| 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 | 44.8 | Very low | 52.5 | Low | 231 Ų | 231 | 144.6 Ų | 144.6 | 100% | 1.138 | 83% | 0.829 | S | S | * | * | 0 | 110.4 | 0 | -73.6 | -158.6 | 152.1 | 0 | 0 | 107.5 | |||||
| 2 | Y | 47 | Very low | 52.1 | Low | 243 Ų | 243 | 148.5 Ų | 148.5 | 95% | 0.953 | 83% | 0.834 | S | S | * | * | trans | -114.6 | 110.8 | 174.2 | -84.4 | -81.4 | 0 | 0 | 0 | 107.7 | ||||
| 3 | S | 49.9 | Very low | 51.7 | Low | 117 Ų | 117 | 150.7 Ų | 150.7 | 82% | 0.818 | 83% | 0.83 | S | S | * | * | trans | -79.8 | 127 | 176.6 | -58.6 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 4 | F | 45.4 | Very low | 51.7 | Low | 205 Ų | 205 | 150.6 Ų | 150.6 | 90% | 0.899 | 83% | 0.828 | S | S | * | * | trans | -96 | 108.1 | 173.1 | -158.9 | -94.4 | 0 | 0 | 0 | 108.3 | G6 | F4-G6 PolarHBondContact O-N 3.33Š| ||
| 5 | S | 58.8 | Low | 51.5 | Low | 116 Ų | 116 | 151.2 Ų | 151.2 | 81% | 0.811 | 83% | 0.828 | S | S | * | * | trans | -82.7 | 106.2 | 171.3 | -68.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 6 | G | 56.8 | Low | 51.8 | Low | 49 Ų | 49 | 145.1 Ų | 145.1 | 51% | 0.505 | 81% | 0.811 | S | S | . | * | trans | -81.5 | 146.6 | 167.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | F4 T8 | F4-G6 PolarHBondContact O-N 3.33Å; G6-T8 PolarHBondContact O-N 2.75Å | ||
| 7 | P | 55.9 | Low | 52 | Low | 135 Ų | 135 | 143.9 Ų | 143.9 | 88% | 0.877 | 81% | 0.811 | S | S | * | * | trans | -72.5 | 119.7 | 174.9 | 27.2 | -30.5 | 0 | 0 | 0 | 111 | A9 | P7-A9 PolarHBondContact O-N 3.31Š| ||
| 8 | T | 54.4 | Low | 51.7 | Low | 142 Ų | 142 | 142.6 Ų | 142.6 | 87% | 0.871 | 81% | 0.809 | S | S | * | * | trans | -80 | 99 | 163.9 | 42.5 | 0 | 0 | 0 | 0 | 109.6 | G6 | G6-T8 PolarHBondContact O-N 2.75Š| ||
| 9 | A | 53.6 | Low | 51 | Low | 94 Ų | 94 | 140.8 Ų | 140.8 | 78% | 0.777 | 81% | 0.806 | S | S | * | * | trans | -169 | 112.7 | 154.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | P7 | P7-A9 PolarHBondContact O-N 3.31Š| ||
| 10 | L | 54.5 | Low | 51.3 | Low | 168 Ų | 168 | 140.7 Ų | 140.7 | 88% | 0.88 | 81% | 0.809 | S | S | * | * | trans | -72.9 | 142.6 | 162.8 | -89.9 | 161.4 | 0 | 0 | 0 | 108.7 | E12 | L10-E12 PolarHBondContact O-N 2.91Š| ||
| 11 | P | 56.2 | Low | 50.8 | Low | 91 Ų | 91 | 138.9 Ų | 138.9 | 59% | 0.591 | 80% | 0.804 | S | S | * | * | trans | -67.8 | 120 | 168.1 | -11.1 | 25.8 | 0 | 0 | 0 | 109.3 | F13 | P11-F13 HydrophobicContact CB-CD2 4.48Å; P11-F13 HydrophobicContact CB-CE2 4.03Å; P11-F13 HydrophobicContact CB-CZ 4.43Å; P11-F13 HydrophobicContact CG-CE2 4.44Å; P11-F13 WeakPolarHBondContact O-CD2 3.47Å; P11-F13 PolarHBondContact O-N 3.09Å | ||
| 12 | E | 48.5 | Very low | 50.9 | Low | 191 Ų | 191 | 134.9 Ų | 134.9 | 89% | 0.893 | 79% | 0.788 | S | S | * | * | trans | -70.5 | 109 | 167.9 | -174.4 | 166.8 | -171.1 | 0 | 0 | 108.1 | L10 D14 | L10-E12 PolarHBondContact O-N 2.91Å; E12-D14 PolarHBondContact O-N 3.45Å | ||
| 13 | F | 46.7 | Very low | 50.5 | Low | 177 Ų | 177 | 129.1 Ų | 129.1 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | trans | -86.5 | 101.9 | 174 | -73.8 | -86.3 | 0 | 0 | 0 | 108.8 | P11 L15 | P11-F13 HydrophobicContact CB-CD2 4.48Å; P11-F13 HydrophobicContact CB-CE2 4.03Å; P11-F13 HydrophobicContact CB-CZ 4.43Å; P11-F13 HydrophobicContact CG-CE2 4.44Å; P11-F13 WeakPolarHBondContact O-CD2 3.47Å; P11-F13 PolarHBondContact O-N 3.09Å; F13-L15 PolarHBondContact O-N 3.08Å | ||
| 14 | D | 51.4 | Low | 50.3 | Low | 149 Ų | 149 | 129.5 Ų | 129.5 | 80% | 0.797 | 78% | 0.775 | S | S | * | * | trans | -81.4 | 107.8 | 170.1 | -174.7 | 20.8 | 0 | 0 | 0 | 109.5 | E12 G16 | E12-D14 PolarHBondContact O-N 3.45Å; D14-G16 PolarHBondContact O-N 3.39Å | ||
| 15 | L | 49.4 | Very low | 50.5 | Low | 160 Ų | 160 | 127.3 Ų | 127.3 | 84% | 0.838 | 77% | 0.768 | S | S | * | * | trans | -91.2 | 95.6 | 172.5 | -64.6 | 174.7 | 0 | 0 | 0 | 108 | F13 | F13-L15 PolarHBondContact O-N 3.08Š| ||
| 16 | G | 54.9 | Low | 49.6 | Very low | 53 Ų | 53 | 132.4 Ų | 132.4 | 55% | 0.546 | 77% | 0.769 | S | S | . | * | P | Polyproline II helix | trans | -56.8 | 157.9 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | D14 | D14-G16 PolarHBondContact O-N 3.39Š|
| 17 | P | 56.3 | Low | 49.2 | Very low | 126 Ų | 126 | 138.5 Ų | 138.5 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 148.7 | -171.1 | 27.4 | -33.5 | 0 | 0 | 0 | 112.2 | S19 | P17-S19 PolarHBondContact O-N 3.39Š|
| 18 | P | 46.1 | Very low | 49 | Very low | 120 Ų | 120 | 138.7 Ų | 138.7 | 78% | 0.779 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 125 | -177 | 26.1 | -33 | 0 | 0 | 0 | 110.9 | T20 | P18-T20 PolarHBondContact O-N 3.04Å; P18-T20 VanDerWaalsContact O-N 3.15Å |
| 19 | S | 38.9 | Very low | 48.9 | Very low | 108 Ų | 108 | 137.4 Ų | 137.4 | 76% | 0.755 | 77% | 0.765 | S | S | * | * | trans | -66.5 | 108.2 | 171.7 | -167.9 | 0 | 0 | 0 | 0 | 109.5 | P17 S21 | P17-S19 PolarHBondContact O-N 3.39Å; S19-S21 PolarHBondContact O-N 2.85Å | ||
| 20 | T | 56.8 | Low | 48.6 | Very low | 139 Ų | 139 | 138.8 Ų | 138.8 | 85% | 0.853 | 77% | 0.766 | S | S | * | * | trans | -76.2 | 100.9 | 165.9 | 52.7 | 0 | 0 | 0 | 0 | 108.1 | P18 | P18-T20 PolarHBondContact O-N 3.04Å; P18-T20 VanDerWaalsContact O-N 3.15Å | ||
| 21 | S | 41.2 | Very low | 48.5 | Very low | 102 Ų | 102 | 135.6 Ų | 135.6 | 71% | 0.713 | 75% | 0.75 | S | S | * | * | trans | -118.2 | 106.2 | 166.4 | 29 | 0 | 0 | 0 | 0 | 110.2 | S19 S23 | S19-S21 PolarHBondContact O-N 2.85Å; S21-S23 PolarHBondContact O-N 3.33Å | ||
| 22 | D | 46 | Very low | 48.3 | Very low | 148 Ų | 148 | 135 Ų | 135 | 79% | 0.791 | 75% | 0.748 | S | S | * | * | trans | -32.1 | 124 | 156.9 | -109.4 | -60.3 | 0 | 0 | 0 | 112.9 | ||||
| 23 | S | 39 | Very low | 48.7 | Very low | 121 Ų | 121 | 128.8 Ų | 128.8 | 85% | 0.846 | 73% | 0.726 | S | S | * | * | trans | -130.9 | 94.3 | 154 | -169.1 | 0 | 0 | 0 | 0 | 108 | S21 | S21-S23 PolarHBondContact O-N 3.33Š| ||
| 24 | L | 45.3 | Very low | 48.5 | Very low | 126 Ų | 126 | 126.9 Ų | 126.9 | 66% | 0.66 | 71% | 0.713 | S | S | * | * | trans | -49.5 | 131.7 | 173.4 | -88.5 | 120.5 | 0 | 0 | 0 | 112.5 | ||||
| 25 | Q | 50.7 | Low | 48.8 | Very low | 159 Ų | 159 | 124.5 Ų | 124.5 | 74% | 0.743 | 70% | 0.697 | S | S | * | * | trans | 47 | 96.4 | 136.3 | -61.4 | -161.3 | -65.8 | 0 | 0 | 117.6 | ||||
| 26 | R | 39.8 | Very low | 49.3 | Very low | 222 Ų | 222 | 121.7 Ų | 121.7 | 84% | 0.838 | 69% | 0.687 | S | S | * | * | trans | -133.8 | 81.5 | 139.6 | -169.5 | 171 | -68.9 | -167.1 | 0.7 | 109.2 | L28 | R26-L28 HydrophobicContact CG-CB 4.47Å; R26-L28 HydrophobicContact CG-CD1 3.98Å; R26-L28 HydrophobicContact CG-CG 4.4Å; R26-L28 PolarHBondContact O-N 3.4Å; R26-L28 VanDerWaalsContact O-N 3.09Å | ||
| 27 | E | 48.3 | Very low | 49.5 | Very low | 177 Ų | 177 | 127.2 Ų | 127.2 | 83% | 0.827 | 69% | 0.691 | S | S | * | * | trans | -65.7 | 96.7 | 162.9 | -162.8 | -176.1 | 141.5 | 0 | 0 | 107.9 | ||||
| 28 | L | 51.1 | Low | 49.4 | Very low | 140 Ų | 140 | 129.9 Ų | 129.9 | 73% | 0.733 | 69% | 0.685 | S | S | * | * | trans | -139.5 | 83.8 | 166 | -88.4 | 166.4 | 0 | 0 | 0 | 107.6 | R26 | R26-L28 HydrophobicContact CG-CB 4.47Å; R26-L28 HydrophobicContact CG-CD1 3.98Å; R26-L28 HydrophobicContact CG-CG 4.4Å; R26-L28 PolarHBondContact O-N 3.4Å; R26-L28 VanDerWaalsContact O-N 3.09Å | ||
| 29 | N | 52.5 | Low | 49.8 | Very low | 114 Ų | 114 | 132.8 Ų | 132.8 | 61% | 0.61 | 69% | 0.686 | S | S | * | * | trans | 35.9 | 100.2 | 141.5 | -148.4 | -24.8 | 0 | 0 | 0 | 116.2 | D31 | N29-D31 PolarHBondContact O-N 3.04Å; N29-D31 VanDerWaalsContact O-N 3.1Å | ||
| 30 | P | 47.9 | Very low | 50.8 | Low | 123 Ų | 123 | 133.4 Ų | 133.4 | 80% | 0.799 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.6 | -0.8 | -179.3 | 28.1 | -32.4 | 0 | 0 | 0 | 114.6 | ||
| 31 | D | 50.7 | Low | 51.3 | Low | 102 Ų | 102 | 134 Ų | 134 | 55% | 0.545 | 68% | 0.68 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.7 | -9.4 | -176.3 | -97.1 | -36.3 | 0 | 0 | 0 | 115.9 | N29 S33 W34 | N29-D31 PolarHBondContact O-N 3.04Å; N29-D31 VanDerWaalsContact O-N 3.1Å; D31-S33 PolarHBondContact O-N 2.99Å; D31-W34 PolarHBondContact O-NE1 2.9Å |
| 32 | S | 53.1 | Low | 52.3 | Low | 79 Ų | 79 | 136.8 Ų | 136.8 | 55% | 0.552 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.9 | -1.5 | -170.6 | 89.9 | 0 | 0 | 0 | 0 | 116.3 | T36 | S32-T36 PolarHBondContact O-OG1 3.5Š|
| 33 | S | 56.1 | Low | 52.8 | Low | 60 Ų | 60 | 140.4 Ų | 140.4 | 42% | 0.42 | 68% | 0.684 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78 | -27.4 | -171.3 | -169.6 | 0 | 0 | 0 | 0 | 113.8 | D31 R37 | D31-S33 PolarHBondContact O-N 2.99Å; S33-R37 PolarHBondContact O-NE 2.93Å; S33-R37 PolarHBondContact O-NH2 3.5Å; S33-R37 VanDerWaalsContact O-NH2 3.07Å; S33-R37 PolarHBondContact OG-NH2 3.16Å |
| 34 | W | 43.9 | Very low | 53.8 | Low | 136 Ų | 136 | 145 Ų | 145 | 52% | 0.515 | 68% | 0.682 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94.7 | -26.3 | -172.2 | 55.3 | -94.2 | 0 | 0 | 0 | 113.8 | D31 | D31-W34 PolarHBondContact O-NE1 2.9Š|
| 35 | E | 57.8 | Low | 54.7 | Low | 99 Ų | 99 | 145.6 Ų | 145.6 | 46% | 0.463 | 69% | 0.685 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.1 | -36.5 | 176.1 | -96.4 | 144.3 | 160.4 | 0 | 0 | 113.6 | R37 R38 | E35-R37 PolarHBondContact O-N 3.37Å; E35-R38 PolarHBondContact O-N 3.19Å; E35-R38 VanDerWaalsContact O-N 3.14Å |
| 36 | T | 58.1 | Low | 54.9 | Low | 101 Ų | 101 | 144.9 Ų | 144.9 | 62% | 0.62 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.2 | -18 | -179.4 | 33.9 | 0 | 0 | 0 | 0 | 113.5 | S32 | S32-T36 PolarHBondContact O-OG1 3.5Š|
| 37 | R | 59.9 | Low | 55.5 | Low | 169 Ų | 169 | 139.8 Ų | 139.8 | 64% | 0.638 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.8 | -10.3 | 175 | -72 | -170.7 | -89.2 | -101.2 | -2.7 | 114.2 | S33 E35 | S33-R37 PolarHBondContact O-NE 2.93Å; S33-R37 PolarHBondContact O-NH2 3.5Å; S33-R37 VanDerWaalsContact O-NH2 3.07Å; S33-R37 PolarHBondContact OG-NH2 3.16Å; E35-R37 PolarHBondContact O-N 3.37Å |
| 38 | R | 54.5 | Low | 56 | Low | 183 Ų | 183 | 140.3 Ų | 140.3 | 69% | 0.691 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -82.8 | -15.1 | -176.8 | -72.6 | -82 | -169.8 | 169.1 | 1.4 | 114.4 | E35 | E35-R38 PolarHBondContact O-N 3.19Å; E35-R38 VanDerWaalsContact O-N 3.14Å |
