3.96Å; F370-R372 VanDerWaalsContact C-N 3.3Å; F370-H375 HydrophobicContact CB-CB 4.23Å; F370-H375 HydrophobicContact CD1-CB 3.92Å; F370-H375 HydrophobicContact CG-CB 4.32Å; F370-L376 HydrophobicContact CB-CB 4.41Å; F370-L376 HydrophobicContact CD2-CB 3.94Å; F370-L376 HydrophobicContact CD2-CD1 3.83Å; F370-L376 HydrophobicContact CD2-CG 4.49Å; F370-L376 HydrophobicContact CE2-CD1 3.96Å; F370-L376 HydrophobicContact CG-CB 4.33Å; F370-H379 HydrophobicContact CE1-CB 4.01Å; F370-H379 HydrophobicContact CE2-CB 3.87Å; F370-H379 AromaticContact CE2-CD2 3.32Å; F370-H379 WeakPolarHBondContact CE2-CD2 3.34Å; F370-H379 AromaticContact CE2-CG 3.66Å; F370-H379 HydrophobicContact CZ-CB 3.43Å; F370-H379 VanDerWaalsContact CZ-CB 3.43Å; F370-H379 AromaticContact CZ-CD2 3.42Å; F370-H379 VanDerWaalsContact CZ-CD2 3.42Å; F370-H379 WeakPolarHBondContact CZ-CD2 3.29Å; F370-H379 AromaticContact CZ-CG 3.27Å; F370-H379 AromaticContact CZ-ND1 3.93Å |
| 371 | S | 92.6 | Very high | 94.7 | Very high | 35 Ų | 35 | 74.5 Ų | 74.5 | 25% | 0.245 | 37% | 0.373 | C | S | . | . | S | Bend | trans | -82.2 | -10.1 | 176.6 | 54.8 | 0 | 0 | 0 | 0 | 113.3 | R353 | R353-S371 WeakPolarHBondContact CD-O 3.4Å; R353-S371 PolarHBondContact NH1-O 3.15Å |
| 372 | R | 92.7 | Very high | 94.7 | Very high | 70 Ų | 70 | 80.1 Ų | 80.1 | 26% | 0.264 | 39% | 0.393 | S | S | . | . | S | Bend | trans | -140 | 145.6 | -179 | -56.5 | 161.9 | 55.4 | 159 | -2.4 | 111.6 | R350 F361 F370 D374 H375 L376 | R350-R372 HydrophobicContact CG-CG 4.34Å; F361-R372 VanDerWaalsContact CD2-CA 3.5Å; F370-R372 VanDerWaalsContact C-N 3.3Å; R372-D374 WeakPolarHBondContact CB-OD1 3.49Å; R372-D374 IonicContact CZ-OD1 3.38Å; R372-D374 IonicContact CZ-OD2 3.51Å; R372-D374 IonicContact NE-OD1 3.13Å; R372-D374 PolarHBondContact NE-OD1 3.43Å; R372-D374 IonicContact NE-OD2 2.68Å; R372-D374 IonicContact NH2-OD1 2.74Å; R372-D374 IonicContact NH2-OD2 2.79Å; R372-D374 PolarHBondContact NH2-OD2 3.36Å; R372-H375 HydrophobicContact CB-CB 4.43Å; R372-H375 PolarHBondContact NE-NE2 2.99Å; R372-H375 PolarHBondContact O-N 2.85Å; R372-L376 PolarHBondContact O-N 3.41Å |
| 373 | S | 93.6 | Very high | 94.5 | Very high | 69 Ų | 69 | 77.3 Ų | 77.3 | 48% | 0.483 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -68.6 | -36.4 | -179.6 | 55.5 | 0 | 0 | 0 | 0 | 113 | H375 L376 A377 | S373-H375 VanDerWaalsContact C-N 3.31Å; S373-H375 PolarHBondContact O-N 3.32Å; S373-L376 WeakPolarHBondContact O-CB 3.5Å; S373-L376 PolarHBondContact O-N 2.87Å; S373-A377 PolarHBondContact O-N 3.34Å |
