| 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 | 46.7 | Very low | 47.2 | Very low | 233 Ų | 233 | 154.6 Ų | 154.6 | 100% | 1.148 | 83% | 0.826 | S | S | * | * | 0 | 113.9 | 0 | -62.3 | 87.5 | 157.6 | 0 | 0 | 105.9 | |||||
| 2 | D | 52.2 | Low | 46.5 | Very low | 154 Ų | 154 | 151 Ų | 151 | 82% | 0.824 | 82% | 0.822 | S | S | * | * | cis | -146.7 | 124.6 | 6.8 | -83.2 | -43.3 | 0 | 0 | 0 | 104.8 | ||||
| 3 | K | 44.8 | Very low | 45.9 | Very low | 204 Ų | 204 | 147 Ų | 147 | 89% | 0.887 | 82% | 0.822 | S | S | * | * | 58.6 | 133.1 | 69.2 | -98.2 | -169.7 | 177.5 | -168.9 | 0 | 117.2 | |||||
| 4 | S | 57.2 | Low | 45.5 | Very low | 118 Ų | 118 | 150.5 Ų | 150.5 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | trans | 89.9 | 113.6 | 170.5 | 68.8 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 5 | Q | 44.3 | Very low | 44.8 | Very low | 167 Ų | 167 | 148.8 Ų | 148.8 | 78% | 0.78 | 83% | 0.832 | S | S | * | * | cis | 78 | 99.7 | 27.8 | -158 | 97.7 | 49 | 0 | 0 | 115.7 | ||||
| 6 | I | 48.4 | Very low | 44.6 | Very low | 134 Ų | 134 | 146.6 Ų | 146.6 | 69% | 0.687 | 83% | 0.829 | S | S | * | * | trans | 72.3 | 143.5 | 145.8 | -69.5 | 176.4 | 0 | 0 | 0 | 116.3 | ||||
| 7 | P | 49.4 | Very low | 44.4 | Very low | 120 Ų | 120 | 145 Ų | 145 | 78% | 0.779 | 83% | 0.83 | S | S | * | * | cis | -142.7 | 166.1 | 46.3 | 24.3 | 2.6 | 0 | 0 | 0 | 121.2 | ||||
| 8 | N | 40.5 | Very low | 44.5 | Very low | 142 Ų | 142 | 145.6 Ų | 145.6 | 76% | 0.759 | 83% | 0.828 | S | S | * | * | trans | -56.7 | 143.1 | 163.4 | -71.8 | -47.4 | 0 | 0 | 0 | 113.3 | ||||
| 9 | E | 48.2 | Very low | 44.6 | Very low | 188 Ų | 188 | 147.8 Ų | 147.8 | 88% | 0.879 | 83% | 0.827 | S | S | * | * | trans | -151 | 127.3 | 145.5 | -82 | -64.1 | 125.5 | 0 | 0 | 107.3 | ||||
| 10 | T | 43 | Very low | 44.5 | Very low | 122 Ų | 122 | 148.3 Ų | 148.3 | 75% | 0.748 | 83% | 0.827 | S | S | * | * | trans | -102.4 | 146.5 | 169.4 | -36 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 11 | P | 44.8 | Very low | 44.6 | Very low | 119 Ų | 119 | 147.1 Ų | 147.1 | 77% | 0.773 | 82% | 0.824 | S | S | * | * | -149.2 | 138.4 | 114.9 | 29.9 | -10 | 0 | 0 | 0 | 115.9 | |||||
| 12 | S | 37.9 | Very low | 44.5 | Very low | 111 Ų | 111 | 142.5 Ų | 142.5 | 78% | 0.776 | 81% | 0.809 | S | S | * | * | trans | 30.8 | 118.8 | 137 | -53.5 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 13 | A | 39.2 | Very low | 44.5 | Very low | 99 Ų | 99 | 139.2 Ų | 139.2 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | 66.3 | 100.5 | 129.3 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 14 | E | 39.7 | Very low | 45.3 | Very low | 196 Ų | 196 | 135.2 Ų | 135.2 | 92% | 0.916 | 80% | 0.798 | S | S | * | * | trans | -138.2 | 119.2 | 142.1 | -102.7 | -174.9 | 163.5 | 0 | 0 | 111.2 | ||||
| 15 | S | 35.6 | Very low | 44.9 | Very low | 125 Ų | 125 | 139.8 Ų | 139.8 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | -65.5 | 120.1 | 175.5 | 36.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 16 | S | 41.7 | Very low | 45.5 | Very low | 113 Ų | 113 | 136.9 Ų | 136.9 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | trans | -115.1 | 123.2 | 169.1 | 49.4 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 17 | S | 41.2 | Very low | 45.9 | Very low | 120 Ų | 120 | 137.4 Ų | 137.4 | 84% | 0.839 | 80% | 0.803 | S | S | * | * | trans | -43.5 | 121.4 | -177.8 | -65.4 | 0 | 0 | 0 | 0 | 116.3 | K19 | S17-K19 PolarHBondContact O-N 2.99Š| ||
| 18 | I | 47.1 | Very low | 46.5 | Very low | 155 Ų | 155 | 136.3 Ų | 136.3 | 80% | 0.795 | 79% | 0.794 | S | S | * | * | trans | -77.3 | 103.8 | 159.8 | -58.4 | 173.6 | 0 | 0 | 0 | 107.7 | L20 | I18-L20 PolarHBondContact O-N 3.22Š| ||
| 19 | K | 45.9 | Very low | 46.9 | Very low | 188 Ų | 188 | 136.3 Ų | 136.3 | 82% | 0.817 | 79% | 0.793 | S | S | * | * | trans | -67 | 96.2 | 169.8 | -123.8 | 178.5 | -175.5 | -177.4 | 0 | 108.4 | S17 T21 | S17-K19 PolarHBondContact O-N 2.99Å; K19-T21 PolarHBondContact O-N 3.49Å | ||
| 20 | L | 41.3 | Very low | 47.2 | Very low | 158 Ų | 158 | 133.9 Ų | 133.9 | 83% | 0.827 | 79% | 0.786 | S | S | * | * | trans | -66.6 | 97.6 | 165.6 | -85.6 | 140.8 | 0 | 0 | 0 | 108.4 | I18 T22 | I18-L20 PolarHBondContact O-N 3.22Å; L20-T22 PolarHBondContact O-N 3.48Å | ||
| 21 | T | 47.5 | Very low | 47.9 | Very low | 124 Ų | 124 | 134 Ų | 134 | 76% | 0.761 | 78% | 0.781 | S | S | * | * | trans | -77.8 | 107.5 | 170.9 | 57 | 0 | 0 | 0 | 0 | 108.4 | K19 A23 | K19-T21 PolarHBondContact O-N 3.49Å; T21-A23 PolarHBondContact O-N 3.25Å | ||