| 39 | F | 55.6 | Low | 56.4 | Low | 181 Ų | 181 | 136.4 Ų | 136.4 | 79% | 0.794 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -99.3 | -7.2 | -173.6 | -70.2 | -79.5 | 0 | 0 | 0 | 115.3 | K41 | F39-K41 VanDerWaalsContact C-N 3.28Å; F39-K41 PolarHBondContact O-N 2.85Å |
| 40 | C | 59.8 | Low | 56.1 | Low | 121 Ų | 121 | 136 Ų | 136 | 82% | 0.818 | 68% | 0.677 | S | S | * | * | trans | -92.5 | 49.9 | 175.2 | -70.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 41 | K | 65.7 | Low | 56.5 | Low | 152 Ų | 152 | 135.6 Ų | 135.6 | 66% | 0.661 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -122.6 | 106.8 | 172.4 | -47.5 | -158.3 | -175.5 | -159.7 | 0 | 108.5 | F39 | F39-K41 VanDerWaalsContact C-N 3.28Å; F39-K41 PolarHBondContact O-N 2.85Å |
| 42 | H | 61.9 | Low | 56.5 | Low | 160 Ų | 160 | 135.3 Ų | 135.3 | 74% | 0.741 | 69% | 0.689 | S | S | * | * | trans | 48.9 | 81.5 | 168.6 | -85.1 | 94.9 | 0 | 0 | 0 | 116.6 | R44 | H42-R44 VanDerWaalsContact C-N 3.28Å; H42-R44 PolarHBondContact O-N 3.19Å | ||
| 43 | R | 57.4 | Low | 56.7 | Low | 224 Ų | 224 | 140.7 Ų | 140.7 | 85% | 0.845 | 70% | 0.702 | S | S | * | * | trans | -70.8 | 92.4 | 148.8 | -174.6 | -176.1 | -65.8 | -123.7 | -1.6 | 107.1 | L45 | R43-L45 HydrophobicContact CG-CB 4.21Å; R43-L45 PolarHBondContact O-N 3.4Å | ||
| 44 | R | 60.8 | Low | 56.9 | Low | 217 Ų | 217 | 147.7 Ų | 147.7 | 82% | 0.819 | 73% | 0.725 | S | S | * | * | trans | -72.2 | 85.5 | 163 | -71.6 | -170.5 | 177.6 | 131.8 | -1 | 107.1 | H42 | H42-R44 VanDerWaalsContact C-N 3.28Å; H42-R44 PolarHBondContact O-N 3.19Å | ||
| 45 | L | 62.8 | Low | 57.4 | Low | 138 Ų | 138 | 152.8 Ų | 152.8 | 72% | 0.723 | 74% | 0.744 | S | S | * | * | trans | -87.1 | 112.1 | 165.4 | -162.7 | 133.4 | 0 | 0 | 0 | 105.1 | R43 | R43-L45 HydrophobicContact CG-CB 4.21Å; R43-L45 PolarHBondContact O-N 3.4Å | ||
| 46 | D | 56 | Low | 57.3 | Low | 144 Ų | 144 | 159 Ų | 159 | 77% | 0.77 | 76% | 0.764 | S | S | * | * | trans | 74.7 | 89.5 | 170.3 | -142.6 | 59.3 | 0 | 0 | 0 | 116.8 | ||||
| 47 | D | 52.8 | Low | 56.9 | Low | 116 Ų | 116 | 162 Ų | 162 | 62% | 0.62 | 78% | 0.775 | S | S | * | * | trans | -133.1 | 71.3 | 146.5 | -175.7 | 43 | 0 | 0 | 0 | 107.4 | G49 C50 | D47-G49 PolarHBondContact O-N 3.38Å; D47-C50 PolarHBondContact OD2-SG 3.16Å; D47-C50 VanDerWaalsContact OD2-SG 3.34Å | ||
| 48 | E | 58.6 | Low | 56.3 | Low | 187 Ų | 187 | 161.4 Ų | 161.4 | 87% | 0.874 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | 61.5 | 167 | -134.8 | -99.6 | 104 | 0 | 0 | 108.1 | ||
| 49 | G | 57.7 | Low | 55.8 | Low | 58 Ų | 58 | 158.3 Ų | 158.3 | 60% | 0.598 | 79% | 0.785 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -155.9 | -11.5 | -163.5 | 0 | 0 | 0 | 0 | 0 | 119.5 | D47 | D47-G49 PolarHBondContact O-N 3.38Š|
| 50 | C | 48.2 | Very low | 55 | Low | 107 Ų | 107 | 159 Ų | 159 | 72% | 0.723 | 79% | 0.79 | S | S | * | * | trans | -117.9 | 74.3 | -174.6 | -72.1 | 0 | 0 | 0 | 0 | 113.5 | D47 A52 | D47-C50 PolarHBondContact OD2-SG 3.16Å; D47-C50 VanDerWaalsContact OD2-SG 3.34Å; C50-A52 PolarHBondContact O-N 3.46Å; C50-A52 VanDerWaalsContact O-N 3.09Å | ||
| 51 | S | 55.2 | Low | 54.1 | Low | 114 Ų | 114 | 159.9 Ų | 159.9 | 80% | 0.797 | 79% | 0.792 | S | S | * | * | trans | -69.8 | 98.4 | 163.5 | 179.6 | 0 | 0 | 0 | 0 | 109.9 | K53 | S51-K53 PolarHBondContact O-N 3.07Š| ||
| 52 | A | 49.9 | Very low | 53 | Low | 95 Ų | 95 | 161.1 Ų | 161.1 | 79% | 0.785 | 80% | 0.801 | S | S | * | * | trans | -64.5 | 100.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | C50 K54 | C50-A52 PolarHBondContact O-N 3.46Å; C50-A52 VanDerWaalsContact O-N 3.09Å; A52-K54 PolarHBondContact O-N 2.96Å | ||
| 53 | K | 58.3 | Low | 51.7 | Low | 193 Ų | 193 | 160 Ų | 160 | 84% | 0.839 | 80% | 0.804 | S | S | * | * | trans | -59 | 117.4 | 172.9 | -82.1 | 170.7 | 167.4 | 170.7 | 0 | 109.6 | S51 R55 | S51-K53 PolarHBondContact O-N 3.07Å; K53-R55 PolarHBondContact O-N 3.05Å; K53-R55 VanDerWaalsContact O-N 3.08Å | ||
| 54 | K | 59.7 | Low | 50.7 | Low | 206 Ų | 206 | 155.9 Ų | 155.9 | 90% | 0.896 | 80% | 0.799 | S | S | * | * | trans | -54.8 | 110.5 | 170.5 | -68.2 | 176.1 | 74.1 | 167.2 | 0 | 109.7 | A52 R56 | A52-K54 PolarHBondContact O-N 2.96Å; K54-R56 PolarHBondContact O-N 3.05Å | ||
| 55 | R | 53.9 | Low | 49.5 | Very low | 244 Ų | 244 | 152.1 Ų | 152.1 | 92% | 0.921 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 120.5 | 163 | -86.2 | 170.9 | 53.8 | 158.4 | -4.3 | 108.2 | K53 | K53-R55 PolarHBondContact O-N 3.05Å; K53-R55 VanDerWaalsContact O-N 3.08Å |
| 56 | R | 57.4 | Low | 48.2 | Very low | 229 Ų | 229 | 153.2 Ų | 153.2 | 86% | 0.864 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 122.4 | 175 | -152.6 | -178.9 | -70.6 | -160.8 | -0.1 | 106.6 | K54 | K54-R56 PolarHBondContact O-N 3.05Š|
| 57 | L | 48 | Very low | 48.1 | Very low | 164 Ų | 164 | 151.4 Ų | 151.4 | 86% | 0.859 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 126.6 | 173.8 | -68.2 | 167.5 | 0 | 0 | 0 | 109 | ||
| 58 | M | 47.8 | Very low | 47.1 | Very low | 156 Ų | 156 | 154 Ų | 154 | 77% | 0.768 | 81% | 0.81 | S | S | * | * | trans | -137.3 | 138.6 | 162.4 | -78.9 | -68.1 | 139.2 | 0 | 0 | 108.2 | ||||
| 59 | P | 44 | Very low | 45.9 | Very low | 118 Ų | 118 | 148.4 Ų | 148.4 | 77% | 0.766 | 80% | 0.802 | S | S | * | * | trans | -75.2 | 137.6 | -176.3 | 29.7 | -33 | 0 | 0 | 0 | 111.7 | ||||
| 60 | E | 39.3 | Very low | 44.6 | Very low | 195 Ų | 195 | 151.7 Ų | 151.7 | 91% | 0.911 | 82% | 0.815 | S | S | * | * | trans | -72.4 | 133.2 | 175.8 | -61.6 | -168.4 | 142.5 | 0 | 0 | 110.4 | ||||
| 61 | T | 40.3 | Very low | 45.2 | Very low | 140 Ų | 140 | 152.1 Ų | 152.1 | 86% | 0.859 | 82% | 0.816 | S | S | * | * | trans | -127.3 | 118.3 | 158 | -51.8 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 62 | E | 43.7 | Very low | 44.1 | Very low | 179 Ų | 179 | 152 Ų | 152 | 84% | 0.836 | 81% | 0.811 | S | S | * | * | trans | -58.1 | 146 | -178.8 | -163.8 | 175.3 | 123.7 | 0 | 0 | 112.1 | ||||
| 63 | V | 34.7 | Very low | 43.4 | Very low | 135 Ų | 135 | 155.3 Ų | 155.3 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | 164.2 | 110.7 | 141.7 | 155.8 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 64 | D | 34.8 | Very low | 42.2 | Very low | 138 Ų | 138 | 151.9 Ų | 151.9 | 74% | 0.738 | 81% | 0.814 | S | S | * | * | trans | 58.7 | 118.6 | 131.7 | -118.1 | 15 | 0 | 0 | 0 | 125.1 | ||||
| 65 | I | 36.1 | Very low | 41.1 | Very low | 138 Ų | 138 | 146.1 Ų | 146.1 | 71% | 0.708 | 81% | 0.806 | S | S | * | * | trans | 57.2 | 124.5 | 138.5 | -58.8 | 162.8 | 0 | 0 | 0 | 123.9 | ||||
| 66 | L | 36.8 | Very low | 40.3 | Very low | 162 Ų | 162 | 144.1 Ų | 144.1 | 85% | 0.848 | 81% | 0.807 | S | S | * | * | trans | 78.2 | 154.8 | 152.2 | -90.9 | -6.9 | 0 | 0 | 0 | 122.5 | ||||
| 67 | P | 52 | Low | 39.3 | Very low | 106 Ų | 106 | 141.5 Ų | 141.5 | 69% | 0.688 | 80% | 0.804 | S | S | * | * | trans | -110.5 | 167.3 | -148.3 | 41.7 | -30.3 | 0 | 0 | 0 | 114.1 | ||||
| 68 | N | 33.3 | Very low | 38.6 | Very low | 171 Ų | 171 | 139.8 Ų | 139.8 | 91% | 0.914 | 80% | 0.8 | S | S | * | * | trans | 105.7 | 124.4 | 156.2 | -154.1 | 21 | 0 | 0 | 0 | 116.4 | ||||
| 69 | G | 32.2 | Very low | 38.4 | Very low | 69 Ų | 69 | 138 Ų | 138 | 71% | 0.711 | 80% | 0.8 | S | S | * | * | trans | 97.9 | 110 | 157.8 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 70 | C | 31.4 | Very low | 38.3 | Very low | 127 Ų | 127 | 140.8 Ų | 140.8 | 86% | 0.858 | 81% | 0.808 | S | S | * | * | trans | -73.4 | 176.9 | 159.5 | -61.2 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 71 | P | 59.6 | Low | 38.2 | Very low | 115 Ų | 115 | 136.1 Ų | 136.1 | 75% | 0.747 | 80% | 0.803 | S | S | * | * | cis | -130.6 | -170.4 | -37.2 | 29.3 | -8.4 | 0 | 0 | 0 | 111.5 | ||||
| 72 | T | 32.6 | Very low | 38.7 | Very low | 112 Ų | 112 | 135 Ų | 135 | 69% | 0.687 | 80% | 0.798 | S | S | * | * | trans | 136 | 115.2 | 138.2 | -53.9 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 73 | L | 36.3 | Very low | 38.6 | Very low | 164 Ų | 164 | 132.7 Ų | 132.7 | 86% | 0.859 | 80% | 0.798 | S | S | * | * | trans | 50.9 | 129.8 | 146.4 | -53.5 | 170.4 | 0 | 0 | 0 | 121.1 | ||||
| 74 | S | 32.1 | Very low | 39.1 | Very low | 121 Ų | 121 | 134.6 Ų | 134.6 | 85% | 0.846 | 80% | 0.798 | S | S | * | * | 177.7 | 143.8 | 101.8 | -168.5 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 75 | A | 37.4 | Very low | 39.4 | Very low | 86 Ų | 86 | 133.3 Ų | 133.3 | 71% | 0.711 | 80% | 0.797 | S | S | * | * | trans | -84.7 | 146.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 76 | Q | 36.2 | Very low | 39.3 | Very low | 201 Ų | 201 | 133 Ų | 133 | 94% | 0.939 | 81% | 0.805 | S | S | * | * | trans | -151.2 | 144.1 | 148.8 | -130.2 | 171.9 | 79.2 | 0 | 0 | 111.4 | ||||
| 77 | Q | 35.7 | Very low | 39.3 | Very low | 175 Ų | 175 | 130.4 Ų | 130.4 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | -97.7 | -175.2 | -158.4 | -67.7 | 172.3 | -31.6 | 0 | 0 | 113.5 | ||||
| 78 | V | 34.9 | Very low | 38.5 | Very low | 127 Ų | 127 | 130.3 Ų | 130.3 | 77% | 0.77 | 81% | 0.81 | S | S | * | * | trans | 93.2 | 151.5 | 149.8 | -128.5 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 79 | P | 43.3 | Very low | 38.8 | Very low | 118 Ų | 118 | 130.3 Ų | 130.3 | 77% | 0.766 | 80% | 0.803 | S | S | * | * | -133.3 | 173.8 | -94 | 40.1 | -20.1 | 0 | 0 | 0 | 115.6 | |||||
| 80 | L | 41.3 | Very low | 39.5 | Very low | 178 Ų | 178 | 136.3 Ų | 136.3 | 93% | 0.932 | 81% | 0.813 | S | S | * | * | trans | -59.9 | 147.9 | 176.4 | -112.2 | 80.1 | 0 | 0 | 0 | 116.3 | ||||
| 81 | A | 38 | Very low | 39.8 | Very low | 97 Ų | 97 | 135.5 Ų | 135.5 | 80% | 0.802 | 81% | 0.809 | S | S | * | * | trans | -155.6 | 154.2 | 150.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 82 | P | 49.9 | Very low | 39.1 | Very low | 117 Ų | 117 | 137.9 Ų | 137.9 | 76% | 0.76 | 81% | 0.814 | S | S | * | * | trans | -106.2 | 175.5 | -156.7 | 40.6 | -32 | 0 | 0 | 0 | 115.7 | ||||
| 83 | P | 41.6 | Very low | 39.6 | Very low | 129 Ų | 129 | 139.1 Ų | 139.1 | 84% | 0.838 | 82% | 0.822 | S | S | * | * | trans | -84.5 | 147.7 | -172.3 | 33.7 | -33.4 | 0 | 0 | 0 | 114.5 | ||||
| 84 | Q | 45.2 | Very low | 39.9 | Very low | 176 Ų | 176 | 139.2 Ų | 139.2 | 82% | 0.822 | 82% | 0.822 | S | S | * | * | trans | -95.6 | 141.1 | 179.4 | -86.7 | -86.6 | -40.6 | 0 | 0 | 112.4 | ||||