| 374 | D | 94.1 | Very high | 94.1 | Very high | 65 Ų | 65 | 87.1 Ų | 87.1 | 35% | 0.348 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -65.3 | -35.5 | 177.6 | 64.7 | -40 | 0 | 0 | 0 | 112.1 | R372 A377 L378 | R372-D374 WeakPolarHBondContact CB-OD1 3.49Å; R372-D374 IonicContact CZ-OD1 3.38Å; R372-D374 IonicContact CZ-OD2 3.51Å; R372-D374 IonicContact NE-OD1 3.13Å; R372-D374 PolarHBondContact NE-OD1 3.43Å; R372-D374 IonicContact NE-OD2 2.68Å; R372-D374 IonicContact NH2-OD1 2.74Å; R372-D374 IonicContact NH2-OD2 2.79Å; R372-D374 PolarHBondContact NH2-OD2 3.36Å; D374-A377 PolarHBondContact O-N 3.16Å; D374-L378 WeakPolarHBondContact O-CG 3.4Å; D374-L378 PolarHBondContact O-N 3.12Å |
| 375 | H | 95.1 | Very high | 94.1 | Very high | 77 Ų | 77 | 83.8 Ų | 83.8 | 36% | 0.356 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -66.6 | -41.1 | 173 | -68.7 | -161.4 | 0 | 0 | 0 | 111.6 | F370 R372 S373 H379 | F370-H375 HydrophobicContact CB-CB 4.23Å; F370-H375 HydrophobicContact CD1-CB 3.92Å; F370-H375 HydrophobicContact CG-CB 4.32Å; R372-H375 HydrophobicContact CB-CB 4.43Å; R372-H375 PolarHBondContact NE-NE2 2.99Å; R372-H375 PolarHBondContact O-N 2.85Å; S373-H375 VanDerWaalsContact C-N 3.31Å; S373-H375 PolarHBondContact O-N 3.32Å; H375-H379 WeakPolarHBondContact O-CB 3.49Å; H375-H379 PolarHBondContact O-N 3.43Å |
| 376 | L | 95.6 | Very high | 94.1 | Very high | 32 Ų | 32 | 82.9 Ų | 82.9 | 17% | 0.168 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -61.4 | -47.1 | 172.4 | 173.4 | 62.6 | 0 | 0 | 0 | 110.4 | F361 C363 F370 R372 S373 L378 H379 M380 | F361-L376 HydrophobicContact CB-CB 4.19Å; F361-L376 HydrophobicContact CB-CD2 3.98Å; C363-L376 HydrophobicContact CB-CD1 3.85Å; F370-L376 HydrophobicContact CB-CB 4.41Å; F370-L376 HydrophobicContact CD2-CB 3.94Å; F370-L376 HydrophobicContact CD2-CD1 3.83Å; F370-L376 HydrophobicContact CD2-CG 4.49Å; F370-L376 HydrophobicContact CE2-CD1 3.96Å; F370-L376 HydrophobicContact CG-CB 4.33Å; R372-L376 PolarHBondContact O-N 3.41Å; S373-L376 WeakPolarHBondContact O-CB 3.5Å; S373-L376 PolarHBondContact O-N 2.87Å; L376-L378 VanDerWaalsContact C-N 3.34Å; L376-L378 PolarHBondContact O-N 3.29Å; L376-H379 CarbonylContact O-C 3.28Å; L376-H379 WeakPolarHBondContact O-CA 3.5Å; L376-H379 WeakPolarHBondContact O-CB 3.4Å; L376-H379 PolarHBondContact O-N 2.79Å; L376-M380 HydrophobicContact CD1-CG 4.2Å; L376-M380 HydrophobicContact CD1-SD 4.06Å; L376-M380 HydrophobicContact CG-CG 4.38Å; L376-M380 WeakPolarHBondContact O-CG 3.48Å; L376-M380 PolarHBondContact O-N 3.23Å |