| 22 | T | 44.9 | Very low | 48.1 | Very low | 135 Ų | 135 | 135.4 Ų | 135.4 | 83% | 0.828 | 78% | 0.781 | S | S | * | * | trans | -66.7 | 100 | 175 | -52.4 | 0 | 0 | 0 | 0 | 109.4 | L20 | L20-T22 PolarHBondContact O-N 3.48Š| ||
| 23 | A | 51.8 | Low | 48.8 | Very low | 85 Ų | 85 | 135.6 Ų | 135.6 | 70% | 0.702 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 130.6 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | T21 | T21-A23 PolarHBondContact O-N 3.25Š|
| 24 | P | 61.2 | Low | 49.2 | Very low | 120 Ų | 120 | 137 Ų | 137 | 78% | 0.779 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 134.8 | 178.3 | 29.1 | -31.8 | 0 | 0 | 0 | 109.3 | ||
| 25 | R | 49.9 | Very low | 49.3 | Very low | 214 Ų | 214 | 135.2 Ų | 135.2 | 81% | 0.808 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 134.5 | 174.7 | -80.2 | 178.4 | 167.5 | -168.4 | -5.4 | 110 | T27 | R25-T27 PolarHBondContact O-N 3.43Š|
| 26 | P | 56.6 | Low | 49.8 | Very low | 107 Ų | 107 | 135.2 Ų | 135.2 | 70% | 0.695 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 122.4 | 174.2 | 26.4 | -31.4 | 0 | 0 | 0 | 109.7 | T28 | P26-T28 PolarHBondContact O-N 2.93Š|
| 27 | T | 56.5 | Low | 50 | Low | 145 Ų | 145 | 136.6 Ų | 136.6 | 89% | 0.89 | 76% | 0.755 | S | S | * | * | trans | -88.7 | 24.3 | 179.9 | -30.5 | 0 | 0 | 0 | 0 | 112.2 | R25 | R25-T27 PolarHBondContact O-N 3.43Š| ||
| 28 | T | 61.2 | Low | 50 | Low | 97 Ų | 97 | 141.2 Ų | 141.2 | 60% | 0.595 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -128.1 | 131.8 | 179.5 | 54.8 | 0 | 0 | 0 | 0 | 109.6 | P26 N30 | P26-T28 PolarHBondContact O-N 2.93Å; T28-N30 VanDerWaalsContact C-N 3.31Å; T28-N30 PolarHBondContact O-N 3.25Å |
| 29 | L | 49.8 | Very low | 49.6 | Very low | 142 Ų | 142 | 136.5 Ų | 136.5 | 74% | 0.743 | 74% | 0.741 | S | S | * | * | trans | -70.2 | 90.9 | 176.8 | -148.4 | 153.7 | 0 | 0 | 0 | 106.5 | I31 | L29-I31 HydrophobicContact CD2-CD1 4.12Å; L29-I31 HydrophobicContact CD2-CG1 3.47Å; L29-I31 VanDerWaalsContact CD2-CG1 3.47Å; L29-I31 PolarHBondContact O-N 3.32Å | ||
| 30 | N | 53.8 | Low | 49.5 | Very low | 137 Ų | 137 | 133.9 Ų | 133.9 | 73% | 0.733 | 74% | 0.743 | S | S | * | * | trans | -66.2 | 88.4 | 172 | -85.6 | 6.8 | 0 | 0 | 0 | 108 | T28 L32 | T28-N30 VanDerWaalsContact C-N 3.31Å; T28-N30 PolarHBondContact O-N 3.25Å; N30-L32 PolarHBondContact O-N 3.19Å | ||
| 31 | I | 57.5 | Low | 49.6 | Very low | 124 Ų | 124 | 129.7 Ų | 129.7 | 64% | 0.636 | 73% | 0.731 | S | S | * | * | trans | -73.8 | 101.6 | 162.2 | -54.9 | 174.8 | 0 | 0 | 0 | 104.4 | L29 L33 | L29-I31 HydrophobicContact CD2-CD1 4.12Å; L29-I31 HydrophobicContact CD2-CG1 3.47Å; L29-I31 VanDerWaalsContact CD2-CG1 3.47Å; L29-I31 PolarHBondContact O-N 3.32Å; I31-L33 VanDerWaalsContact C-N 3.31Å; I31-L33 HydrophobicContact CG2-CD1 3.8Å; I31-L33 PolarHBondContact O-N 3.34Å | ||
| 32 | L | 49.5 | Very low | 49.4 | Very low | 148 Ų | 148 | 129 Ų | 129 | 78% | 0.775 | 72% | 0.723 | S | S | * | * | trans | -60.6 | 98 | 166.8 | -168.6 | 94.5 | 0 | 0 | 0 | 106.6 | N30 | N30-L32 PolarHBondContact O-N 3.19Š| ||
| 33 | L | 53.9 | Low | 49.3 | Very low | 115 Ų | 115 | 126.9 Ų | 126.9 | 60% | 0.602 | 71% | 0.713 | S | S | * | * | trans | -78.5 | 114.6 | 164.2 | -116.2 | 67.1 | 0 | 0 | 0 | 105.8 | I31 N35 | I31-L33 VanDerWaalsContact C-N 3.31Å; I31-L33 HydrophobicContact CG2-CD1 3.8Å; I31-L33 PolarHBondContact O-N 3.34Å; L33-N35 PolarHBondContact O-N 3.45Å | ||
| 34 | D | 47 | Very low | 49 | Very low | 130 Ų | 130 | 127.8 Ų | 127.8 | 70% | 0.695 | 71% | 0.714 | S | S | * | * | trans | -60.6 | 103.7 | 172.3 | -76.5 | -35.1 | 0 | 0 | 0 | 109.1 | T36 | D34-T36 PolarHBondContact O-N 3.36Š| ||
| 35 | N | 42.3 | Very low | 48.1 | Very low | 157 Ų | 157 | 130.8 Ų | 130.8 | 84% | 0.84 | 72% | 0.715 | S | S | * | * | trans | -71.3 | 75.9 | 170.3 | -79.4 | 2 | 0 | 0 | 0 | 109.1 | L33 | L33-N35 PolarHBondContact O-N 3.45Š| ||
| 36 | T | 45.5 | Very low | 48.3 | Very low | 126 Ų | 126 | 127.3 Ų | 127.3 | 77% | 0.773 | 71% | 0.712 | S | S | * | * | trans | -119.3 | 6.5 | 166.4 | -37.8 | 0 | 0 | 0 | 0 | 112.3 | D34 | D34-T36 PolarHBondContact O-N 3.36Š| ||
| 37 | I | 46.3 | Very low | 48.1 | Very low | 141 Ų | 141 | 128.4 Ų | 128.4 | 72% | 0.723 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -112.6 | 108.8 | 168 | -55.8 | 178 | 0 | 0 | 0 | 107.6 | S39 | I37-S39 PolarHBondContact O-N 3.34Š|
| 38 | K | 41.6 | Very low | 48 | Very low | 217 Ų | 217 | 125.9 Ų | 125.9 | 94% | 0.943 | 70% | 0.703 | S | S | * | * | trans | -62.7 | 81.8 | 167.3 | -65.3 | 173.3 | 179 | 177.8 | 0 | 108.3 | ||||