| 85 | P | 42.4 | Very low | 40.4 | Very low | 111 Ų | 111 | 139.8 Ų | 139.8 | 72% | 0.721 | 82% | 0.821 | S | S | * | * | trans | -104.6 | 142.9 | 168.7 | 35.6 | -26 | 0 | 0 | 0 | 112.3 | ||||
| 86 | C | 32.2 | Very low | 40.8 | Very low | 130 Ų | 130 | 143.5 Ų | 143.5 | 88% | 0.878 | 82% | 0.824 | S | S | * | * | trans | -115.9 | 114.4 | 169.3 | -68.8 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 87 | S | 36.8 | Very low | 41.7 | Very low | 109 Ų | 109 | 138.7 Ų | 138.7 | 76% | 0.762 | 81% | 0.81 | S | S | * | * | trans | -87.8 | 138.8 | 162 | -76.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 88 | A | 36.6 | Very low | 41.9 | Very low | 104 Ų | 104 | 135.8 Ų | 135.8 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | trans | -135.9 | 116.3 | 158.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 89 | H | 39.9 | Very low | 42.2 | Very low | 170 Ų | 170 | 135 Ų | 135 | 79% | 0.787 | 81% | 0.809 | S | S | * | * | trans | -76.8 | 135.9 | 176.2 | -66.2 | -114.2 | 0 | 0 | 0 | 110 | ||||
| 90 | Q | 46.8 | Very low | 42.3 | Very low | 196 Ų | 196 | 134.9 Ų | 134.9 | 92% | 0.916 | 81% | 0.806 | S | S | * | * | trans | -142.3 | 107.9 | 145.8 | -72.9 | -155 | 96.7 | 0 | 0 | 111.8 | ||||
| 91 | S | 37 | Very low | 42.4 | Very low | 109 Ų | 109 | 135.3 Ų | 135.3 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | trans | -4.7 | 123.5 | 152.8 | -39.9 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 92 | L | 46 | Very low | 42.9 | Very low | 166 Ų | 166 | 135.1 Ų | 135.1 | 87% | 0.869 | 79% | 0.794 | S | S | * | * | 39.9 | 110.9 | 123.2 | -55.1 | 174.1 | 0 | 0 | 0 | 120 | |||||
| 93 | T | 41.3 | Very low | 42.8 | Very low | 137 Ų | 137 | 138.1 Ų | 138.1 | 84% | 0.84 | 79% | 0.79 | S | S | * | * | -148.2 | 109 | 128.5 | 44.3 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 94 | L | 44 | Very low | 43.2 | Very low | 166 Ų | 166 | 137 Ų | 137 | 87% | 0.869 | 79% | 0.791 | S | S | * | * | trans | -78.8 | 118.6 | 164.5 | 176.2 | 71.5 | 0 | 0 | 0 | 108 | ||||
| 95 | T | 42.2 | Very low | 43.5 | Very low | 134 Ų | 134 | 136.2 Ų | 136.2 | 82% | 0.822 | 79% | 0.788 | S | S | * | * | trans | -130.3 | 110.5 | 162.2 | -23.3 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 96 | Q | 46.1 | Very low | 44 | Very low | 163 Ų | 163 | 137.4 Ų | 137.4 | 76% | 0.762 | 79% | 0.785 | S | S | * | * | trans | -95.9 | -179.4 | 173.8 | -153 | -153.5 | 9.5 | 0 | 0 | 109 | ||||
| 97 | P | 53.7 | Low | 45.2 | Very low | 101 Ų | 101 | 138.9 Ų | 138.9 | 66% | 0.656 | 78% | 0.779 | S | S | * | * | -102.9 | -174.8 | -92.9 | 35.6 | -19.8 | 0 | 0 | 0 | 112.5 | |||||
| 98 | S | 40 | Very low | 46.3 | Very low | 113 Ų | 113 | 136.5 Ų | 136.5 | 79% | 0.79 | 76% | 0.763 | S | S | * | * | trans | 102.8 | 100.6 | 157.8 | -150.1 | 0 | 0 | 0 | 0 | 116 | ||||
| 99 | S | 41.3 | Very low | 47.5 | Very low | 110 Ų | 110 | 135.2 Ų | 135.2 | 77% | 0.769 | 75% | 0.746 | S | S | * | * | trans | -147.6 | 103.4 | 133.2 | -179.5 | 0 | 0 | 0 | 0 | 107.2 | Q101 | S99-Q101 PolarHBondContact O-N 3.45Š| ||
| 100 | V | 46.8 | Very low | 48.6 | Very low | 117 Ų | 117 | 132 Ų | 132 | 71% | 0.709 | 74% | 0.741 | S | S | * | * | trans | -52 | 114.4 | 155.4 | 178.4 | 0 | 0 | 0 | 0 | 106.2 | P102 | V100-P102 HydrophobicContact CG1-CB 4.44Å; V100-P102 HydrophobicContact CG1-CG 4.14Å; V100-P102 WeakPolarHBondContact O-CD 3.39Å | ||
| 101 | Q | 42.9 | Very low | 50.2 | Low | 186 Ų | 186 | 128.8 Ų | 128.8 | 87% | 0.869 | 73% | 0.728 | S | S | * | * | trans | -104 | 98.7 | 162.1 | -157.6 | 176.4 | -15.1 | 0 | 0 | 106.9 | S99 | S99-Q101 PolarHBondContact O-N 3.45Š| ||
| 102 | P | 48.4 | Very low | 52.4 | Low | 93 Ų | 93 | 130.1 Ų | 130.1 | 60% | 0.604 | 72% | 0.722 | S | S | * | * | trans | -86.7 | 138.7 | 169.5 | 31.8 | -20 | 0 | 0 | 0 | 108.5 | V100 | V100-P102 HydrophobicContact CG1-CB 4.44Å; V100-P102 HydrophobicContact CG1-CG 4.14Å; V100-P102 WeakPolarHBondContact O-CD 3.39Å | ||
| 103 | R | 47.5 | Very low | 54.4 | Low | 181 Ų | 181 | 127.6 Ų | 127.6 | 68% | 0.683 | 71% | 0.708 | S | S | * | * | trans | 82.6 | 104.6 | 151.9 | -57.9 | -81.3 | -129.2 | 151.6 | 4.4 | 117.7 | M106 | R103-M106 VanDerWaalsContact NH1-CE 3.27Å; R103-M106 PolarHBondContact NH1-SD 3.23Å; R103-M106 VanDerWaalsContact NH1-SD 3.4Å | ||
| 104 | A | 50.3 | Low | 56.8 | Low | 105 Ų | 105 | 126.9 Ų | 126.9 | 87% | 0.868 | 70% | 0.695 | S | S | * | * | -148.1 | 41.3 | 115 | 0 | 0 | 0 | 0 | 0 | 111.7 | M106 | A104-M106 PolarHBondContact O-N 3.47Š| |||
| 105 | E | 51.2 | Low | 59.2 | Low | 159 Ų | 159 | 121.3 Ų | 121.3 | 74% | 0.743 | 67% | 0.673 | S | S | * | * | trans | -88.8 | 95.7 | 156.7 | -79 | -175.2 | 165.4 | 0 | 0 | 107.1 | ||||
| 106 | M | 53.9 | Low | 61.7 | Low | 137 Ų | 137 | 117.3 Ų | 117.3 | 68% | 0.675 | 65% | 0.654 | S | S | * | * | trans | -150.2 | 36.2 | 171.1 | -165.1 | 69.6 | 121 | 0 | 0 | 110.3 | R103 A104 | R103-M106 VanDerWaalsContact NH1-CE 3.27Å; R103-M106 PolarHBondContact NH1-SD 3.23Å; R103-M106 VanDerWaalsContact NH1-SD 3.4Å; A104-M106 PolarHBondContact O-N 3.47Å | ||
| 107 | E | 57.2 | Low | 64 | Low | 160 Ų | 160 | 115.4 Ų | 115.4 | 75% | 0.748 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -145.8 | 39.4 | 168.6 | -61 | -163.3 | 176.2 | 0 | 0 | 109.5 | ||
| 108 | S | 59.2 | Low | 65.9 | Low | 59 Ų | 59 | 118.2 Ų | 118.2 | 41% | 0.413 | 64% | 0.642 | S | S | . | * | trans | -129.6 | 33 | -150.1 | 62.9 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 109 | P | 61.5 | Low | 68.5 | Low | 78 Ų | 78 | 119.7 Ų | 119.7 | 51% | 0.506 | 63% | 0.634 | S | S | . | * | S | Bend | trans | -132.1 | -36.2 | 148.6 | 21.6 | -5.9 | 0 | 0 | 0 | 114 | E112 I113 | P109-E112 PolarHBondContact O-N 2.81Å; P109-I113 HydrophobicContact CB-CD1 4.21Å; P109-I113 WeakPolarHBondContact O-CB 3.44Å; P109-I113 VanDerWaalsContact O-CD1 3.26Å; P109-I113 WeakPolarHBondContact O-CD1 3.48Å; P109-I113 WeakPolarHBondContact O-CG1 3.33Å; P109-I113 PolarHBondContact O-N 2.87Å |
| 110 | C | 63.9 | Low | 71.1 | Confident | 101 Ų | 101 | 120 Ų | 120 | 68% | 0.682 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -68.7 | -40.6 | -172.9 | -70.1 | 0 | 0 | 0 | 0 | 113.4 | E112 E114 | C110-E112 VanDerWaalsContact C-N 3.33Å; C110-E114 WeakPolarHBondContact O-CB 3.29Å; C110-E114 PolarHBondContact O-N 2.68Å |
| 111 | M | 79.7 | Confident | 73.2 | Confident | 130 Ų | 130 | 119 Ų | 119 | 64% | 0.64 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -69.9 | -34.1 | 177.8 | -66.5 | -178.8 | 67.9 | 0 | 0 | 111.9 | A115 | M111-A115 VanDerWaalsContact O-CB 3.31Å; M111-A115 WeakPolarHBondContact O-CB 3.44Å; M111-A115 PolarHBondContact O-N 2.77Å |
| 112 | E | 83.9 | Confident | 75.6 | Confident | 137 Ų | 137 | 115.4 Ų | 115.4 | 64% | 0.64 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -72.9 | -39.4 | 177.5 | -169.6 | 172.1 | -168.3 | 0 | 0 | 111.6 | P109 C110 A115 A116 | P109-E112 PolarHBondContact O-N 2.81Å; C110-E112 VanDerWaalsContact C-N 3.33Å; E112-A115 PolarHBondContact O-N 2.87Å; E112-A116 VanDerWaalsContact O-CB 3.3Å; E112-A116 WeakPolarHBondContact O-CB 3.3Å; E112-A116 PolarHBondContact O-N 2.87Å |
| 113 | I | 88.3 | Confident | 77.6 | Confident | 112 Ų | 112 | 115.1 Ų | 115.1 | 57% | 0.574 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -63.8 | -42.5 | 172.8 | -67.4 | 161.6 | 0 | 0 | 0 | 110.6 | P109 A116 H117 | P109-I113 HydrophobicContact CB-CD1 4.21Å; P109-I113 WeakPolarHBondContact O-CB 3.44Å; P109-I113 VanDerWaalsContact O-CD1 3.26Å; P109-I113 WeakPolarHBondContact O-CD1 3.48Å; P109-I113 WeakPolarHBondContact O-CG1 3.33Å; P109-I113 PolarHBondContact O-N 2.87Å; I113-A116 PolarHBondContact O-N 3.18Å; I113-H117 WeakPolarHBondContact O-CB 2.91Å; I113-H117 PolarHBondContact O-N 2.94Å |
| 114 | E | 91.7 | Very high | 79.5 | Confident | 122 Ų | 122 | 112 Ų | 112 | 57% | 0.57 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -64.9 | -42.2 | 176.1 | -170.3 | -172.9 | -85.9 | 0 | 0 | 111.6 | C110 A116 H117 R118 | C110-E114 WeakPolarHBondContact O-CB 3.29Å; C110-E114 PolarHBondContact O-N 2.68Å; E114-A116 VanDerWaalsContact C-N 3.34Å; E114-A116 PolarHBondContact O-N 3.47Å; E114-H117 PolarHBondContact O-N 3.28Å; E114-R118 WeakPolarHBondContact O-CB 3.23Å; E114-R118 PolarHBondContact O-N 3.49Å; E114-R118 IonicContact OE2-NH2 2.75Å; E114-R118 PolarHBondContact OE2-NH2 2.99Å |
| 115 | A | 93.6 | Very high | 81.2 | Confident | 50 Ų | 50 | 111.2 Ų | 111.2 | 41% | 0.413 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.3 | -39.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | M111 E112 R118 K119 | M111-A115 VanDerWaalsContact O-CB 3.31Å; M111-A115 WeakPolarHBondContact O-CB 3.44Å; M111-A115 PolarHBondContact O-N 2.77Å; E112-A115 PolarHBondContact O-N 2.87Å; A115-R118 PolarHBondContact O-N 3.38Å; A115-K119 PolarHBondContact O-N 2.73Å |
| 116 | A | 94.2 | Very high | 82.8 | Confident | 50 Ų | 50 | 112 Ų | 112 | 41% | 0.413 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -64.8 | -42.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | E112 I113 E114 K119 L120 | E112-A116 VanDerWaalsContact O-CB 3.3Å; E112-A116 WeakPolarHBondContact O-CB 3.3Å; E112-A116 PolarHBondContact O-N 2.87Å; I113-A116 PolarHBondContact O-N 3.18Å; E114-A116 VanDerWaalsContact C-N 3.34Å; E114-A116 PolarHBondContact O-N 3.47Å; A116-K119 PolarHBondContact O-N 3.38Å; A116-L120 WeakPolarHBondContact O-CG 3.36Å; A116-L120 PolarHBondContact O-N 3.41Å |
| 117 | H | 94.8 | Very high | 83.9 | Confident | 122 Ų | 122 | 111.3 Ų | 111.3 | 57% | 0.565 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -63.3 | -42.5 | 176.7 | -165.3 | -93.5 | 0 | 0 | 0 | 111.7 | I113 E114 K119 L120 Q121 | I113-H117 WeakPolarHBondContact O-CB 2.91Å; I113-H117 PolarHBondContact O-N 2.94Å; E114-H117 PolarHBondContact O-N 3.28Å; H117-K119 VanDerWaalsContact C-N 3.32Å; H117-K119 PolarHBondContact O-N 3.06Å; H117-L120 PolarHBondContact O-N 3.38Å; H117-Q121 WeakPolarHBondContact O-CB 3.19Å; H117-Q121 PolarHBondContact O-N 2.87Å |