| 377 | A | 95.4 | Very high | 94 | Very high | 57 Ų | 57 | 85.3 Ų | 85.3 | 47% | 0.471 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -60 | -42 | 180 | 0 | 0 | 0 | 0 | 0 | 112.7 | S373 D374 H379 M380 | S373-A377 PolarHBondContact O-N 3.34Å; D374-A377 PolarHBondContact O-N 3.16Å; A377-H379 VanDerWaalsContact C-N 3.34Å; A377-M380 PolarHBondContact O-N 3.48Å |
| 378 | L | 95.9 | Very high | 94 | Very high | 102 Ų | 102 | 79.5 Ų | 79.5 | 53% | 0.534 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -66.3 | -37 | 173 | -72 | 173.9 | 0 | 0 | 0 | 112.2 | D374 L376 K381 | D374-L378 WeakPolarHBondContact O-CG 3.4Å; D374-L378 PolarHBondContact O-N 3.12Å; L376-L378 VanDerWaalsContact C-N 3.34Å; L376-L378 PolarHBondContact O-N 3.29Å; L378-K381 WeakPolarHBondContact O-CB 3.45Å; L378-K381 PolarHBondContact O-N 3.31Å |
| 379 | H | 95.7 | Very high | 94 | Very high | 7 Ų | 7 | 75.4 Ų | 75.4 | 3% | 0.032 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -64.8 | -39.7 | 174.8 | 170.5 | 56.7 | 0 | 0 | 0 | 112.2 | C366 F370 H375 L376 A377 K381 R382 H383 | C366-H379 PolarHBondContact SG-NE2 3.39Å; F370-H379 HydrophobicContact CE1-CB 4.01Å; F370-H379 HydrophobicContact CE2-CB 3.87Å; F370-H379 AromaticContact CE2-CD2 3.32Å; F370-H379 WeakPolarHBondContact CE2-CD2 3.34Å; F370-H379 AromaticContact CE2-CG 3.66Å; F370-H379 HydrophobicContact CZ-CB 3.43Å; F370-H379 VanDerWaalsContact CZ-CB 3.43Å; F370-H379 AromaticContact CZ-CD2 3.42Å; F370-H379 VanDerWaalsContact CZ-CD2 3.42Å; F370-H379 WeakPolarHBondContact CZ-CD2 3.29Å; F370-H379 AromaticContact CZ-CG 3.27Å; F370-H379 AromaticContact CZ-ND1 3.93Å; H375-H379 WeakPolarHBondContact O-CB 3.49Å; H375-H379 PolarHBondContact O-N 3.43Å; L376-H379 CarbonylContact O-C 3.28Å; L376-H379 WeakPolarHBondContact O-CA 3.5Å; L376-H379 WeakPolarHBondContact O-CB 3.4Å; L376-H379 PolarHBondContact O-N 2.79Å; A377-H379 VanDerWaalsContact C-N 3.34Å; H379-K381 PolarHBondContact O-N 3.22Å; H379-R382 VanDerWaalsContact O-CB 3.27Å; H379-R382 WeakPolarHBondContact O-CB 3.38Å; H379-R382 WeakPolarHBondContact O-CG 3.5Å; H379-R382 PolarHBondContact O-N 3.36Å; H379-H383 AromaticContact CD2-NE2 3.91Å; H379-H383 AromaticContact CE1-CD2 3.98Å; H379-H383 AromaticContact CE1-CE1 3.98Å; H379-H383 AromaticContact CE1-NE2 3.25Å; H379-H383 PolarHBondContact CE1-NE2 3.41Å; H379-H383 VanDerWaalsContact CE1-NE2 3.25Å; H379-H383 AromaticContact NE2-CD2 3.73Å; H379-H383 AromaticContact NE2-NE2 2.99Å; H379-H383 PolarHBondContact NE2-NE2 2.85Å |