| 39 | S | 38.5 | Very low | 47.7 | Very low | 56 Ų | 56 | 124.4 Ų | 124.4 | 39% | 0.392 | 70% | 0.696 | S | S | . | * | trans | -120.1 | 111.5 | 171.7 | 54.5 | 0 | 0 | 0 | 0 | 109 | I37 A41 | I37-S39 PolarHBondContact O-N 3.34Å; S39-A41 PolarHBondContact O-N 3.37Å | ||
| 40 | P | 43 | Very low | 48.1 | Very low | 134 Ų | 134 | 121.4 Ų | 121.4 | 87% | 0.87 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | 31 | 179.6 | 32.7 | -33.9 | 0 | 0 | 0 | 113 | ||
| 41 | A | 43.9 | Very low | 48.6 | Very low | 70 Ų | 70 | 120.7 Ų | 120.7 | 58% | 0.579 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.3 | 6.3 | -166.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | S39 | S39-A41 PolarHBondContact O-N 3.37Š|
| 42 | L | 42.3 | Very low | 48.8 | Very low | 110 Ų | 110 | 122.1 Ų | 122.1 | 58% | 0.576 | 68% | 0.677 | S | S | * | * | trans | -115.2 | 24.2 | -178.2 | -62.1 | -177.9 | 0 | 0 | 0 | 114.1 | S44 F45 | L42-S44 VanDerWaalsContact C-N 3.3Å; L42-F45 HydrophobicContact CD2-CD2 4.44Å; L42-F45 HydrophobicContact CD2-CE2 4.45Å | ||
| 43 | S | 42.6 | Very low | 49.1 | Very low | 90 Ų | 90 | 117.7 Ų | 117.7 | 63% | 0.629 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -79.5 | -11.3 | 165.7 | 50.5 | 0 | 0 | 0 | 0 | 113.2 | F45 | S43-F45 VanDerWaalsContact C-N 3.34Å; S43-F45 PolarHBondContact O-N 3.5Å |
| 44 | S | 45.7 | Very low | 49.8 | Very low | 103 Ų | 103 | 118.7 Ų | 118.7 | 72% | 0.72 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | 10.2 | -175.2 | -64.1 | 0 | 0 | 0 | 0 | 115.9 | L42 | L42-S44 VanDerWaalsContact C-N 3.3Š|
| 45 | F | 42.2 | Very low | 50.5 | Low | 184 Ų | 184 | 117.7 Ų | 117.7 | 81% | 0.807 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.3 | 10.1 | 174.6 | -75.4 | -75.1 | 0 | 0 | 0 | 114.2 | L42 S43 T47 | L42-F45 HydrophobicContact CD2-CD2 4.44Å; L42-F45 HydrophobicContact CD2-CE2 4.45Å; S43-F45 VanDerWaalsContact C-N 3.34Å; S43-F45 PolarHBondContact O-N 3.5Å; F45-T47 PolarHBondContact O-N 2.93Å |
| 46 | L | 54.1 | Low | 51.4 | Low | 141 Ų | 141 | 116.1 Ų | 116.1 | 74% | 0.738 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -74.5 | 119.9 | 159.8 | -74.4 | 160.4 | 0 | 0 | 0 | 107.2 | P48 | L46-P48 VanDerWaalsContact O-N 3.12Š|
| 47 | T | 53.6 | Low | 52.1 | Low | 129 Ų | 129 | 113.9 Ų | 113.9 | 79% | 0.791 | 63% | 0.629 | S | S | * | * | P | Polyproline II helix | trans | -47.9 | 120.6 | 167 | 42.6 | 0 | 0 | 0 | 0 | 108.1 | F45 S49 | F45-T47 PolarHBondContact O-N 2.93Å; T47-S49 PolarHBondContact O-N 3.21Å |
| 48 | P | 53.3 | Low | 53 | Low | 93 Ų | 93 | 111.9 Ų | 111.9 | 60% | 0.604 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -60 | 127.9 | -178.3 | 23.8 | -31 | 0 | 0 | 0 | 107.8 | L46 | L46-P48 VanDerWaalsContact O-N 3.12Š|
| 49 | S | 56.1 | Low | 54.5 | Low | 65 Ų | 65 | 104 Ų | 104 | 46% | 0.455 | 59% | 0.585 | S | S | . | * | P | Polyproline II helix | trans | -60.5 | 147.1 | 176.5 | -155.1 | 0 | 0 | 0 | 0 | 108.5 | T47 E51 E52 | T47-S49 PolarHBondContact O-N 3.21Å; S49-E51 WeakPolarHBondContact CB-OE2 3.42Å; S49-E51 PolarHBondContact O-N 3.07Å; S49-E51 PolarHBondContact OG-OE2 3.12Å; S49-E52 PolarHBondContact O-N 3.04Å |
| 50 | L | 57.3 | Low | 56.2 | Low | 79 Ų | 79 | 106.6 Ų | 106.6 | 41% | 0.414 | 59% | 0.591 | S | S | . | * | G | 310 helix | trans | -56.3 | -20.9 | -178.6 | -171.8 | 61.1 | 0 | 0 | 0 | 112 | L53 V61 | L50-L53 HydrophobicContact CD1-CD1 4.28Å; L50-V61 HydrophobicContact CD1-CG1 4.03Å |
| 51 | E | 65.5 | Low | 57.6 | Low | 123 Ų | 123 | 102.8 Ų | 102.8 | 58% | 0.575 | 57% | 0.565 | S | S | * | * | G | 310 helix | trans | -77.5 | -5 | 175 | -59.2 | 76 | -161.9 | 0 | 0 | 115.3 | S49 R58 | S49-E51 WeakPolarHBondContact CB-OE2 3.42Å; S49-E51 PolarHBondContact O-N 3.07Å; S49-E51 PolarHBondContact OG-OE2 3.12Å; E51-R58 VanDerWaalsContact CA-NH2 3.34Å; E51-R58 PolarHBondContact O-NH2 3.49Å |
| 52 | E | 61.4 | Low | 59 | Low | 153 Ų | 153 | 105 Ų | 105 | 72% | 0.715 | 56% | 0.563 | S | S | * | * | G | 310 helix | trans | -101.1 | -5.5 | 177.8 | -83.7 | 177.5 | 157.3 | 0 | 0 | 114.2 | S49 | S49-E52 PolarHBondContact O-N 3.04Š|
| 53 | L | 54.8 | Low | 60.7 | Low | 56 Ų | 56 | 106.8 Ų | 106.8 | 29% | 0.293 | 57% | 0.566 | S | S | . | * | S | Bend | trans | -76.2 | 140.9 | 177 | -67.6 | 174.5 | 0 | 0 | 0 | 111.5 | L50 R58 V61 | L50-L53 HydrophobicContact CD1-CD1 4.28Å; L53-R58 HydrophobicContact CB-CG 3.8Å; L53-R58 WeakPolarHBondContact O-CG 3.01Å; L53-R58 PolarHBondContact O-NE 2.97Å; L53-V61 HydrophobicContact CD1-CB 4.5Å; L53-V61 HydrophobicContact CD1-CG1 4.49Å; L53-V61 HydrophobicContact CD1-CG2 4.09Å |