| 118 | R | 94.8 | Very high | 84.6 | Confident | 161 Ų | 161 | 109.1 Ų | 109.1 | 61% | 0.608 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -60.7 | -41 | 175.3 | -169.9 | -178.8 | -58.6 | 172.8 | 6 | 112.1 | E114 A115 Q121 E122 | E114-R118 WeakPolarHBondContact O-CB 3.23Å; E114-R118 PolarHBondContact O-N 3.49Å; E114-R118 IonicContact OE2-NH2 2.75Å; E114-R118 PolarHBondContact OE2-NH2 2.99Å; A115-R118 PolarHBondContact O-N 3.38Å; R118-Q121 PolarHBondContact O-N 3.17Å; R118-E122 WeakPolarHBondContact O-CB 3.04Å; R118-E122 PolarHBondContact O-N 2.79Å |
| 119 | K | 94.4 | Very high | 84.7 | Confident | 144 Ų | 144 | 113.8 Ų | 113.8 | 63% | 0.626 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.5 | -39.5 | 175.7 | -83 | -174.5 | 157.4 | -174 | 0 | 113 | A115 A116 H117 Q121 E122 I123 | A115-K119 PolarHBondContact O-N 2.73Å; A116-K119 PolarHBondContact O-N 3.38Å; H117-K119 VanDerWaalsContact C-N 3.32Å; H117-K119 PolarHBondContact O-N 3.06Å; K119-Q121 VanDerWaalsContact C-N 3.34Å; K119-E122 PolarHBondContact O-N 3.3Å; K119-I123 WeakPolarHBondContact O-CD1 3.47Å; K119-I123 VanDerWaalsContact O-CG1 3.28Å; K119-I123 WeakPolarHBondContact O-CG1 3.25Å; K119-I123 PolarHBondContact O-N 2.75Å |
| 120 | L | 94.5 | Very high | 84.6 | Confident | 116 Ų | 116 | 118.4 Ų | 118.4 | 61% | 0.607 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -63.9 | -42.9 | 174.9 | -74 | 171.4 | 0 | 0 | 0 | 110.9 | A116 H117 I123 E124 | A116-L120 WeakPolarHBondContact O-CG 3.36Å; A116-L120 PolarHBondContact O-N 3.41Å; H117-L120 PolarHBondContact O-N 3.38Å; L120-I123 PolarHBondContact O-N 3.28Å; L120-E124 PolarHBondContact O-N 3.47Å |
| 121 | Q | 92.2 | Very high | 84.5 | Confident | 96 Ų | 96 | 119.7 Ų | 119.7 | 45% | 0.449 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66 | -39.5 | 177.9 | -168.5 | 167.2 | 5.2 | 0 | 0 | 112.3 | H117 R118 K119 I123 E124 D125 | H117-Q121 WeakPolarHBondContact O-CB 3.19Å; H117-Q121 PolarHBondContact O-N 2.87Å; R118-Q121 PolarHBondContact O-N 3.17Å; K119-Q121 VanDerWaalsContact C-N 3.34Å; Q121-I123 VanDerWaalsContact C-N 3.27Å; Q121-I123 PolarHBondContact O-N 3.12Å; Q121-E124 PolarHBondContact O-N 3.44Å; Q121-D125 WeakPolarHBondContact O-CB 3.26Å; Q121-D125 VanDerWaalsContact O-CG 3.22Å; Q121-D125 PolarHBondContact O-N 3.43Å |
| 122 | E | 93.1 | Very high | 83.4 | Confident | 110 Ų | 110 | 119.9 Ų | 119.9 | 51% | 0.514 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -58.2 | -39.2 | 172.6 | -176.2 | -163.7 | 159.4 | 0 | 0 | 112.3 | R118 K119 R126 | R118-E122 WeakPolarHBondContact O-CB 3.04Å; R118-E122 PolarHBondContact O-N 2.79Å; K119-E122 PolarHBondContact O-N 3.3Å; E122-R126 VanDerWaalsContact O-CG 3.3Å; E122-R126 WeakPolarHBondContact O-CG 3.37Å; E122-R126 PolarHBondContact O-N 2.91Å |
| 123 | I | 89.9 | Confident | 82.4 | Confident | 87 Ų | 87 | 119.7 Ų | 119.7 | 45% | 0.446 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -69.8 | -43.1 | 177.1 | -65.4 | 162.3 | 0 | 0 | 0 | 110.4 | K119 L120 Q121 R126 I127 | K119-I123 WeakPolarHBondContact O-CD1 3.47Å; K119-I123 VanDerWaalsContact O-CG1 3.28Å; K119-I123 WeakPolarHBondContact O-CG1 3.25Å; K119-I123 PolarHBondContact O-N 2.75Å; L120-I123 PolarHBondContact O-N 3.28Å; Q121-I123 VanDerWaalsContact C-N 3.27Å; Q121-I123 PolarHBondContact O-N 3.12Å; I123-R126 PolarHBondContact O-N 3.48Å; I123-I127 HydrophobicContact CG2-CD1 3.68Å; I123-I127 HydrophobicContact CG2-CG1 4.4Å; I123-I127 VanDerWaalsContact O-CG1 3.26Å; I123-I127 WeakPolarHBondContact O-CG1 3.34Å; I123-I127 PolarHBondContact O-N 3.26Å |
| 124 | E | 88 | Confident | 81 | Confident | 115 Ų | 115 | 121.8 Ų | 121.8 | 54% | 0.537 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -59.9 | -46.6 | 176.4 | -178.4 | 172.6 | -167.8 | 0 | 0 | 111.5 | L120 Q121 R126 I127 I128 | L120-E124 PolarHBondContact O-N 3.47Å; Q121-E124 PolarHBondContact O-N 3.44Å; E124-R126 VanDerWaalsContact C-N 3.27Å; E124-R126 PolarHBondContact O-N 2.98Å; E124-I127 PolarHBondContact O-N 3.14Å; E124-I127 VanDerWaalsContact O-N 3.14Å; E124-I128 HydrophobicContact CG-CD1 3.59Å; E124-I128 HydrophobicContact CG-CG1 4.46Å; E124-I128 VanDerWaalsContact O-CG1 3.28Å; E124-I128 WeakPolarHBondContact O-CG1 3.16Å; E124-I128 PolarHBondContact O-N 3.05Å |
| 125 | D | 84.9 | Confident | 79.6 | Confident | 90 Ų | 90 | 122.6 Ų | 122.6 | 48% | 0.481 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -61.9 | -35.1 | 177.9 | -68.6 | -20.7 | 0 | 0 | 0 | 112.1 | Q121 L129 | Q121-D125 WeakPolarHBondContact O-CB 3.26Å; Q121-D125 VanDerWaalsContact O-CG 3.22Å; Q121-D125 PolarHBondContact O-N 3.43Å; D125-L129 PolarHBondContact O-N 3.49Å |
| 126 | R | 85.6 | Confident | 77.8 | Confident | 176 Ų | 176 | 128 Ų | 128 | 66% | 0.664 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -73.5 | -32.4 | 175.8 | -76 | 177.2 | 59.8 | -156 | -7.6 | 113.4 | E122 I123 E124 | E122-R126 VanDerWaalsContact O-CG 3.3Å; E122-R126 WeakPolarHBondContact O-CG 3.37Å; E122-R126 PolarHBondContact O-N 2.91Å; I123-R126 PolarHBondContact O-N 3.48Å; E124-R126 VanDerWaalsContact C-N 3.27Å; E124-R126 PolarHBondContact O-N 2.98Å |
| 127 | I | 75.8 | Confident | 76.4 | Confident | 122 Ų | 122 | 132.6 Ų | 132.6 | 63% | 0.626 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -75.7 | -34.7 | 177.9 | -67.9 | 166 | 0 | 0 | 0 | 110.6 | I123 E124 | I123-I127 HydrophobicContact CG2-CD1 3.68Å; I123-I127 HydrophobicContact CG2-CG1 4.4Å; I123-I127 VanDerWaalsContact O-CG1 3.26Å; I123-I127 WeakPolarHBondContact O-CG1 3.34Å; I123-I127 PolarHBondContact O-N 3.26Å; E124-I127 PolarHBondContact O-N 3.14Å; E124-I127 VanDerWaalsContact O-N 3.14Å |
| 128 | I | 72.6 | Confident | 74.9 | Confident | 114 Ų | 114 | 133.1 Ų | 133.1 | 59% | 0.585 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -74.8 | -23.8 | -177.3 | -69.6 | 167.8 | 0 | 0 | 0 | 112.5 | E124 | E124-I128 HydrophobicContact CG-CD1 3.59Å; E124-I128 HydrophobicContact CG-CG1 4.46Å; E124-I128 VanDerWaalsContact O-CG1 3.28Å; E124-I128 WeakPolarHBondContact O-CG1 3.16Å; E124-I128 PolarHBondContact O-N 3.05Å |
| 129 | L | 62.2 | Low | 73.6 | Confident | 156 Ų | 156 | 133 Ų | 133 | 82% | 0.817 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.7 | 3.6 | -174.3 | -132 | 92.1 | 0 | 0 | 0 | 115.4 | D125 | D125-L129 PolarHBondContact O-N 3.49Š|
| 130 | E | 58.6 | Low | 72.2 | Confident | 175 Ų | 175 | 131.4 Ų | 131.4 | 82% | 0.818 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -125.8 | 31.8 | -174.1 | -155.6 | -179.5 | -159.8 | 0 | 0 | 113.2 | ||
| 131 | D | 60.8 | Low | 70.9 | Confident | 128 Ų | 128 | 131.6 Ų | 131.6 | 68% | 0.684 | 67% | 0.674 | S | S | * | * | trans | -136.7 | 37.7 | 167.9 | -157.8 | 30.1 | 0 | 0 | 0 | 110.3 | D133 | D131-D133 PolarHBondContact O-N 3.46Š| ||
| 132 | D | 58.1 | Low | 69.7 | Low | 134 Ų | 134 | 131.9 Ų | 131.9 | 72% | 0.717 | 68% | 0.684 | S | S | * | * | trans | -76.3 | 112.1 | 158.2 | -157.4 | 11.7 | 0 | 0 | 0 | 105.7 | E134 | D132-E134 PolarHBondContact O-N 3.19Š| ||
| 133 | D | 61.3 | Low | 68.8 | Low | 133 Ų | 133 | 138.3 Ų | 138.3 | 71% | 0.711 | 70% | 0.704 | S | S | * | * | trans | -65.7 | 57.1 | -173.2 | -47.1 | -81.8 | 0 | 0 | 0 | 112.1 | D131 | D131-D133 PolarHBondContact O-N 3.46Š| ||
| 134 | E | 60.8 | Low | 68.5 | Low | 156 Ų | 156 | 144.4 Ų | 144.4 | 73% | 0.729 | 72% | 0.721 | S | S | * | * | trans | -96 | 103.3 | 174.6 | -61.7 | -151.4 | 115.8 | 0 | 0 | 108.9 | D132 | D132-E134 PolarHBondContact O-N 3.19Š| ||
| 135 | D | 61.3 | Low | 68.4 | Low | 140 Ų | 140 | 145.3 Ų | 145.3 | 75% | 0.749 | 74% | 0.737 | S | S | * | * | trans | 80.6 | 63.4 | 167.9 | -45.9 | -33.6 | 0 | 0 | 0 | 115.7 | D137 | D135-D137 PolarHBondContact O-N 3.22Š| ||
| 136 | L | 56.7 | Low | 68.4 | Low | 164 Ų | 164 | 146.9 Ų | 146.9 | 86% | 0.859 | 75% | 0.75 | S | S | * | * | trans | -65.6 | 77.5 | 136.3 | -66.2 | -175.9 | 0 | 0 | 0 | 107.6 | V138 | L136-V138 VanDerWaalsContact C-N 3.34Å; L136-V138 PolarHBondContact O-N 3.18Å | ||
| 137 | D | 63.8 | Low | 68.7 | Low | 146 Ų | 146 | 145.7 Ų | 145.7 | 78% | 0.781 | 76% | 0.756 | S | S | * | * | trans | -43.7 | 108.3 | 156.9 | -118.8 | -7.8 | 0 | 0 | 0 | 104.9 | D135 E139 | D135-D137 PolarHBondContact O-N 3.22Å; D137-E139 PolarHBondContact O-N 3.35Å | ||
| 138 | V | 64.3 | Low | 69.4 | Low | 133 Ų | 133 | 145.9 Ų | 145.9 | 81% | 0.806 | 76% | 0.762 | S | S | * | * | trans | -61.6 | 93.3 | 173.6 | 170.2 | 0 | 0 | 0 | 0 | 104.4 | L136 P140 | L136-V138 VanDerWaalsContact C-N 3.34Å; L136-V138 PolarHBondContact O-N 3.18Å; V138-P140 WeakPolarHBondContact O-CD 3.38Å | ||
| 139 | E | 67.8 | Low | 70.4 | Confident | 159 Ų | 159 | 144.4 Ų | 144.4 | 74% | 0.743 | 75% | 0.754 | S | S | * | * | trans | -53.1 | 116.3 | -179.7 | -175.9 | 166.8 | 179.2 | 0 | 0 | 105.4 | D137 V141 | D137-E139 PolarHBondContact O-N 3.35Å; E139-V141 PolarHBondContact O-N 3.28Å | ||
| 140 | P | 64.7 | Low | 72 | Confident | 110 Ų | 110 | 140.2 Ų | 140.2 | 71% | 0.714 | 74% | 0.738 | S | S | * | * | trans | -59.2 | 115.2 | -174.5 | 21.5 | -31.2 | 0 | 0 | 0 | 106.2 | V138 | V138-P140 WeakPolarHBondContact O-CD 3.38Š| ||
| 141 | V | 66.9 | Low | 73.7 | Confident | 120 Ų | 120 | 136.9 Ų | 136.9 | 73% | 0.727 | 73% | 0.726 | S | S | * | * | trans | -34.9 | 119.5 | -178.2 | 169.5 | 0 | 0 | 0 | 0 | 108.4 | E139 R143 | E139-V141 PolarHBondContact O-N 3.28Å; V141-R143 PolarHBondContact O-N 3.32Å | ||
| 142 | P | 66 | Low | 75.3 | Confident | 102 Ų | 102 | 135.4 Ų | 135.4 | 66% | 0.662 | 73% | 0.726 | S | S | * | * | trans | -56.9 | 106.7 | -168.8 | 16.8 | -29.4 | 0 | 0 | 0 | 108.5 | R144 | P142-R144 VanDerWaalsContact C-N 3.32Å; P142-R144 PolarHBondContact O-N 3.01Å | ||
| 143 | R | 75.6 | Confident | 76.9 | Confident | 244 Ų | 244 | 133.3 Ų | 133.3 | 92% | 0.921 | 71% | 0.714 | S | S | * | * | trans | -69.5 | 97.5 | 179 | -73.7 | -167.7 | 175.8 | 164.8 | 1.5 | 106.1 | V141 | V141-R143 PolarHBondContact O-N 3.32Š| ||
| 144 | R | 83 | Confident | 78.4 | Confident | 216 Ų | 216 | 131.4 Ų | 131.4 | 82% | 0.815 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 135.5 | 176.2 | -64 | -175.1 | 179.5 | -150.9 | -1.1 | 108.2 | P142 V146 | P142-R144 VanDerWaalsContact C-N 3.32Å; P142-R144 PolarHBondContact O-N 3.01Å; R144-V146 PolarHBondContact O-N 2.87Å; R144-V146 VanDerWaalsContact O-N 3.16Å |
| 145 | P | 84.8 | Confident | 79.9 | Confident | 133 Ų | 133 | 128.2 Ų | 128.2 | 86% | 0.864 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 125.4 | 176.6 | 22.3 | -31.7 | 0 | 0 | 0 | 109.2 | ||