| 380 | M | 95.3 | Very high | 93.9 | Very high | 39 Ų | 39 | 78.9 Ų | 78.9 | 19% | 0.192 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -57.6 | -31.5 | 178.8 | -70 | -53.1 | -58.6 | 0 | 0 | 112.5 | H364 L365 L376 A377 R382 H383 | H364-M380 WeakPolarHBondContact CE1-CE 3.18Å; L365-M380 HydrophobicContact CD1-CE 3.55Å; L365-M380 HydrophobicContact CG-CE 4.08Å; L376-M380 HydrophobicContact CD1-CG 4.2Å; L376-M380 HydrophobicContact CD1-SD 4.06Å; L376-M380 HydrophobicContact CG-CG 4.38Å; L376-M380 WeakPolarHBondContact O-CG 3.48Å; L376-M380 PolarHBondContact O-N 3.23Å; A377-M380 PolarHBondContact O-N 3.48Å; M380-R382 PolarHBondContact O-N 3.35Å; M380-R382 VanDerWaalsContact O-N 3.1Å; M380-H383 PolarHBondContact O-N 3.49Å |
| 381 | K | 95.9 | Very high | 93.9 | Very high | 138 Ų | 138 | 82.6 Ų | 82.6 | 60% | 0.6 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | -14.5 | 174.9 | -61 | -176.4 | 179 | -176.3 | 0 | 114.3 | L378 H379 H383 | L378-K381 WeakPolarHBondContact O-CB 3.45Å; L378-K381 PolarHBondContact O-N 3.31Å; H379-K381 PolarHBondContact O-N 3.22Å; K381-H383 VanDerWaalsContact C-N 3.34Å |
| 382 | R | 94.2 | Very high | 94 | Very high | 180 Ų | 180 | 86.2 Ų | 86.2 | 68% | 0.679 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.3 | -12.8 | 176.7 | -56.4 | 177.5 | 177.4 | 168.4 | -3.9 | 112.6 | H379 M380 | H379-R382 VanDerWaalsContact O-CB 3.27Å; H379-R382 WeakPolarHBondContact O-CB 3.38Å; H379-R382 WeakPolarHBondContact O-CG 3.5Å; H379-R382 PolarHBondContact O-N 3.36Å; M380-R382 PolarHBondContact O-N 3.35Å; M380-R382 VanDerWaalsContact O-N 3.1Å |
| 383 | H | 91.4 | Very high | 94.2 | Very high | 74 Ų | 74 | 87.6 Ų | 87.6 | 34% | 0.343 | 44% | 0.437 | S | S | . | . | trans | -102.3 | 1.2 | 176.3 | -61.2 | -65.5 | 0 | 0 | 0 | 112.5 | L365 H379 M380 K381 | L365-H383 HydrophobicContact CD1-CB 3.47Å; L365-H383 VanDerWaalsContact CD1-CB 3.47Å; H379-H383 AromaticContact CD2-NE2 3.91Å; H379-H383 AromaticContact CE1-CD2 3.98Å; H379-H383 AromaticContact CE1-CE1 3.98Å; H379-H383 AromaticContact CE1-NE2 3.25Å; H379-H383 PolarHBondContact CE1-NE2 3.41Å; H379-H383 VanDerWaalsContact CE1-NE2 3.25Å; H379-H383 AromaticContact NE2-CD2 3.73Å; H379-H383 AromaticContact NE2-NE2 2.99Å; H379-H383 PolarHBondContact NE2-NE2 2.85Å; M380-H383 PolarHBondContact O-N 3.49Å; K381-H383 VanDerWaalsContact C-N 3.34Å | ||
| 384 | M | 87.7 | Confident | 94.2 | Very high | 211 Ų | 211 | 89.3 Ų | 89.3 | 100% | 1.039 | 43% | 0.433 | S | S | * | . | trans | -100.7 | 0 | 172.8 | -53.5 | -180 | 86.2 | 0 | 0 | 107.6 |
Retrieved 384 of 384 residues in 198.5 ms
(Link to these results)