| 54 | Q | 68.6 | Low | 62.1 | Low | 135 Ų | 135 | 106.9 Ų | 106.9 | 63% | 0.631 | 56% | 0.559 | S | S | * | * | trans | -53.3 | 145.3 | 171.8 | -84.8 | -164.9 | -34.1 | 0 | 0 | 111 | I56 L57 R58 | Q54-I56 PolarHBondContact O-N 3.48Å; Q54-I56 VanDerWaalsContact O-N 3.08Å; Q54-L57 HydrophobicContact CB-CD1 4.34Å; Q54-L57 CarbonylContact O-C 3.44Å; Q54-L57 PolarHBondContact O-N 2.95Å; Q54-R58 PolarHBondContact O-N 3.38Å | ||
| 55 | P | 63.1 | Low | 63.5 | Low | 109 Ų | 109 | 105.8 Ų | 105.8 | 71% | 0.708 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -54.9 | -34.3 | -174.2 | -24.5 | 31.7 | 0 | 0 | 0 | 114.5 | R58 S59 | P55-R58 PolarHBondContact O-N 2.77Å; P55-S59 PolarHBondContact O-N 3.22Å |
| 56 | I | 60.9 | Low | 65 | Low | 125 Ų | 125 | 103.7 Ų | 103.7 | 64% | 0.641 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -67.1 | -45.6 | 177.5 | -72.7 | 164.6 | 0 | 0 | 0 | 110.8 | Q54 S59 E60 | Q54-I56 PolarHBondContact O-N 3.48Å; Q54-I56 VanDerWaalsContact O-N 3.08Å; I56-S59 PolarHBondContact O-N 3.16Å; I56-S59 PolarHBondContact O-OG 3.09Å; I56-E60 PolarHBondContact O-N 2.94Å |
| 57 | L | 60.5 | Low | 65.6 | Low | 79 Ų | 79 | 103.4 Ų | 103.4 | 41% | 0.414 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -70.5 | -30.4 | 177.2 | -65.4 | 173.2 | 0 | 0 | 0 | 112.1 | Q54 E60 V61 | Q54-L57 HydrophobicContact CB-CD1 4.34Å; Q54-L57 CarbonylContact O-C 3.44Å; Q54-L57 PolarHBondContact O-N 2.95Å; L57-E60 PolarHBondContact O-N 3.45Å; L57-V61 VanDerWaalsContact O-CB 3.31Å; L57-V61 WeakPolarHBondContact O-CB 3.4Å; L57-V61 WeakPolarHBondContact O-CG2 3.38Å; L57-V61 PolarHBondContact O-N 3.39Å |
| 58 | R | 64.5 | Low | 65.9 | Low | 98 Ų | 98 | 102.7 Ų | 102.7 | 37% | 0.37 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.3 | -43.4 | 171.9 | -72.2 | -171.8 | -172.9 | -169 | 7.9 | 111.9 | E51 L53 Q54 P55 E60 V61 E62 | E51-R58 VanDerWaalsContact CA-NH2 3.34Å; E51-R58 PolarHBondContact O-NH2 3.49Å; L53-R58 HydrophobicContact CB-CG 3.8Å; L53-R58 WeakPolarHBondContact O-CG 3.01Å; L53-R58 PolarHBondContact O-NE 2.97Å; Q54-R58 PolarHBondContact O-N 3.38Å; P55-R58 PolarHBondContact O-N 2.77Å; R58-E60 VanDerWaalsContact C-N 3.29Å; R58-E60 PolarHBondContact O-N 2.91Å; R58-V61 PolarHBondContact O-N 3.19Å; R58-E62 VanDerWaalsContact O-CB 3.24Å; R58-E62 WeakPolarHBondContact O-CB 3.4Å; R58-E62 WeakPolarHBondContact O-CG 3.38Å; R58-E62 PolarHBondContact O-N 3.43Å |
| 59 | S | 72.5 | Confident | 66.3 | Low | 51 Ų | 51 | 106 Ų | 106 | 36% | 0.357 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66 | -33.6 | 179.3 | 80.4 | 0 | 0 | 0 | 0 | 112.6 | P55 I56 K63 | P55-S59 PolarHBondContact O-N 3.22Å; I56-S59 PolarHBondContact O-N 3.16Å; I56-S59 PolarHBondContact O-OG 3.09Å; S59-K63 WeakPolarHBondContact O-CB 3.22Å; S59-K63 WeakPolarHBondContact O-CD 3.39Å; S59-K63 WeakPolarHBondContact O-CG 3.37Å; S59-K63 PolarHBondContact O-N 2.96Å |
| 60 | E | 73.8 | Confident | 66.5 | Low | 111 Ų | 111 | 106.8 Ų | 106.8 | 52% | 0.519 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -79.7 | -39.2 | 179.7 | -162.9 | 155.7 | -165.8 | 0 | 0 | 111.3 | I56 L57 R58 K63 I64 | I56-E60 PolarHBondContact O-N 2.94Å; L57-E60 PolarHBondContact O-N 3.45Å; R58-E60 VanDerWaalsContact C-N 3.29Å; R58-E60 PolarHBondContact O-N 2.91Å; E60-K63 PolarHBondContact O-N 3.25Å; E60-I64 HydrophobicContact CG-CD1 4.32Å; E60-I64 WeakPolarHBondContact O-CB 3.4Å; E60-I64 WeakPolarHBondContact O-CD1 3.44Å; E60-I64 WeakPolarHBondContact O-CG1 3.46Å; E60-I64 PolarHBondContact O-N 3.3Å |
| 61 | V | 72.8 | Confident | 66 | Low | 54 Ų | 54 | 105.7 Ų | 105.7 | 33% | 0.327 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.9 | -37.1 | 171 | 173.2 | 0 | 0 | 0 | 0 | 111.4 | L50 L53 L57 R58 I64 L65 | L50-V61 HydrophobicContact CD1-CG1 4.03Å; L53-V61 HydrophobicContact CD1-CB 4.5Å; L53-V61 HydrophobicContact CD1-CG1 4.49Å; L53-V61 HydrophobicContact CD1-CG2 4.09Å; L57-V61 VanDerWaalsContact O-CB 3.31Å; L57-V61 WeakPolarHBondContact O-CB 3.4Å; L57-V61 WeakPolarHBondContact O-CG2 3.38Å; L57-V61 PolarHBondContact O-N 3.39Å; R58-V61 PolarHBondContact O-N 3.19Å; V61-I64 PolarHBondContact O-N 3.42Å; V61-L65 WeakPolarHBondContact O-CB 3.28Å; V61-L65 PolarHBondContact O-N 2.91Å |