| 146 | V | 87 | Confident | 81.3 | Confident | 124 Ų | 124 | 123.3 Ų | 123.3 | 75% | 0.752 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -90 | 118.1 | 176.6 | 177.5 | 0 | 0 | 0 | 0 | 107.7 | R144 V148 | R144-V146 PolarHBondContact O-N 2.87Å; R144-V146 VanDerWaalsContact O-N 3.16Å; V146-V148 HydrophobicContact CG1-CG2 4.4Å; V146-V148 PolarHBondContact O-N 3.21Å |
| 147 | L | 90.1 | Very high | 82.7 | Confident | 151 Ų | 151 | 119.9 Ų | 119.9 | 79% | 0.791 | 65% | 0.649 | S | S | * | * | trans | -71.4 | 110.6 | 171.4 | -177.6 | 65.6 | 0 | 0 | 0 | 108.9 | I149 | L147-I149 HydrophobicContact CD2-CG1 4.31Å; L147-I149 HydrophobicContact CG-CG1 4.19Å | ||
| 148 | V | 91.2 | Very high | 83.5 | Confident | 126 Ų | 126 | 118.4 Ų | 118.4 | 76% | 0.764 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -93.2 | 121 | 172 | -176.6 | 0 | 0 | 0 | 0 | 108.3 | V146 | V146-V148 HydrophobicContact CG1-CG2 4.4Å; V146-V148 PolarHBondContact O-N 3.21Å |
| 149 | I | 93.4 | Very high | 84.4 | Confident | 82 Ų | 82 | 118.6 Ų | 118.6 | 42% | 0.421 | 62% | 0.624 | S | S | . | * | P | Polyproline II helix | trans | -99.1 | 136.2 | -179.1 | -54 | 178.4 | 0 | 0 | 0 | 108.5 | L147 L153 K154 | L147-I149 HydrophobicContact CD2-CG1 4.31Å; L147-I149 HydrophobicContact CG-CG1 4.19Å; I149-L153 HydrophobicContact CG2-CB 3.85Å; I149-L153 HydrophobicContact CG2-CD2 3.82Å; I149-L153 HydrophobicContact CG2-CG 3.71Å; I149-K154 HydrophobicContact CG2-CB 4.31Å |
| 150 | S | 95.8 | Very high | 84.9 | Confident | 69 Ų | 69 | 112.3 Ų | 112.3 | 48% | 0.483 | 60% | 0.602 | S | S | . | * | P | Polyproline II helix | trans | -71.1 | 153.3 | 175.6 | 65.4 | 0 | 0 | 0 | 0 | 111.9 | S152 L153 K154 | S150-S152 VanDerWaalsContact C-N 3.3Å; S150-S152 PolarHBondContact O-N 3.34Å; S150-L153 PolarHBondContact O-N 3.43Å; S150-L153 VanDerWaalsContact O-N 3.08Å; S150-L153 VanDerWaalsContact OG-CB 3.3Å; S150-L153 WeakPolarHBondContact OG-CB 3.36Å; S150-L153 PolarHBondContact OG-N 2.92Å; S150-K154 WeakPolarHBondContact O-CB 3.43Å; S150-K154 PolarHBondContact O-N 3.25Å |
| 151 | D | 94.8 | Very high | 85.2 | Confident | 104 Ų | 104 | 112 Ų | 112 | 56% | 0.556 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -59.8 | -40.2 | -179.7 | -71 | -43.3 | 0 | 0 | 0 | 112.6 | L153 K154 E155 | D151-L153 VanDerWaalsContact C-N 3.32Å; D151-L153 PolarHBondContact O-N 3.5Å; D151-K154 PolarHBondContact O-N 2.99Å; D151-K154 IonicContact OD1-NZ 3.54Å; D151-K154 PolarHBondContact OD1-NZ 3.29Å; D151-E155 WeakPolarHBondContact O-CB 3.45Å; D151-E155 WeakPolarHBondContact O-CG 3.46Å; D151-E155 PolarHBondContact O-N 3.04Å |
| 152 | S | 95 | Very high | 85.4 | Confident | 97 Ų | 97 | 109.2 Ų | 109.2 | 68% | 0.678 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -61.5 | -39 | 175.5 | -173.5 | 0 | 0 | 0 | 0 | 112.6 | S150 G156 | S150-S152 VanDerWaalsContact C-N 3.3Å; S150-S152 PolarHBondContact O-N 3.34Å; S152-G156 PolarHBondContact O-N 3.21Å |
| 153 | L | 91.6 | Very high | 85.7 | Confident | 91 Ų | 91 | 110.4 Ų | 110.4 | 48% | 0.476 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -73.8 | -40.2 | 178.1 | 179.3 | 56.7 | 0 | 0 | 0 | 111 | I149 S150 D151 E155 G156 L157 | I149-L153 HydrophobicContact CG2-CB 3.85Å; I149-L153 HydrophobicContact CG2-CD2 3.82Å; I149-L153 HydrophobicContact CG2-CG 3.71Å; S150-L153 PolarHBondContact O-N 3.43Å; S150-L153 VanDerWaalsContact O-N 3.08Å; S150-L153 VanDerWaalsContact OG-CB 3.3Å; S150-L153 WeakPolarHBondContact OG-CB 3.36Å; S150-L153 PolarHBondContact OG-N 2.92Å; D151-L153 VanDerWaalsContact C-N 3.32Å; D151-L153 PolarHBondContact O-N 3.5Å; L153-E155 PolarHBondContact O-N 3.05Å; L153-G156 PolarHBondContact O-N 3.15Å; L153-L157 HydrophobicContact CD1-CD1 4.14Å; L153-L157 HydrophobicContact CD1-CG 4.06Å; L153-L157 HydrophobicContact CG-CD1 4.14Å; L153-L157 HydrophobicContact CG-CG 4.49Å; L153-L157 WeakPolarHBondContact O-CB 3.09Å; L153-L157 VanDerWaalsContact O-CG 3.29Å; L153-L157 WeakPolarHBondContact O-CG 3.33Å; L153-L157 PolarHBondContact O-N 2.95Å |
| 154 | K | 92.2 | Very high | 85.7 | Confident | 92 Ų | 92 | 105.7 Ų | 105.7 | 40% | 0.4 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -57.7 | -49 | 174.8 | -175 | -177.4 | 77 | -156 | 0 | 111.3 | I149 S150 D151 L157 Q158 | I149-K154 HydrophobicContact CG2-CB 4.31Å; S150-K154 WeakPolarHBondContact O-CB 3.43Å; S150-K154 PolarHBondContact O-N 3.25Å; D151-K154 PolarHBondContact O-N 2.99Å; D151-K154 IonicContact OD1-NZ 3.54Å; D151-K154 PolarHBondContact OD1-NZ 3.29Å; K154-L157 PolarHBondContact O-N 3.28Å; K154-Q158 WeakPolarHBondContact O-CB 3.37Å; K154-Q158 WeakPolarHBondContact O-CG 3.3Å; K154-Q158 PolarHBondContact O-N 3.42Å |
| 155 | E | 91.4 | Very high | 85 | Confident | 89 Ų | 89 | 99 Ų | 99 | 42% | 0.416 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -65.8 | -41.6 | 177.2 | -74 | -175.7 | -154 | 0 | 0 | 112.8 | D151 L153 L157 Q158 R159 | D151-E155 WeakPolarHBondContact O-CB 3.45Å; D151-E155 WeakPolarHBondContact O-CG 3.46Å; D151-E155 PolarHBondContact O-N 3.04Å; L153-E155 PolarHBondContact O-N 3.05Å; E155-L157 VanDerWaalsContact C-N 3.34Å; E155-Q158 PolarHBondContact O-N 2.92Å; E155-R159 PolarHBondContact O-N 3.23Å; E155-R159 IonicContact OE2-CZ 3.09Å; E155-R159 IonicContact OE2-NH1 3.22Å; E155-R159 PolarHBondContact OE2-NH1 3.27Å; E155-R159 VanDerWaalsContact OE2-NH1 3.09Å; E155-R159 IonicContact OE2-NH2 3.21Å |
| 156 | G | 90.5 | Very high | 84.7 | Confident | 37 Ų | 37 | 96.3 Ų | 96.3 | 38% | 0.381 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.7 | -42.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | S152 L153 G160 | S152-G156 PolarHBondContact O-N 3.21Å; L153-G156 PolarHBondContact O-N 3.15Å; G156-G160 PolarHBondContact O-N 3.46Å |
| 157 | L | 86.5 | Confident | 84.2 | Confident | 93 Ų | 93 | 97.5 Ų | 97.5 | 49% | 0.487 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.3 | -47.5 | 175.3 | -70.7 | 173.5 | 0 | 0 | 0 | 111.4 | L153 K154 E155 R159 G160 I161 | L153-L157 HydrophobicContact CD1-CD1 4.14Å; L153-L157 HydrophobicContact CD1-CG 4.06Å; L153-L157 HydrophobicContact CG-CD1 4.14Å; L153-L157 HydrophobicContact CG-CG 4.49Å; L153-L157 WeakPolarHBondContact O-CB 3.09Å; L153-L157 VanDerWaalsContact O-CG 3.29Å; L153-L157 WeakPolarHBondContact O-CG 3.33Å; L153-L157 PolarHBondContact O-N 2.95Å; K154-L157 PolarHBondContact O-N 3.28Å; E155-L157 VanDerWaalsContact C-N 3.34Å; L157-R159 PolarHBondContact O-N 3.08Å; L157-G160 PolarHBondContact O-N 3.2Å; L157-I161 WeakPolarHBondContact O-CG1 3.42Å; L157-I161 PolarHBondContact O-N 2.97Å |
| 158 | Q | 82 | Confident | 83.2 | Confident | 115 Ų | 115 | 95.3 Ų | 95.3 | 54% | 0.537 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -58.1 | -43.7 | 179.9 | -77.8 | 178.6 | 0.1 | 0 | 0 | 113 | K154 E155 S162 | K154-Q158 WeakPolarHBondContact O-CB 3.37Å; K154-Q158 WeakPolarHBondContact O-CG 3.3Å; K154-Q158 PolarHBondContact O-N 3.42Å; E155-Q158 PolarHBondContact O-N 2.92Å; Q158-S162 WeakPolarHBondContact O-CB 3.45Å; Q158-S162 PolarHBondContact O-N 3.07Å; Q158-S162 VanDerWaalsContact O-N 3.16Å; Q158-S162 PolarHBondContact O-OG 3.09Å; Q158-S162 VanDerWaalsContact O-OG 3.05Å |
| 159 | R | 82.5 | Confident | 82.5 | Confident | 137 Ų | 137 | 92 Ų | 92 | 52% | 0.517 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -68.9 | -44.1 | 174.3 | -69.9 | -172.3 | -69.9 | -102.8 | -0.5 | 111.7 | E155 L157 I161 S162 D163 | E155-R159 PolarHBondContact O-N 3.23Å; E155-R159 IonicContact OE2-CZ 3.09Å; E155-R159 IonicContact OE2-NH1 3.22Å; E155-R159 PolarHBondContact OE2-NH1 3.27Å; E155-R159 VanDerWaalsContact OE2-NH1 3.09Å; E155-R159 IonicContact OE2-NH2 3.21Å; L157-R159 PolarHBondContact O-N 3.08Å; R159-I161 PolarHBondContact O-N 3.25Å; R159-S162 WeakPolarHBondContact CA-OG 3.26Å; R159-S162 PolarHBondContact O-N 2.89Å; R159-S162 PolarHBondContact O-OG 2.99Å; R159-D163 VanDerWaalsContact O-CB 3.25Å; R159-D163 WeakPolarHBondContact O-CB 3.47Å; R159-D163 PolarHBondContact O-N 2.97Å |
| 160 | G | 77.9 | Confident | 81.7 | Confident | 27 Ų | 27 | 90 Ų | 90 | 28% | 0.278 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.3 | -48.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113 | G156 L157 I164 | G156-G160 PolarHBondContact O-N 3.46Å; L157-G160 PolarHBondContact O-N 3.2Å; G160-I164 VanDerWaalsContact O-CB 3.23Å; G160-I164 WeakPolarHBondContact O-CB 3.28Å; G160-I164 WeakPolarHBondContact O-CD1 3.42Å; G160-I164 WeakPolarHBondContact O-CG1 3.28Å; G160-I164 PolarHBondContact O-N 3.05Å; G160-I164 VanDerWaalsContact O-N 3.07Å |
| 161 | I | 72 | Confident | 80.7 | Confident | 103 Ų | 103 | 92.4 Ų | 92.4 | 53% | 0.528 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -70.3 | -36.1 | 178.7 | 49.5 | 125.6 | 0 | 0 | 0 | 113 | L157 R159 D163 L165 | L157-I161 WeakPolarHBondContact O-CG1 3.42Å; L157-I161 PolarHBondContact O-N 2.97Å; R159-I161 PolarHBondContact O-N 3.25Å; I161-D163 VanDerWaalsContact C-N 3.28Å; I161-D163 PolarHBondContact O-N 2.84Å; I161-L165 HydrophobicContact CB-CD1 4.29Å; I161-L165 HydrophobicContact CG2-CD1 4.49Å; I161-L165 WeakPolarHBondContact O-CB 3.48Å; I161-L165 PolarHBondContact O-N 3.39Å |
| 162 | S | 71 | Confident | 79.4 | Confident | 62 Ų | 62 | 91 Ų | 91 | 43% | 0.434 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.8 | -32.1 | 177.4 | 61.6 | 0 | 0 | 0 | 0 | 113 | Q158 R159 | Q158-S162 WeakPolarHBondContact O-CB 3.45Å; Q158-S162 PolarHBondContact O-N 3.07Å; Q158-S162 VanDerWaalsContact O-N 3.16Å; Q158-S162 PolarHBondContact O-OG 3.09Å; Q158-S162 VanDerWaalsContact O-OG 3.05Å; R159-S162 WeakPolarHBondContact CA-OG 3.26Å; R159-S162 PolarHBondContact O-N 2.89Å; R159-S162 PolarHBondContact O-OG 2.99Å |
| 163 | D | 71.8 | Confident | 77.9 | Confident | 127 Ų | 127 | 92 Ų | 92 | 68% | 0.679 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -93.8 | -24.8 | -171.3 | -58.9 | -8.4 | 0 | 0 | 0 | 112.1 | R159 I161 | R159-D163 VanDerWaalsContact O-CB 3.25Å; R159-D163 WeakPolarHBondContact O-CB 3.47Å; R159-D163 PolarHBondContact O-N 2.97Å; I161-D163 VanDerWaalsContact C-N 3.28Å; I161-D163 PolarHBondContact O-N 2.84Å |
| 164 | I | 74.9 | Confident | 76.7 | Confident | 145 Ų | 145 | 92.2 Ų | 92.2 | 74% | 0.744 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -91.5 | -32.7 | -178.9 | -61.9 | 166.8 | 0 | 0 | 0 | 111.7 | G160 | G160-I164 VanDerWaalsContact O-CB 3.23Å; G160-I164 WeakPolarHBondContact O-CB 3.28Å; G160-I164 WeakPolarHBondContact O-CD1 3.42Å; G160-I164 WeakPolarHBondContact O-CG1 3.28Å; G160-I164 PolarHBondContact O-N 3.05Å; G160-I164 VanDerWaalsContact O-N 3.07Å |
| 165 | L | 68.9 | Low | 75.1 | Confident | 76 Ų | 76 | 91.9 Ų | 91.9 | 40% | 0.398 | 52% | 0.52 | S | S | . | . | S | Bend | trans | -90 | 134.6 | 178.6 | -75.1 | 151.3 | 0 | 0 | 0 | 110.2 | I161 Q167 V169 | I161-L165 HydrophobicContact CB-CD1 4.29Å; I161-L165 HydrophobicContact CG2-CD1 4.49Å; I161-L165 WeakPolarHBondContact O-CB 3.48Å; I161-L165 PolarHBondContact O-N 3.39Å; L165-Q167 PolarHBondContact O-N 3.47Å; L165-V169 HydrophobicContact CD2-CB 4.31Å; L165-V169 HydrophobicContact CD2-CG1 3.78Å |
| 166 | P | 79.2 | Confident | 73.9 | Confident | 76 Ų | 76 | 94.1 Ų | 94.1 | 49% | 0.494 | 55% | 0.545 | S | S | . | . | trans | -52.4 | 138.6 | 171.2 | -24 | 32.8 | 0 | 0 | 0 | 110.4 | T168 V169 A170 | P166-T168 PolarHBondContact O-N 3.5Å; P166-V169 HydrophobicContact CB-CG2 4.17Å; P166-V169 HydrophobicContact CG-CG2 4.21Å; P166-V169 WeakPolarHBondContact O-CA 3.31Å; P166-V169 WeakPolarHBondContact O-CB 3.42Å; P166-V169 PolarHBondContact O-N 3.37Å; P166-A170 PolarHBondContact O-N 3.37Å | ||
| 167 | Q | 75.3 | Confident | 72.5 | Confident | 148 Ų | 148 | 95.1 Ų | 95.1 | 69% | 0.692 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -53.7 | -29.9 | -177.2 | -166.7 | 176.6 | 14.5 | 0 | 0 | 112.6 | L165 A170 Q171 | L165-Q167 PolarHBondContact O-N 3.47Å; Q167-A170 PolarHBondContact O-N 2.95Å; Q167-Q171 WeakPolarHBondContact O-CB 3.3Å; Q167-Q171 VanDerWaalsContact O-CG 3.26Å; Q167-Q171 WeakPolarHBondContact O-CG 3.07Å; Q167-Q171 PolarHBondContact O-N 2.91Å |
| 168 | T | 69.9 | Low | 71.3 | Confident | 105 Ų | 105 | 99.1 Ų | 99.1 | 64% | 0.644 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -64 | -37.7 | 173.8 | 52.6 | 0 | 0 | 0 | 0 | 113.3 | P166 S172 | P166-T168 PolarHBondContact O-N 3.5Å; T168-S172 WeakPolarHBondContact O-CB 3.35Å; T168-S172 PolarHBondContact O-N 2.89Å; T168-S172 PolarHBondContact O-OG 3.43Å |
| 169 | V | 76.9 | Confident | 70.9 | Confident | 58 Ų | 58 | 101.7 Ų | 101.7 | 35% | 0.352 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -75 | -39.3 | 178 | -176.9 | 0 | 0 | 0 | 0 | 110.7 | L165 P166 Q171 S172 V173 | L165-V169 HydrophobicContact CD2-CB 4.31Å; L165-V169 HydrophobicContact CD2-CG1 3.78Å; P166-V169 HydrophobicContact CB-CG2 4.17Å; P166-V169 HydrophobicContact CG-CG2 4.21Å; P166-V169 WeakPolarHBondContact O-CA 3.31Å; P166-V169 WeakPolarHBondContact O-CB 3.42Å; P166-V169 PolarHBondContact O-N 3.37Å; V169-Q171 VanDerWaalsContact C-N 3.31Å; V169-Q171 PolarHBondContact O-N 3.3Å; V169-S172 WeakPolarHBondContact CA-OG 3.45Å; V169-S172 PolarHBondContact O-N 3.49Å; V169-S172 PolarHBondContact O-OG 3.45Å; V169-V173 PolarHBondContact O-N 3.14Å |
| 170 | A | 75.6 | Confident | 70.8 | Confident | 38 Ų | 38 | 102.5 Ų | 102.5 | 31% | 0.314 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -64.3 | -36 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | P166 Q167 V173 S174 | P166-A170 PolarHBondContact O-N 3.37Å; Q167-A170 PolarHBondContact O-N 2.95Å; A170-V173 WeakPolarHBondContact O-CG2 3.43Å; A170-S174 PolarHBondContact O-OG 2.99Å |
| 171 | Q | 73.8 | Confident | 71 | Confident | 120 Ų | 120 | 106.9 Ų | 106.9 | 56% | 0.561 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -77.2 | -29.1 | 174.6 | -71.8 | 179.7 | 18.4 | 0 | 0 | 112.8 | Q167 V169 V173 S174 P175 | Q167-Q171 WeakPolarHBondContact O-CB 3.3Å; Q167-Q171 VanDerWaalsContact O-CG 3.26Å; Q167-Q171 WeakPolarHBondContact O-CG 3.07Å; Q167-Q171 PolarHBondContact O-N 2.91Å; V169-Q171 VanDerWaalsContact C-N 3.31Å; V169-Q171 PolarHBondContact O-N 3.3Å; Q171-V173 VanDerWaalsContact C-N 3.28Å; Q171-V173 PolarHBondContact O-N 3.21Å; Q171-S174 PolarHBondContact O-N 3.49Å; Q171-P175 WeakPolarHBondContact O-CD 3.26Å |
| 172 | S | 68.4 | Low | 71.6 | Confident | 76 Ų | 76 | 108.8 Ų | 108.8 | 53% | 0.531 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -71.9 | -19.1 | 179.5 | 67.6 | 0 | 0 | 0 | 0 | 114.2 | T168 V169 S174 P175 | T168-S172 WeakPolarHBondContact O-CB 3.35Å; T168-S172 PolarHBondContact O-N 2.89Å; T168-S172 PolarHBondContact O-OG 3.43Å; V169-S172 WeakPolarHBondContact CA-OG 3.45Å; V169-S172 PolarHBondContact O-N 3.49Å; V169-S172 PolarHBondContact O-OG 3.45Å; S172-S174 VanDerWaalsContact C-N 3.34Å; S172-P175 VanDerWaalsContact C-CD 3.46Å; S172-P175 WeakPolarHBondContact O-CD 3.48Å |
| 173 | V | 64.4 | Low | 72.4 | Confident | 118 Ų | 118 | 115.2 Ų | 115.2 | 72% | 0.715 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | -7 | 170.4 | -61.2 | 0 | 0 | 0 | 0 | 112.8 | V169 A170 Q171 P175 | V169-V173 PolarHBondContact O-N 3.14Å; A170-V173 WeakPolarHBondContact O-CG2 3.43Å; Q171-V173 VanDerWaalsContact C-N 3.28Å; Q171-V173 PolarHBondContact O-N 3.21Å; V173-P175 VanDerWaalsContact C-CD 3.43Å |
| 174 | S | 64.6 | Low | 72.9 | Confident | 94 Ų | 94 | 118.1 Ų | 118.1 | 66% | 0.657 | 65% | 0.648 | S | S | * | * | trans | -98.8 | 3 | -178.4 | -59 | 0 | 0 | 0 | 0 | 117.4 | A170 Q171 S172 | A170-S174 PolarHBondContact O-OG 2.99Å; Q171-S174 PolarHBondContact O-N 3.49Å; S172-S174 VanDerWaalsContact C-N 3.34Å | ||
| 175 | P | 60.6 | Low | 73.4 | Confident | 86 Ų | 86 | 115 Ų | 115 | 56% | 0.558 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -88.7 | 125.8 | 171 | 31.3 | -21.8 | 0 | 0 | 0 | 109.7 | Q171 S172 V173 G177 | Q171-P175 WeakPolarHBondContact O-CD 3.26Å; S172-P175 VanDerWaalsContact C-CD 3.46Å; S172-P175 WeakPolarHBondContact O-CD 3.48Å; V173-P175 VanDerWaalsContact C-CD 3.43Å; P175-G177 PolarHBondContact O-N 3.44Å |
| 176 | S | 65.7 | Low | 74.1 | Confident | 135 Ų | 135 | 116.7 Ų | 116.7 | 94% | 0.944 | 65% | 0.652 | S | S | * | * | trans | -63.1 | 72.6 | 165.3 | 59 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 177 | G | 60.7 | Low | 74.2 | Confident | 59 Ų | 59 | 118.7 Ų | 118.7 | 61% | 0.608 | 66% | 0.655 | S | S | * | * | trans | -137.6 | 47 | -168.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | P175 E179 | P175-G177 PolarHBondContact O-N 3.44Å; G177-E179 PolarHBondContact O-N 3.48Å; G177-E179 VanDerWaalsContact O-N 3.12Å | ||
| 178 | M | 60.5 | Low | 74.7 | Confident | 177 Ų | 177 | 115 Ų | 115 | 87% | 0.872 | 64% | 0.64 | S | S | * | * | trans | -79.6 | 76.4 | 159.9 | -67 | -160.6 | 77.7 | 0 | 0 | 108.3 | L180 | M178-L180 PolarHBondContact O-N 2.95Š| ||
| 179 | E | 74 | Confident | 75.3 | Confident | 168 Ų | 168 | 114.2 Ų | 114.2 | 79% | 0.785 | 64% | 0.637 | S | S | * | * | trans | -75.3 | 107.3 | 164 | -172.8 | 179.5 | 169.8 | 0 | 0 | 107.6 | G177 V181 | G177-E179 PolarHBondContact O-N 3.48Å; G177-E179 VanDerWaalsContact O-N 3.12Å; E179-V181 PolarHBondContact O-N 3.1Å | ||
| 180 | L | 80.6 | Confident | 75.1 | Confident | 155 Ų | 155 | 117.5 Ų | 117.5 | 81% | 0.812 | 65% | 0.647 | S | S | * | * | trans | -71.5 | 100.3 | 173.3 | -64.1 | 176.7 | 0 | 0 | 0 | 108.5 | M178 L182 | M178-L180 PolarHBondContact O-N 2.95Å; L180-L182 PolarHBondContact O-N 3.37Å | ||
| 181 | V | 82.5 | Confident | 75.2 | Confident | 119 Ų | 119 | 118.6 Ų | 118.6 | 72% | 0.721 | 65% | 0.652 | S | S | * | * | trans | -80.6 | 117.5 | 167.7 | 179.7 | 0 | 0 | 0 | 0 | 108.1 | E179 W183 | E179-V181 PolarHBondContact O-N 3.1Å; V181-W183 PolarHBondContact O-N 3.09Å | ||
| 182 | L | 85.3 | Confident | 75.5 | Confident | 143 Ų | 143 | 116.8 Ų | 116.8 | 75% | 0.749 | 64% | 0.643 | S | S | * | * | trans | -70.2 | 102.9 | 174.3 | -177 | 66.6 | 0 | 0 | 0 | 109.2 | L180 R184 | L180-L182 PolarHBondContact O-N 3.37Å; L182-R184 HydrophobicContact CD2-CG 4.29Å; L182-R184 HydrophobicContact CG-CG 4.32Å; L182-R184 PolarHBondContact O-N 2.98Å | ||
| 183 | W | 86 | Confident | 76.2 | Confident | 196 Ų | 196 | 121 Ų | 121 | 74% | 0.742 | 65% | 0.647 | S | S | * | * | trans | -69.5 | 115.5 | 167.6 | -176.3 | 74.7 | 0 | 0 | 0 | 108.9 | V181 P185 | V181-W183 PolarHBondContact O-N 3.09Å; W183-P185 HydrophobicContact CE3-CG 4.08Å; W183-P185 HydrophobicContact CH2-CB 3.89Å; W183-P185 HydrophobicContact CH2-CG 3.99Å; W183-P185 HydrophobicContact CZ2-CB 4.49Å; W183-P185 HydrophobicContact CZ3-CB 4.01Å; W183-P185 HydrophobicContact CZ3-CG 3.57Å | ||
| 184 | R | 83.4 | Confident | 77.1 | Confident | 189 Ų | 189 | 121.2 Ų | 121.2 | 71% | 0.713 | 64% | 0.644 | S | S | * | * | P | Polyproline II helix | trans | -95 | 125 | 167 | -67.7 | -159 | -123.6 | 148.4 | 0.4 | 108.8 | L182 | L182-R184 HydrophobicContact CD2-CG 4.29Å; L182-R184 HydrophobicContact CG-CG 4.32Å; L182-R184 PolarHBondContact O-N 2.98Å |
| 185 | P | 85.6 | Confident | 77.9 | Confident | 78 Ų | 78 | 121.7 Ų | 121.7 | 51% | 0.506 | 63% | 0.634 | S | S | . | * | P | Polyproline II helix | trans | -54.5 | 146.8 | 168.7 | -19.1 | 27.4 | 0 | 0 | 0 | 110.6 | W183 E187 | W183-P185 HydrophobicContact CE3-CG 4.08Å; W183-P185 HydrophobicContact CH2-CB 3.89Å; W183-P185 HydrophobicContact CH2-CG 3.99Å; W183-P185 HydrophobicContact CZ2-CB 4.49Å; W183-P185 HydrophobicContact CZ3-CB 4.01Å; W183-P185 HydrophobicContact CZ3-CG 3.57Å; P185-E187 PolarHBondContact O-N 2.88Å |
| 186 | P | 82.6 | Confident | 79 | Confident | 112 Ų | 112 | 120.7 Ų | 120.7 | 73% | 0.727 | 62% | 0.624 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 137.1 | 168.4 | -23.5 | 33.5 | 0 | 0 | 0 | 110.4 | D188 | P186-D188 PolarHBondContact O-N 3.37Š|
| 187 | E | 82.3 | Confident | 79.8 | Confident | 118 Ų | 118 | 117.6 Ų | 117.6 | 55% | 0.551 | 60% | 0.602 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 123.4 | 178.8 | -65 | -74.4 | 151.9 | 0 | 0 | 109.5 | P185 K195 | P185-E187 PolarHBondContact O-N 2.88Å; E187-K195 IonicContact OE2-NZ 3.8Å; E187-K195 PolarHBondContact OE2-NZ 2.93Å |
| 188 | D | 84.9 | Confident | 80.9 | Confident | 70 Ų | 70 | 120.2 Ų | 120.2 | 37% | 0.374 | 60% | 0.602 | S | S | . | * | P | Polyproline II helix | trans | -72.7 | 128 | 176.1 | 179.4 | 1.3 | 0 | 0 | 0 | 109.7 | P186 F190 C191 Q192 | P186-D188 PolarHBondContact O-N 3.37Å; D188-F190 PolarHBondContact O-N 3.21Å; D188-F190 VanDerWaalsContact O-N 3.1Å; D188-F190 VanDerWaalsContact OD1-CD2 3.24Å; D188-F190 WeakPolarHBondContact OD1-CD2 3.37Å; D188-F190 PolarHBondContact OD1-N 3.22Å; D188-C191 HydrophobicContact CB-CB 4.28Å; D188-C191 WeakPolarHBondContact O-CB 3.39Å; D188-C191 PolarHBondContact O-N 3.02Å; D188-Q192 PolarHBondContact O-N 2.95Å; D188-Q192 VanDerWaalsContact O-N 3.1Å |