| 62 | E | 74.3 | Confident | 65.3 | Low | 116 Ų | 116 | 105.6 Ų | 105.6 | 54% | 0.542 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -66.2 | -42.7 | 171.5 | -84.4 | 179.7 | 163.6 | 0 | 0 | 111.5 | R58 I64 L65 Q66 | R58-E62 VanDerWaalsContact O-CB 3.24Å; R58-E62 WeakPolarHBondContact O-CB 3.4Å; R58-E62 WeakPolarHBondContact O-CG 3.38Å; R58-E62 PolarHBondContact O-N 3.43Å; E62-I64 VanDerWaalsContact C-N 3.34Å; E62-I64 PolarHBondContact O-N 2.94Å; E62-L65 PolarHBondContact O-N 3.44Å; E62-Q66 WeakPolarHBondContact O-CB 3.41Å; E62-Q66 PolarHBondContact O-N 3.33Å |
| 63 | K | 76.5 | Confident | 64.6 | Low | 148 Ų | 148 | 106.8 Ų | 106.8 | 64% | 0.643 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -61.4 | -41.9 | 173.2 | -78.7 | 169.5 | -175.9 | 177.9 | 0 | 111.8 | S59 E60 Q66 H67 | S59-K63 WeakPolarHBondContact O-CB 3.22Å; S59-K63 WeakPolarHBondContact O-CD 3.39Å; S59-K63 WeakPolarHBondContact O-CG 3.37Å; S59-K63 PolarHBondContact O-N 2.96Å; E60-K63 PolarHBondContact O-N 3.25Å; K63-Q66 PolarHBondContact O-N 2.85Å; K63-H67 WeakPolarHBondContact O-CB 3.35Å; K63-H67 PolarHBondContact O-N 3.36Å |
| 64 | I | 73.9 | Confident | 64.1 | Low | 93 Ų | 93 | 110 Ų | 110 | 48% | 0.477 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -67.7 | -41.4 | 175.9 | -68.8 | 163.3 | 0 | 0 | 0 | 110.3 | E60 V61 E62 H67 L68 | E60-I64 HydrophobicContact CG-CD1 4.32Å; E60-I64 WeakPolarHBondContact O-CB 3.4Å; E60-I64 WeakPolarHBondContact O-CD1 3.44Å; E60-I64 WeakPolarHBondContact O-CG1 3.46Å; E60-I64 PolarHBondContact O-N 3.3Å; V61-I64 PolarHBondContact O-N 3.42Å; E62-I64 VanDerWaalsContact C-N 3.34Å; E62-I64 PolarHBondContact O-N 2.94Å; I64-H67 CarbonylContact O-C 3.57Å; I64-H67 PolarHBondContact O-N 3.35Å; I64-L68 HydrophobicContact CG2-CD1 3.72Å; I64-L68 HydrophobicContact CG2-CG 4.24Å; I64-L68 VanDerWaalsContact O-CB 3.28Å; I64-L68 WeakPolarHBondContact O-CB 3.46Å; I64-L68 WeakPolarHBondContact O-CG 3.33Å; I64-L68 PolarHBondContact O-N 3.41Å |
| 65 | L | 74 | Confident | 62.6 | Low | 80 Ų | 80 | 107.9 Ų | 107.9 | 42% | 0.419 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -68 | -35.6 | 177.3 | -172.4 | 65.2 | 0 | 0 | 0 | 111.9 | V61 E62 K69 | V61-L65 WeakPolarHBondContact O-CB 3.28Å; V61-L65 PolarHBondContact O-N 2.91Å; E62-L65 PolarHBondContact O-N 3.44Å; L65-K69 VanDerWaalsContact O-CB 3.29Å; L65-K69 WeakPolarHBondContact O-CB 3.4Å; L65-K69 WeakPolarHBondContact O-CG 3.38Å; L65-K69 PolarHBondContact O-N 3.25Å |
| 66 | Q | 73.7 | Confident | 61.9 | Low | 140 Ų | 140 | 105.6 Ų | 105.6 | 65% | 0.654 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -70.7 | -39 | 173.7 | -162.8 | 114.9 | 43.4 | 0 | 0 | 110.7 | E62 K63 K69 A70 | E62-Q66 WeakPolarHBondContact O-CB 3.41Å; E62-Q66 PolarHBondContact O-N 3.33Å; K63-Q66 PolarHBondContact O-N 2.85Å; Q66-K69 CarbonylContact O-C 3.58Å; Q66-K69 PolarHBondContact O-N 2.87Å; Q66-A70 WeakPolarHBondContact O-CB 3.43Å; Q66-A70 PolarHBondContact O-N 2.93Å |
| 67 | H | 66.5 | Low | 61.2 | Low | 134 Ų | 134 | 103.4 Ų | 103.4 | 62% | 0.62 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -69.4 | -35.7 | 173.5 | -170.2 | 84.4 | 0 | 0 | 0 | 112.1 | K63 I64 A70 S71 | K63-H67 WeakPolarHBondContact O-CB 3.35Å; K63-H67 PolarHBondContact O-N 3.36Å; I64-H67 CarbonylContact O-C 3.57Å; I64-H67 PolarHBondContact O-N 3.35Å; H67-A70 CarbonylContact O-C 3.52Å; H67-A70 PolarHBondContact O-N 2.83Å; H67-S71 WeakPolarHBondContact O-CB 3.33Å; H67-S71 PolarHBondContact O-N 3.39Å |
| 68 | L | 60.9 | Low | 60.6 | Low | 115 Ų | 115 | 109 Ų | 109 | 60% | 0.602 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -73.7 | -30.4 | 173.4 | -71.9 | 169 | 0 | 0 | 0 | 112 | I64 | I64-L68 HydrophobicContact CG2-CD1 3.72Å; I64-L68 HydrophobicContact CG2-CG 4.24Å; I64-L68 VanDerWaalsContact O-CB 3.28Å; I64-L68 WeakPolarHBondContact O-CB 3.46Å; I64-L68 WeakPolarHBondContact O-CG 3.33Å; I64-L68 PolarHBondContact O-N 3.41Å |
| 69 | K | 61.8 | Low | 59.8 | Low | 161 Ų | 161 | 111.8 Ų | 111.8 | 70% | 0.7 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -72.4 | -28.7 | 167.3 | -89.6 | 178.2 | 173.5 | 174.8 | 0 | 113.1 | L65 Q66 | L65-K69 VanDerWaalsContact O-CB 3.29Å; L65-K69 WeakPolarHBondContact O-CB 3.4Å; L65-K69 WeakPolarHBondContact O-CG 3.38Å; L65-K69 PolarHBondContact O-N 3.25Å; Q66-K69 CarbonylContact O-C 3.58Å; Q66-K69 PolarHBondContact O-N 2.87Å |
| 70 | A | 59.6 | Low | 58.5 | Low | 83 Ų | 83 | 116.1 Ų | 116.1 | 69% | 0.686 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -92.8 | -11.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q66 H67 | Q66-A70 WeakPolarHBondContact O-CB 3.43Å; Q66-A70 PolarHBondContact O-N 2.93Å; H67-A70 CarbonylContact O-C 3.52Å; H67-A70 PolarHBondContact O-N 2.83Å |
| 71 | S | 47 | Very low | 57.8 | Low | 56 Ų | 56 | 115.4 Ų | 115.4 | 39% | 0.392 | 63% | 0.632 | S | S | . | * | S | Bend | trans | -69.4 | 141 | 168.1 | -138.9 | 0 | 0 | 0 | 0 | 108.1 | H67 Q73 | H67-S71 WeakPolarHBondContact O-CB 3.33Å; H67-S71 PolarHBondContact O-N 3.39Å; S71-Q73 PolarHBondContact O-N 3.26Å |
| 72 | P | 50 | Low | 57.3 | Low | 121 Ų | 121 | 122.2 Ų | 122.2 | 79% | 0.786 | 66% | 0.657 | S | S | * | * | trans | -51.7 | 111.8 | -164.5 | 17.6 | -29.6 | 0 | 0 | 0 | 110.5 | T74 | P72-T74 PolarHBondContact O-N 2.95Š| ||
| 73 | Q | 46.4 | Very low | 56.8 | Low | 177 Ų | 177 | 124.2 Ų | 124.2 | 83% | 0.827 | 67% | 0.666 | S | S | * | * | trans | -42.9 | 108.9 | 172.4 | -132 | -177.9 | 17.4 | 0 | 0 | 107.3 | S71 P75 | S71-Q73 PolarHBondContact O-N 3.26Å; Q73-P75 VanDerWaalsContact O-CD 3.22Å; Q73-P75 WeakPolarHBondContact O-CD 3.48Å | ||
| 74 | T | 45.6 | Very low | 56.6 | Low | 124 Ų | 124 | 122.1 Ų | 122.1 | 76% | 0.761 | 67% | 0.665 | S | S | * | * | trans | -49.8 | 119.6 | 158 | 36.6 | 0 | 0 | 0 | 0 | 105.3 | P72 G76 | P72-T74 PolarHBondContact O-N 2.95Å; T74-G76 PolarHBondContact O-N 3Å | ||
| 75 | P | 37.3 | Very low | 56.9 | Low | 91 Ų | 91 | 121.5 Ų | 121.5 | 59% | 0.591 | 67% | 0.666 | S | S | * | * | trans | -62.9 | 93 | 178.5 | -16 | 28.5 | 0 | 0 | 0 | 106.6 | Q73 S77 | Q73-P75 VanDerWaalsContact O-CD 3.22Å; Q73-P75 WeakPolarHBondContact O-CD 3.48Å; P75-S77 PolarHBondContact O-N 3.41Å | ||
| 76 | G | 48.3 | Very low | 57.3 | Low | 61 Ų | 61 | 123.5 Ų | 123.5 | 63% | 0.629 | 67% | 0.673 | S | S | * | * | trans | -67.2 | 83.9 | 170.4 | 0 | 0 | 0 | 0 | 0 | 105.7 | T74 F78 | T74-G76 PolarHBondContact O-N 3Å; G76-F78 PolarHBondContact O-N 3.47Å | ||
| 77 | S | 45.6 | Very low | 57.7 | Low | 78 Ų | 78 | 122.7 Ų | 122.7 | 55% | 0.545 | 67% | 0.669 | S | S | . | * | trans | -44.6 | 82.3 | 174.6 | -175.5 | 0 | 0 | 0 | 0 | 110.7 | P75 L79 | P75-S77 PolarHBondContact O-N 3.41Å; S77-L79 PolarHBondContact O-N 3.42Å; S77-L79 VanDerWaalsContact O-N 3.13Å | ||
| 78 | F | 47.6 | Very low | 58.4 | Low | 197 Ų | 197 | 120 Ų | 120 | 86% | 0.864 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -71.1 | 91.7 | 151.1 | -95.2 | -96.5 | 0 | 0 | 0 | 105.3 | G76 | G76-F78 PolarHBondContact O-N 3.47Š|
| 79 | L | 48.6 | Very low | 59.6 | Low | 156 Ų | 156 | 119.7 Ų | 119.7 | 82% | 0.817 | 65% | 0.652 | S | S | * | * | S | Bend | trans | 72.9 | 73.9 | 161.9 | -52.4 | 159.6 | 0 | 0 | 0 | 115.9 | S77 | S77-L79 PolarHBondContact O-N 3.42Å; S77-L79 VanDerWaalsContact O-N 3.13Å |
| 80 | N | 45.5 | Very low | 60.7 | Low | 143 Ų | 143 | 119.7 Ų | 119.7 | 77% | 0.765 | 65% | 0.648 | S | S | * | * | trans | 45.8 | 82.3 | 157.9 | -95.4 | -5.5 | 0 | 0 | 0 | 115.8 | K82 | N80-K82 PolarHBondContact O-N 3.38Å; N80-K82 VanDerWaalsContact O-N 3.11Å | ||
| 81 | P | 57.9 | Low | 62 | Low | 95 Ų | 95 | 122.2 Ų | 122.2 | 62% | 0.617 | 64% | 0.644 | S | S | * | * | trans | -67.7 | 113.2 | 165.2 | 28 | -29.4 | 0 | 0 | 0 | 108.6 | H83 | P81-H83 PolarHBondContact O-N 2.98Š| ||
| 82 | K | 62.5 | Low | 63.9 | Low | 197 Ų | 197 | 121.9 Ų | 121.9 | 86% | 0.857 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -71.3 | -5.7 | 176.1 | -74.1 | -175 | 174.5 | -176.7 | 0 | 113.5 | N80 | N80-K82 PolarHBondContact O-N 3.38Å; N80-K82 VanDerWaalsContact O-N 3.11Å |
| 83 | H | 64.7 | Low | 65.7 | Low | 159 Ų | 159 | 120.4 Ų | 120.4 | 74% | 0.736 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -129.1 | 125.3 | -177.9 | -61.8 | -72.8 | 0 | 0 | 0 | 110 | P81 | P81-H83 PolarHBondContact O-N 2.98Š|
| 84 | V | 71 | Confident | 67.6 | Low | 104 Ų | 104 | 115.8 Ų | 115.8 | 63% | 0.63 | 61% | 0.614 | S | S | * | * | trans | -76.6 | 126.9 | 169.7 | 172.6 | 0 | 0 | 0 | 0 | 107.4 | Q88 E89 | V84-Q88 HydrophobicContact CG1-CB 3.94Å; V84-E89 HydrophobicContact CG1-CB 4.11Å | ||
| 85 | T | 80.6 | Confident | 69.6 | Low | 80 Ų | 80 | 116.3 Ų | 116.3 | 49% | 0.491 | 61% | 0.606 | S | S | . | * | trans | -68.3 | 142 | 175.1 | -51.5 | 0 | 0 | 0 | 0 | 109.6 | E87 Q88 E89 | T85-E87 HydrophobicContact CG2-CB 4.29Å; T85-E87 PolarHBondContact O-N 3Å; T85-E87 VanDerWaalsContact O-N 3.08Å; T85-Q88 VanDerWaalsContact N-OE1 3.17Å; T85-Q88 WeakPolarHBondContact O-CA 3.41Å; T85-Q88 WeakPolarHBondContact O-CB 3.48Å; T85-Q88 PolarHBondContact O-N 2.89Å; T85-E89 PolarHBondContact O-N 3.49Å | ||
| 86 | E | 82.2 | Confident | 72.1 | Confident | 121 Ų | 121 | 115.5 Ų | 115.5 | 57% | 0.565 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -51.2 | -36.5 | 178.3 | -172.1 | -171.6 | 160.6 | 0 | 0 | 112.5 | E89 R90 | E86-E89 PolarHBondContact O-N 3.41Å; E86-R90 WeakPolarHBondContact O-CG 3.32Å; E86-R90 PolarHBondContact O-N 3.36Å; E86-R90 IonicContact OE1-CZ 3.4Å; E86-R90 IonicContact OE1-NE 3.23Å; E86-R90 PolarHBondContact OE1-NE 3.28Å; E86-R90 IonicContact OE1-NH2 2.73Å; E86-R90 PolarHBondContact OE1-NH2 2.88Å |