| 189 | P | 82.1 | Confident | 81.9 | Confident | 89 Ų | 89 | 118.4 Ų | 118.4 | 58% | 0.578 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -52.5 | -29.7 | 173 | 21.4 | -35 | 0 | 0 | 0 | 113.5 | Q192 R193 | P189-Q192 PolarHBondContact O-N 3.43Å; P189-R193 WeakPolarHBondContact O-CG 3.24Å; P189-R193 PolarHBondContact O-N 3.33Å; P189-R193 VanDerWaalsContact O-N 3.1Å |
| 190 | F | 74.4 | Confident | 82.2 | Confident | 127 Ų | 127 | 117.4 Ų | 117.4 | 56% | 0.557 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -67.3 | -43.3 | 175.6 | -68.2 | -75.9 | 0 | 0 | 0 | 112.3 | D188 Q192 R193 L194 | D188-F190 PolarHBondContact O-N 3.21Å; D188-F190 VanDerWaalsContact O-N 3.1Å; D188-F190 VanDerWaalsContact OD1-CD2 3.24Å; D188-F190 WeakPolarHBondContact OD1-CD2 3.37Å; D188-F190 PolarHBondContact OD1-N 3.22Å; F190-Q192 VanDerWaalsContact C-N 3.31Å; F190-Q192 PolarHBondContact O-N 3.11Å; F190-R193 PolarHBondContact O-N 3.4Å; F190-L194 PolarHBondContact O-N 3.1Å; F190-L194 VanDerWaalsContact O-N 3.11Å |
| 191 | C | 77.2 | Confident | 82.1 | Confident | 62 Ų | 62 | 115.3 Ų | 115.3 | 42% | 0.419 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -63.5 | -37.1 | 175.8 | -64.9 | 0 | 0 | 0 | 0 | 111.8 | D188 L194 K195 | D188-C191 HydrophobicContact CB-CB 4.28Å; D188-C191 WeakPolarHBondContact O-CB 3.39Å; D188-C191 PolarHBondContact O-N 3.02Å; C191-L194 PolarHBondContact O-N 3.45Å; C191-K195 WeakPolarHBondContact O-CG 3.41Å; C191-K195 PolarHBondContact O-N 3.1Å |
| 192 | Q | 80.6 | Confident | 81.8 | Confident | 81 Ų | 81 | 118.7 Ų | 118.7 | 38% | 0.379 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.2 | -47 | 176.7 | -173.2 | 57.6 | 45.7 | 0 | 0 | 111.9 | D188 P189 F190 L194 K195 D196 | D188-Q192 PolarHBondContact O-N 2.95Å; D188-Q192 VanDerWaalsContact O-N 3.1Å; P189-Q192 PolarHBondContact O-N 3.43Å; F190-Q192 VanDerWaalsContact C-N 3.31Å; F190-Q192 PolarHBondContact O-N 3.11Å; Q192-L194 VanDerWaalsContact C-N 3.27Å; Q192-L194 PolarHBondContact O-N 3.47Å; Q192-K195 WeakPolarHBondContact O-CB 3.46Å; Q192-K195 PolarHBondContact O-N 3.4Å; Q192-D196 PolarHBondContact NE2-OD1 3.5Å; Q192-D196 PolarHBondContact NE2-OD2 2.98Å; Q192-D196 VanDerWaalsContact O-CG 3.25Å; Q192-D196 PolarHBondContact O-N 3.29Å |
| 193 | R | 82.9 | Confident | 81.1 | Confident | 165 Ų | 165 | 119.6 Ų | 119.6 | 62% | 0.623 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -61.9 | -36.3 | 177.3 | -68.5 | -172.6 | -21.9 | -159 | 4.5 | 112.5 | P189 F190 D196 S197 | P189-R193 WeakPolarHBondContact O-CG 3.24Å; P189-R193 PolarHBondContact O-N 3.33Å; P189-R193 VanDerWaalsContact O-N 3.1Å; F190-R193 PolarHBondContact O-N 3.4Å; R193-D196 PolarHBondContact O-N 3.44Å; R193-S197 WeakPolarHBondContact O-CB 3.48Å; R193-S197 PolarHBondContact O-N 2.93Å |
| 194 | L | 82.1 | Confident | 80.3 | Confident | 123 Ų | 123 | 119.8 Ų | 119.8 | 64% | 0.644 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -66.2 | -46 | 176.6 | -177.9 | 61.8 | 0 | 0 | 0 | 111.2 | F190 C191 Q192 D196 S197 L198 | F190-L194 PolarHBondContact O-N 3.1Å; F190-L194 VanDerWaalsContact O-N 3.11Å; C191-L194 PolarHBondContact O-N 3.45Å; Q192-L194 VanDerWaalsContact C-N 3.27Å; Q192-L194 PolarHBondContact O-N 3.47Å; L194-D196 VanDerWaalsContact C-N 3.33Å; L194-D196 PolarHBondContact O-N 3.1Å; L194-S197 PolarHBondContact O-N 3.02Å; L194-L198 WeakPolarHBondContact O-CB 3.48Å; L194-L198 PolarHBondContact O-N 2.89Å |
| 195 | K | 82.7 | Confident | 79.2 | Confident | 103 Ų | 103 | 116.7 Ų | 116.7 | 45% | 0.448 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -57.1 | -45.1 | 173.7 | -75.8 | 170.1 | 168.8 | 173.3 | 0 | 111.5 | E187 C191 Q192 L198 Q199 | E187-K195 IonicContact OE2-NZ 3.8Å; E187-K195 PolarHBondContact OE2-NZ 2.93Å; C191-K195 WeakPolarHBondContact O-CG 3.41Å; C191-K195 PolarHBondContact O-N 3.1Å; Q192-K195 WeakPolarHBondContact O-CB 3.46Å; Q192-K195 PolarHBondContact O-N 3.4Å; K195-L198 PolarHBondContact O-N 2.91Å; K195-Q199 WeakPolarHBondContact O-CG 3.49Å; K195-Q199 PolarHBondContact O-N 2.91Å |
| 196 | D | 83.1 | Confident | 77.7 | Confident | 66 Ų | 66 | 117.6 Ų | 117.6 | 35% | 0.353 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -67.3 | -37.9 | 179.4 | -66 | -23.5 | 0 | 0 | 0 | 112.4 | Q192 R193 L194 K200 | Q192-D196 PolarHBondContact NE2-OD1 3.5Å; Q192-D196 PolarHBondContact NE2-OD2 2.98Å; Q192-D196 VanDerWaalsContact O-CG 3.25Å; Q192-D196 PolarHBondContact O-N 3.29Å; R193-D196 PolarHBondContact O-N 3.44Å; L194-D196 VanDerWaalsContact C-N 3.33Å; L194-D196 PolarHBondContact O-N 3.1Å; D196-K200 WeakPolarHBondContact O-CB 3.32Å; D196-K200 VanDerWaalsContact O-CG 3.28Å; D196-K200 WeakPolarHBondContact O-CG 3.34Å; D196-K200 PolarHBondContact O-N 2.86Å |
| 197 | S | 83.4 | Confident | 76.4 | Confident | 70 Ų | 70 | 117.5 Ų | 117.5 | 49% | 0.49 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.1 | -47.3 | 174.7 | -172.1 | 0 | 0 | 0 | 0 | 111.1 | R193 L194 Q199 K200 Q201 | R193-S197 WeakPolarHBondContact O-CB 3.48Å; R193-S197 PolarHBondContact O-N 2.93Å; L194-S197 PolarHBondContact O-N 3.02Å; S197-Q199 PolarHBondContact O-N 3.49Å; S197-K200 PolarHBondContact O-N 3.23Å; S197-Q201 WeakPolarHBondContact O-CB 3.32Å; S197-Q201 PolarHBondContact O-N 3.39Å |
| 198 | L | 82.6 | Confident | 75 | Confident | 114 Ų | 114 | 116.3 Ų | 116.3 | 60% | 0.597 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -61.6 | -42.7 | 178 | -169.2 | 83.1 | 0 | 0 | 0 | 111.4 | L194 K195 Q201 R202 | L194-L198 WeakPolarHBondContact O-CB 3.48Å; L194-L198 PolarHBondContact O-N 2.89Å; K195-L198 PolarHBondContact O-N 2.91Å; L198-Q201 PolarHBondContact O-N 3.33Å; L198-R202 WeakPolarHBondContact O-CB 3.4Å; L198-R202 PolarHBondContact O-N 3.15Å |
| 199 | Q | 82.4 | Confident | 73.3 | Confident | 139 Ų | 139 | 120.7 Ų | 120.7 | 65% | 0.65 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -64.3 | -41.4 | 175.2 | -77.7 | -162.1 | 2.5 | 0 | 0 | 112.2 | K195 S197 Q201 R202 K203 | K195-Q199 WeakPolarHBondContact O-CG 3.49Å; K195-Q199 PolarHBondContact O-N 2.91Å; S197-Q199 PolarHBondContact O-N 3.49Å; Q199-Q201 VanDerWaalsContact C-N 3.35Å; Q199-R202 PolarHBondContact O-N 3.5Å; Q199-K203 WeakPolarHBondContact O-CB 3.49Å; Q199-K203 PolarHBondContact O-N 3.05Å |
| 200 | K | 80 | Confident | 71.6 | Confident | 147 Ų | 147 | 125 Ų | 125 | 64% | 0.639 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -63.4 | -39.6 | 174.5 | -77.1 | 171.9 | -179.8 | 174.7 | 0 | 111.8 | D196 S197 K203 R204 | D196-K200 WeakPolarHBondContact O-CB 3.32Å; D196-K200 VanDerWaalsContact O-CG 3.28Å; D196-K200 WeakPolarHBondContact O-CG 3.34Å; D196-K200 PolarHBondContact O-N 2.86Å; S197-K200 PolarHBondContact O-N 3.23Å; K200-K203 PolarHBondContact O-N 2.96Å; K200-R204 WeakPolarHBondContact O-CB 3.5Å; K200-R204 WeakPolarHBondContact O-CG 3.28Å; K200-R204 PolarHBondContact O-N 3.5Å |
| 201 | Q | 78.7 | Confident | 70.1 | Confident | 111 Ų | 111 | 126.3 Ų | 126.3 | 52% | 0.519 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -64 | -47.3 | 174.8 | -178.3 | -176.9 | -23.2 | 0 | 0 | 111.4 | S197 L198 Q199 K203 R204 Q205 | S197-Q201 WeakPolarHBondContact O-CB 3.32Å; S197-Q201 PolarHBondContact O-N 3.39Å; L198-Q201 PolarHBondContact O-N 3.33Å; Q199-Q201 VanDerWaalsContact C-N 3.35Å; Q201-K203 VanDerWaalsContact C-N 3.33Å; Q201-K203 PolarHBondContact O-N 3.45Å; Q201-R204 WeakPolarHBondContact O-CB 3.48Å; Q201-R204 PolarHBondContact O-N 3.19Å; Q201-Q205 PolarHBondContact O-N 3.44Å |
| 202 | R | 74.7 | Confident | 68.7 | Low | 189 Ų | 189 | 128.8 Ų | 128.8 | 71% | 0.713 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -60.7 | -43.3 | 177.2 | -170.7 | 175.7 | -180 | 171.2 | 0.7 | 111.3 | L198 Q199 R204 Q205 T206 | L198-R202 WeakPolarHBondContact O-CB 3.4Å; L198-R202 PolarHBondContact O-N 3.15Å; Q199-R202 PolarHBondContact O-N 3.5Å; R202-R204 VanDerWaalsContact C-N 3.32Å; R202-R204 PolarHBondContact O-N 3.4Å; R202-Q205 WeakPolarHBondContact O-CB 3.36Å; R202-Q205 PolarHBondContact O-N 2.85Å; R202-T206 PolarHBondContact O-N 3.18Å; R202-T206 PolarHBondContact O-OG1 2.96Å |
| 203 | K | 72 | Confident | 66.6 | Low | 162 Ų | 162 | 131.3 Ų | 131.3 | 70% | 0.704 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -65.4 | -33.7 | 177.1 | -153.6 | 167.4 | -173.8 | 176.9 | 0 | 112.3 | Q199 K200 Q201 T206 V207 | Q199-K203 WeakPolarHBondContact O-CB 3.49Å; Q199-K203 PolarHBondContact O-N 3.05Å; K200-K203 PolarHBondContact O-N 2.96Å; Q201-K203 VanDerWaalsContact C-N 3.33Å; Q201-K203 PolarHBondContact O-N 3.45Å; K203-T206 PolarHBondContact O-N 3.43Å; K203-V207 WeakPolarHBondContact O-CG2 3.39Å; K203-V207 PolarHBondContact O-N 3.2Å |
| 204 | R | 67.6 | Low | 65 | Low | 201 Ų | 201 | 129 Ų | 129 | 76% | 0.758 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -68.6 | -39.1 | 171.3 | -77 | -178.3 | 176.1 | -86.6 | 0.9 | 112.6 | K200 Q201 R202 T206 V207 S208 | K200-R204 WeakPolarHBondContact O-CB 3.5Å; K200-R204 WeakPolarHBondContact O-CG 3.28Å; K200-R204 PolarHBondContact O-N 3.5Å; Q201-R204 WeakPolarHBondContact O-CB 3.48Å; Q201-R204 PolarHBondContact O-N 3.19Å; R202-R204 VanDerWaalsContact C-N 3.32Å; R202-R204 PolarHBondContact O-N 3.4Å; R204-T206 VanDerWaalsContact C-N 3.32Å; R204-T206 PolarHBondContact O-N 3.49Å; R204-V207 PolarHBondContact O-N 3.44Å; R204-S208 PolarHBondContact O-N 2.92Å |
| 205 | Q | 60.4 | Low | 62.7 | Low | 124 Ų | 124 | 129.6 Ų | 129.6 | 58% | 0.579 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -66 | -31.9 | 172.9 | -92.4 | -175.7 | -10.7 | 0 | 0 | 113.1 | Q201 R202 S208 | Q201-Q205 PolarHBondContact O-N 3.44Å; R202-Q205 WeakPolarHBondContact O-CB 3.36Å; R202-Q205 PolarHBondContact O-N 2.85Å; Q205-S208 PolarHBondContact O-OG 2.93Å; Q205-S208 VanDerWaalsContact O-OG 3.05Å |
| 206 | T | 56 | Low | 60.5 | Low | 97 Ų | 97 | 130.4 Ų | 130.4 | 60% | 0.595 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -73.9 | -27.3 | 176.2 | -39.4 | 0 | 0 | 0 | 0 | 112.5 | R202 K203 R204 | R202-T206 PolarHBondContact O-N 3.18Å; R202-T206 PolarHBondContact O-OG1 2.96Å; K203-T206 PolarHBondContact O-N 3.43Å; R204-T206 VanDerWaalsContact C-N 3.32Å; R204-T206 PolarHBondContact O-N 3.49Å |