| 87 | E | 82.9 | Confident | 74 | Confident | 123 Ų | 123 | 118 Ų | 118 | 58% | 0.575 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -63.7 | -41.7 | 174.3 | -178.7 | 175.2 | -161.2 | 0 | 0 | 112.7 | T85 E89 R90 F91 | T85-E87 HydrophobicContact CG2-CB 4.29Å; T85-E87 PolarHBondContact O-N 3Å; T85-E87 VanDerWaalsContact O-N 3.08Å; E87-E89 VanDerWaalsContact C-N 3.33Å; E87-E89 PolarHBondContact O-N 3.37Å; E87-R90 PolarHBondContact O-N 3.3Å; E87-F91 HydrophobicContact CG-CD2 3.72Å; E87-F91 HydrophobicContact CG-CE2 3.38Å; E87-F91 HydrophobicContact CG-CZ 4.47Å; E87-F91 WeakPolarHBondContact O-CD2 3.37Å; E87-F91 PolarHBondContact O-N 3.15Å; E87-F91 WeakPolarHBondContact OE1-CE2 3.28Å |
| 88 | Q | 81 | Confident | 75.8 | Confident | 77 Ų | 77 | 119.4 Ų | 119.4 | 36% | 0.36 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -65.5 | -37.5 | 175.4 | -66.5 | 173.9 | -23.2 | 0 | 0 | 111.5 | V84 T85 F91 A92 | V84-Q88 HydrophobicContact CG1-CB 3.94Å; T85-Q88 VanDerWaalsContact N-OE1 3.17Å; T85-Q88 WeakPolarHBondContact O-CA 3.41Å; T85-Q88 WeakPolarHBondContact O-CB 3.48Å; T85-Q88 PolarHBondContact O-N 2.89Å; Q88-F91 PolarHBondContact O-N 3.44Å; Q88-A92 WeakPolarHBondContact O-CB 3.42Å; Q88-A92 PolarHBondContact O-N 2.92Å |
| 89 | E | 84.7 | Confident | 77.5 | Confident | 109 Ų | 109 | 114.3 Ų | 114.3 | 51% | 0.509 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -64.8 | -44.8 | 173.6 | -172.9 | 177.7 | -176.6 | 0 | 0 | 111.1 | V84 T85 E86 E87 F91 A92 N93 | V84-E89 HydrophobicContact CG1-CB 4.11Å; T85-E89 PolarHBondContact O-N 3.49Å; E86-E89 PolarHBondContact O-N 3.41Å; E87-E89 VanDerWaalsContact C-N 3.33Å; E87-E89 PolarHBondContact O-N 3.37Å; E89-F91 PolarHBondContact O-N 2.94Å; E89-A92 PolarHBondContact O-N 3.3Å; E89-N93 VanDerWaalsContact O-CB 3.3Å; E89-N93 WeakPolarHBondContact O-CB 3.42Å; E89-N93 PolarHBondContact O-N 3.1Å; E89-N93 PolarHBondContact O-ND2 2.86Å |
| 90 | R | 85.4 | Confident | 79.2 | Confident | 161 Ų | 161 | 110.4 Ų | 110.4 | 61% | 0.608 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -59.3 | -44.9 | 174.4 | -73.1 | 178.5 | -174.3 | -134.3 | 5.7 | 111.9 | E86 E87 N93 V94 | E86-R90 WeakPolarHBondContact O-CG 3.32Å; E86-R90 PolarHBondContact O-N 3.36Å; E86-R90 IonicContact OE1-CZ 3.4Å; E86-R90 IonicContact OE1-NE 3.23Å; E86-R90 PolarHBondContact OE1-NE 3.28Å; E86-R90 IonicContact OE1-NH2 2.73Å; E86-R90 PolarHBondContact OE1-NH2 2.88Å; E87-R90 PolarHBondContact O-N 3.3Å; R90-N93 PolarHBondContact O-N 2.91Å; R90-V94 WeakPolarHBondContact O-CG2 3.32Å; R90-V94 PolarHBondContact O-N 3.33Å |
| 91 | F | 88 | Confident | 80.9 | Confident | 137 Ų | 137 | 107.5 Ų | 107.5 | 60% | 0.601 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -64.4 | -42.3 | 176.2 | -77.3 | -61.5 | 0 | 0 | 0 | 112.8 | E87 Q88 E89 N93 V94 F95 | E87-F91 HydrophobicContact CG-CD2 3.72Å; E87-F91 HydrophobicContact CG-CE2 3.38Å; E87-F91 HydrophobicContact CG-CZ 4.47Å; E87-F91 WeakPolarHBondContact O-CD2 3.37Å; E87-F91 PolarHBondContact O-N 3.15Å; E87-F91 WeakPolarHBondContact OE1-CE2 3.28Å; Q88-F91 PolarHBondContact O-N 3.44Å; E89-F91 PolarHBondContact O-N 2.94Å; F91-N93 VanDerWaalsContact C-N 3.32Å; F91-N93 PolarHBondContact O-N 3.36Å; F91-V94 PolarHBondContact O-N 3.45Å; F91-F95 PolarHBondContact O-N 3.28Å; F91-F95 VanDerWaalsContact O-N 3.12Å |
| 92 | A | 86.8 | Confident | 81.8 | Confident | 49 Ų | 49 | 108.3 Ų | 108.3 | 41% | 0.405 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.6 | -36.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q88 E89 F95 T96 | Q88-A92 WeakPolarHBondContact O-CB 3.42Å; Q88-A92 PolarHBondContact O-N 2.92Å; E89-A92 PolarHBondContact O-N 3.3Å; A92-F95 PolarHBondContact O-N 3.03Å; A92-T96 WeakPolarHBondContact O-CB 3.48Å; A92-T96 PolarHBondContact O-N 2.87Å; A92-T96 PolarHBondContact O-OG1 3.41Å |
| 93 | N | 87.5 | Confident | 82.4 | Confident | 89 Ų | 89 | 106.7 Ų | 106.7 | 48% | 0.476 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67 | -42.1 | 176.7 | -73.9 | -22.3 | 0 | 0 | 0 | 111.8 | E89 R90 F91 F95 T96 Q97 | E89-N93 VanDerWaalsContact O-CB 3.3Å; E89-N93 WeakPolarHBondContact O-CB 3.42Å; E89-N93 PolarHBondContact O-N 3.1Å; E89-N93 PolarHBondContact O-ND2 2.86Å; R90-N93 PolarHBondContact O-N 2.91Å; F91-N93 VanDerWaalsContact C-N 3.32Å; F91-N93 PolarHBondContact O-N 3.36Å; N93-F95 VanDerWaalsContact C-N 3.33Å; N93-F95 PolarHBondContact O-N 2.93Å; N93-T96 PolarHBondContact O-N 3.45Å; N93-Q97 VanDerWaalsContact O-CB 3.27Å; N93-Q97 WeakPolarHBondContact O-CB 3.43Å; N93-Q97 PolarHBondContact O-N 3.27Å |