| 207 | V | 53.8 | Low | 58.1 | Low | 110 Ų | 110 | 132.4 Ų | 132.4 | 67% | 0.667 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -80.7 | -23.8 | 176.6 | 172 | 0 | 0 | 0 | 0 | 112.5 | K203 R204 Q209 | K203-V207 WeakPolarHBondContact O-CG2 3.39Å; K203-V207 PolarHBondContact O-N 3.2Å; R204-V207 PolarHBondContact O-N 3.44Å; V207-Q209 VanDerWaalsContact C-N 3.33Å |
| 208 | S | 52.6 | Low | 56.4 | Low | 92 Ų | 92 | 134.7 Ų | 134.7 | 64% | 0.643 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -80.6 | -10.1 | 174.3 | 61.3 | 0 | 0 | 0 | 0 | 114.3 | R204 Q205 Q210 | R204-S208 PolarHBondContact O-N 2.92Å; Q205-S208 PolarHBondContact O-OG 2.93Å; Q205-S208 VanDerWaalsContact O-OG 3.05Å; S208-Q210 VanDerWaalsContact C-N 3.33Å; S208-Q210 PolarHBondContact O-N 2.96Å |
| 209 | Q | 50 | Low | 54.2 | Low | 162 Ų | 162 | 134.3 Ų | 134.3 | 76% | 0.757 | 73% | 0.725 | S | S | * | * | trans | -97.6 | 51.4 | 174 | -65.8 | -84 | 43.9 | 0 | 0 | 109.9 | V207 L211 | V207-Q209 VanDerWaalsContact C-N 3.33Å; Q209-L211 PolarHBondContact O-N 3.34Å; Q209-L211 VanDerWaalsContact O-N 3.15Å | ||
| 210 | Q | 46.1 | Very low | 53.1 | Low | 181 Ų | 181 | 133 Ų | 133 | 85% | 0.846 | 73% | 0.728 | S | S | * | * | trans | -77.6 | 100.3 | 167.9 | -160.2 | 177.8 | -49 | 0 | 0 | 108.1 | S208 | S208-Q210 VanDerWaalsContact C-N 3.33Å; S208-Q210 PolarHBondContact O-N 2.96Å | ||
| 211 | L | 43.9 | Very low | 51 | Low | 153 Ų | 153 | 131 Ų | 131 | 80% | 0.801 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -46.8 | 133.7 | 175.9 | -168.1 | 70 | 0 | 0 | 0 | 113 | Q209 | Q209-L211 PolarHBondContact O-N 3.34Å; Q209-L211 VanDerWaalsContact O-N 3.15Å |
| 212 | P | 47 | Very low | 49.1 | Very low | 114 Ų | 114 | 133.9 Ų | 133.9 | 74% | 0.74 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 133.6 | 162.5 | -10.9 | 26.5 | 0 | 0 | 0 | 110.4 | ||
| 213 | T | 37.3 | Very low | 47.3 | Very low | 134 Ų | 134 | 130.2 Ų | 130.2 | 82% | 0.822 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -47.8 | 146.3 | 177.3 | -33 | 0 | 0 | 0 | 0 | 113.2 | ||
| 214 | P | 49.4 | Very low | 46.7 | Very low | 117 Ų | 117 | 128.3 Ų | 128.3 | 76% | 0.76 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 137.1 | -166.6 | 33.8 | -32.6 | 0 | 0 | 0 | 112.4 | ||
| 215 | C | 33.3 | Very low | 45 | Very low | 135 Ų | 135 | 124.4 Ų | 124.4 | 91% | 0.912 | 76% | 0.761 | S | S | * | * | trans | -123.4 | 136.2 | 162.3 | -96 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 216 | S | 35.5 | Very low | 44.1 | Very low | 120 Ų | 120 | 123.8 Ų | 123.8 | 84% | 0.839 | 77% | 0.77 | S | S | * | * | trans | -65.4 | 149.4 | -171 | -53.8 | 0 | 0 | 0 | 0 | 115 | ||||
| 217 | S | 33.2 | Very low | 44 | Very low | 109 Ų | 109 | 124.6 Ų | 124.6 | 76% | 0.762 | 78% | 0.777 | S | S | * | * | trans | -16.3 | 165.1 | 166 | 68.7 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 218 | P | 48.6 | Very low | 43.8 | Very low | 117 Ų | 117 | 124.8 Ų | 124.8 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | cis | -138 | 174.2 | 21.2 | 34.3 | -10.5 | 0 | 0 | 0 | 117.8 | ||||
| 219 | S | 35.4 | Very low | 43.4 | Very low | 107 Ų | 107 | 124.7 Ų | 124.7 | 75% | 0.748 | 79% | 0.785 | S | S | * | * | trans | -38.5 | -177.9 | 174.6 | 60.2 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 220 | P | 59.6 | Low | 42.8 | Very low | 111 Ų | 111 | 125.9 Ų | 125.9 | 72% | 0.721 | 79% | 0.791 | S | S | * | * | cis | -129.2 | 162.9 | -35 | 32.5 | -15.3 | 0 | 0 | 0 | 112.4 | ||||
| 221 | S | 36.7 | Very low | 42.6 | Very low | 106 Ų | 106 | 123.6 Ų | 123.6 | 74% | 0.741 | 79% | 0.789 | S | S | * | * | trans | 174.1 | 130.1 | 143 | 34.3 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 222 | L | 38.1 | Very low | 42.5 | Very low | 170 Ų | 170 | 122 Ų | 122 | 89% | 0.89 | 79% | 0.789 | S | S | * | * | trans | 72.3 | 120.1 | 141.4 | -55.9 | 168 | 0 | 0 | 0 | 119.6 | ||||
| 223 | S | 37.8 | Very low | 42.6 | Very low | 112 Ų | 112 | 120.5 Ų | 120.5 | 78% | 0.783 | 79% | 0.787 | S | S | * | * | trans | -56 | -171.1 | 170.5 | -29 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 224 | P | 59.1 | Low | 43.2 | Very low | 123 Ų | 123 | 120.3 Ų | 120.3 | 80% | 0.799 | 79% | 0.788 | S | S | * | * | cis | -132.3 | 178.9 | -21.1 | 31.8 | -11.1 | 0 | 0 | 0 | 112.5 | ||||
| 225 | S | 30.8 | Very low | 43.2 | Very low | 118 Ų | 118 | 121.4 Ų | 121.4 | 83% | 0.825 | 79% | 0.792 | S | S | * | * | trans | 143.6 | 118.8 | 136 | -168.5 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 226 | C | 42.7 | Very low | 43.9 | Very low | 111 Ų | 111 | 123.9 Ų | 123.9 | 75% | 0.75 | 78% | 0.784 | S | S | * | * | trans | -119.4 | 146.9 | 165.4 | -167.9 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 227 | P | 52.6 | Low | 44.3 | Very low | 114 Ų | 114 | 123.6 Ų | 123.6 | 74% | 0.74 | 78% | 0.781 | S | S | * | * | -137.7 | 166.9 | 118.8 | 35.6 | -22.3 | 0 | 0 | 0 | 114.3 | |||||
| 228 | P | 49.3 | Very low | 45 | Very low | 115 Ų | 115 | 125.7 Ų | 125.7 | 75% | 0.747 | 78% | 0.777 | S | S | * | * | trans | -101.9 | 160.5 | -160.6 | 38.1 | -30.8 | 0 | 0 | 0 | 115.2 | ||||
| 229 | A | 44.3 | Very low | 45.4 | Very low | 89 Ų | 89 | 126.2 Ų | 126.2 | 74% | 0.736 | 78% | 0.779 | S | S | * | * | trans | -3.6 | 118.6 | 159.2 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 230 | E | 37.2 | Very low | 45.8 | Very low | 188 Ų | 188 | 126.5 Ų | 126.5 | 88% | 0.879 | 78% | 0.776 | S | S | * | * | trans | -82.3 | 118.5 | 154 | -65.8 | -163 | 137.6 | 0 | 0 | 109.7 | ||||
| 231 | T | 42.3 | Very low | 45.3 | Very low | 132 Ų | 132 | 128.6 Ų | 128.6 | 81% | 0.81 | 78% | 0.78 | S | S | * | * | trans | -90.1 | 104 | 173.5 | -62.5 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 232 | C | 41.7 | Very low | 45.9 | Very low | 120 Ų | 120 | 131 Ų | 131 | 81% | 0.811 | 78% | 0.779 | S | S | * | * | trans | -84.3 | 112 | 169 | -72.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 233 | A | 48.7 | Very low | 46.2 | Very low | 83 Ų | 83 | 130.5 Ų | 130.5 | 69% | 0.686 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -87.4 | 143.7 | 165 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 234 | P | 50.5 | Low | 46.5 | Very low | 130 Ų | 130 | 130.2 Ų | 130.2 | 84% | 0.844 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -82 | 129.8 | 177 | -7.8 | 25.5 | 0 | 0 | 0 | 112.3 | Y236 | P234-Y236 PolarHBondContact O-N 3.23Š|
| 235 | T | 49.6 | Very low | 46.2 | Very low | 139 Ų | 139 | 128.9 Ų | 128.9 | 85% | 0.853 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 116.2 | 176.8 | -37.7 | 0 | 0 | 0 | 0 | 111.7 | ||
| 236 | Y | 48 | Very low | 47.3 | Very low | 188 Ų | 188 | 132.3 Ų | 132.3 | 74% | 0.737 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 130.5 | 168.6 | -174.9 | -102.3 | 0 | 0 | 0 | 109.5 | P234 F238 | P234-Y236 PolarHBondContact O-N 3.23Å; Y236-F238 HydrophobicContact CE1-CB 4.29Å; Y236-F238 AromaticContact CE1-CD2 3.68Å; Y236-F238 HydrophobicContact CE1-CD2 3.68Å; Y236-F238 HydrophobicContact CE1-CG 4.46Å; Y236-F238 AromaticContact CZ-CD2 3.96Å |
| 237 | S | 44.9 | Very low | 48.1 | Very low | 113 Ų | 113 | 136.4 Ų | 136.4 | 79% | 0.79 | 79% | 0.786 | S | S | * | * | trans | -115.4 | 127.1 | 177.7 | 34.4 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 238 | F | 47.1 | Very low | 48.6 | Very low | 154 Ų | 154 | 137.1 Ų | 137.1 | 68% | 0.675 | 78% | 0.783 | S | S | * | * | trans | -118.3 | 126.1 | 175.5 | -150.5 | -94.8 | 0 | 0 | 0 | 108.9 | Y236 V240 | Y236-F238 HydrophobicContact CE1-CB 4.29Å; Y236-F238 AromaticContact CE1-CD2 3.68Å; Y236-F238 HydrophobicContact CE1-CD2 3.68Å; Y236-F238 HydrophobicContact CE1-CG 4.46Å; Y236-F238 AromaticContact CZ-CD2 3.96Å; F238-V240 PolarHBondContact O-N 3.24Å | ||
| 239 | T | 55.9 | Low | 49.5 | Very low | 128 Ų | 128 | 140 Ų | 140 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -83.7 | 108.2 | 170.4 | 47.9 | 0 | 0 | 0 | 0 | 109.3 | L241 | T239-L241 PolarHBondContact O-N 3.46Š| ||
| 240 | V | 44 | Very low | 50.4 | Low | 113 Ų | 113 | 144.2 Ų | 144.2 | 69% | 0.685 | 79% | 0.793 | S | S | * | * | trans | -78.5 | 110 | 165.6 | 170 | 0 | 0 | 0 | 0 | 107.9 | F238 | F238-V240 PolarHBondContact O-N 3.24Š| ||
| 241 | L | 49.3 | Very low | 50.9 | Low | 155 Ų | 155 | 146.8 Ų | 146.8 | 81% | 0.812 | 81% | 0.811 | S | S | * | * | trans | -89.4 | 109.5 | 158.7 | -118.3 | 90.5 | 0 | 0 | 0 | 107.4 | T239 N243 | T239-L241 PolarHBondContact O-N 3.46Å; L241-N243 PolarHBondContact O-N 3.19Å | ||
| 242 | H | 49.5 | Very low | 51.3 | Low | 156 Ų | 156 | 147.5 Ų | 147.5 | 72% | 0.722 | 81% | 0.811 | S | S | * | * | trans | -75.4 | 113 | 170 | -133.1 | -99.4 | 0 | 0 | 0 | 108 | ||||
| 243 | N | 45.8 | Very low | 51.9 | Low | 160 Ų | 160 | 148.9 Ų | 148.9 | 86% | 0.856 | 81% | 0.811 | S | S | * | * | trans | -128.9 | 86.8 | 157.5 | -99 | -6.3 | 0 | 0 | 0 | 107 | L241 | L241-N243 PolarHBondContact O-N 3.19Š| ||
| 244 | S | 43.7 | Very low | 52 | Low | 105 Ų | 105 | 152.6 Ų | 152.6 | 73% | 0.734 | 82% | 0.818 | S | S | * | * | trans | -88.2 | 107.4 | 167.2 | -179.7 | 0 | 0 | 0 | 0 | 107 | ||||
| 245 | A | 51.9 | Low | 52.1 | Low | 96 Ų | 96 | 153.9 Ų | 153.9 | 79% | 0.793 | 82% | 0.816 | S | S | * | * | trans | -128.4 | 106.7 | 162.3 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 246 | E | 53.9 | Low | 52.3 | Low | 190 Ų | 190 | 154.9 Ų | 154.9 | 89% | 0.888 | 81% | 0.814 | S | S | * | * | trans | -51.9 | 133.6 | 164.5 | 59.7 | -170.4 | 114.7 | 0 | 0 | 110.4 | ||||
| 247 | E | 59.9 | Low | 52.6 | Low | 196 Ų | 196 | 152.7 Ų | 152.7 | 92% | 0.916 | 82% | 0.819 | S | S | * | * | trans | -136.7 | 128.5 | 154.7 | -162.9 | 172.5 | 112.9 | 0 | 0 | 108.1 | ||||
| 248 | D | 62.8 | Low | 53.1 | Low | 130 Ų | 130 | 155.5 Ų | 155.5 | 70% | 0.695 | 82% | 0.821 | S | S | * | * | trans | -65.3 | 135.1 | -170.4 | -174.6 | 32.2 | 0 | 0 | 0 | 112.6 | ||||
| 249 | M | 68.1 | Low | 53.6 | Low | 176 Ų | 176 | 155.6 Ų | 155.6 | 87% | 0.867 | 83% | 0.832 | S | S | * | * | trans | -107 | 98.1 | 169.1 | -74.8 | -150.6 | -48.6 | 0 | 0 | 108.7 | ||||
| 250 | E | 64.5 | Low | 53.4 | Low | 176 Ų | 176 | 157.9 Ų | 157.9 | 82% | 0.822 | 84% | 0.836 | S | S | * | * | trans | -79.3 | 139.1 | 164 | -84.4 | -174 | 149.1 | 0 | 0 | 111.2 | ||||
| 251 | I | 47 | Very low | 54.2 | Low | 242 Ų | 242 | 162 Ų | 162 | 100% | 1.241 | 85% | 0.85 | S | S | * | * | trans | -84.5 | 0 | -179.9 | 47.6 | 168.5 | 0 | 0 | 0 | 112.9 |
Retrieved 251 of 251 residues in 213.1 ms
(Link to these results)