| 94 | V | 86 | Confident | 82.7 | Confident | 80 Ų | 80 | 104.6 Ų | 104.6 | 49% | 0.485 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.6 | -42.5 | 174.3 | 173.3 | 0 | 0 | 0 | 0 | 111 | R90 F91 Q97 K98 | R90-V94 WeakPolarHBondContact O-CG2 3.32Å; R90-V94 PolarHBondContact O-N 3.33Å; F91-V94 PolarHBondContact O-N 3.45Å; V94-Q97 PolarHBondContact O-N 3.04Å; V94-K98 WeakPolarHBondContact O-CG 3.42Å; V94-K98 PolarHBondContact O-N 2.82Å |
| 95 | F | 88.2 | Confident | 82.5 | Confident | 136 Ų | 136 | 103.8 Ų | 103.8 | 60% | 0.596 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.8 | -44.8 | 176.3 | -177.1 | -101.9 | 0 | 0 | 0 | 112.2 | F91 A92 N93 K98 L99 | F91-F95 PolarHBondContact O-N 3.28Å; F91-F95 VanDerWaalsContact O-N 3.12Å; A92-F95 PolarHBondContact O-N 3.03Å; N93-F95 VanDerWaalsContact C-N 3.33Å; N93-F95 PolarHBondContact O-N 2.93Å; F95-K98 PolarHBondContact O-N 3.46Å; F95-L99 HydrophobicContact CD1-CD1 4.04Å; F95-L99 HydrophobicContact CE1-CD1 3.49Å; F95-L99 VanDerWaalsContact CE1-CD1 3.49Å; F95-L99 HydrophobicContact CE1-CG 4.16Å; F95-L99 HydrophobicContact CZ-CD1 4Å; F95-L99 HydrophobicContact CZ-CG 4.34Å; F95-L99 PolarHBondContact O-N 3.19Å |
| 96 | T | 88.9 | Confident | 80.9 | Confident | 73 Ų | 73 | 101.6 Ų | 101.6 | 45% | 0.448 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.8 | -39 | 178.7 | -53.3 | 0 | 0 | 0 | 0 | 111.6 | A92 N93 L99 N100 | A92-T96 WeakPolarHBondContact O-CB 3.48Å; A92-T96 PolarHBondContact O-N 2.87Å; A92-T96 PolarHBondContact O-OG1 3.41Å; N93-T96 PolarHBondContact O-N 3.45Å; T96-L99 PolarHBondContact O-N 3.39Å; T96-N100 PolarHBondContact O-N 2.91Å |
| 97 | Q | 87.6 | Confident | 79.4 | Confident | 115 Ų | 115 | 99.4 Ų | 99.4 | 54% | 0.537 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.6 | -45.4 | 173.7 | -175.2 | 177.8 | 27.1 | 0 | 0 | 111.1 | N93 V94 L99 N100 E101 | N93-Q97 VanDerWaalsContact O-CB 3.27Å; N93-Q97 WeakPolarHBondContact O-CB 3.43Å; N93-Q97 PolarHBondContact O-N 3.27Å; V94-Q97 PolarHBondContact O-N 3.04Å; Q97-L99 VanDerWaalsContact C-N 3.33Å; Q97-L99 PolarHBondContact O-N 2.87Å; Q97-N100 PolarHBondContact O-N 3.1Å; Q97-E101 WeakPolarHBondContact O-CG 3.38Å; Q97-E101 PolarHBondContact O-N 3.31Å |
| 98 | K | 85.2 | Confident | 77.7 | Confident | 107 Ų | 107 | 100 Ų | 100 | 47% | 0.465 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.9 | -35.8 | 176.8 | -70.8 | -72.3 | 163.7 | -153.2 | 0 | 112.9 | V94 F95 E101 L102 | V94-K98 WeakPolarHBondContact O-CG 3.42Å; V94-K98 PolarHBondContact O-N 2.82Å; F95-K98 PolarHBondContact O-N 3.46Å; K98-E101 WeakPolarHBondContact CD-OE2 3.34Å; K98-E101 IonicContact NZ-OE1 3.43Å; K98-E101 PolarHBondContact NZ-OE1 3.35Å; K98-E101 IonicContact NZ-OE2 2.71Å; K98-E101 PolarHBondContact NZ-OE2 2.93Å; K98-L102 WeakPolarHBondContact O-CB 3.49Å; K98-L102 PolarHBondContact O-N 3.14Å |
| 99 | L | 83.4 | Confident | 76.2 | Confident | 90 Ų | 90 | 99.7 Ų | 99.7 | 47% | 0.471 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.9 | -37.5 | 173.4 | -74.1 | -179.2 | 0 | 0 | 0 | 112.6 | F95 T96 Q97 L102 R103 | F95-L99 HydrophobicContact CD1-CD1 4.04Å; F95-L99 HydrophobicContact CE1-CD1 3.49Å; F95-L99 VanDerWaalsContact CE1-CD1 3.49Å; F95-L99 HydrophobicContact CE1-CG 4.16Å; F95-L99 HydrophobicContact CZ-CD1 4Å; F95-L99 HydrophobicContact CZ-CG 4.34Å; F95-L99 PolarHBondContact O-N 3.19Å; T96-L99 PolarHBondContact O-N 3.39Å; Q97-L99 VanDerWaalsContact C-N 3.33Å; Q97-L99 PolarHBondContact O-N 2.87Å; L99-L102 PolarHBondContact O-N 3.29Å; L99-R103 WeakPolarHBondContact O-CB 3.5Å; L99-R103 PolarHBondContact O-N 3.42Å |
| 100 | N | 82.8 | Confident | 74.5 | Confident | 73 Ų | 73 | 98.4 Ų | 98.4 | 39% | 0.39 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -69 | -42.4 | 173.2 | -91.1 | 3 | 0 | 0 | 0 | 111.7 | T96 Q97 L102 R103 D104 | T96-N100 PolarHBondContact O-N 2.91Å; Q97-N100 PolarHBondContact O-N 3.1Å; N100-L102 VanDerWaalsContact C-N 3.27Å; N100-L102 PolarHBondContact O-N 2.83Å; N100-R103 PolarHBondContact O-N 3.2Å; N100-R103 VanDerWaalsContact O-N 3.1Å; N100-D104 WeakPolarHBondContact O-CB 3.36Å; N100-D104 PolarHBondContact O-N 2.89Å |
| 101 | E | 81.9 | Confident | 72.5 | Confident | 83 Ų | 83 | 96.2 Ų | 96.2 | 39% | 0.388 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -56.8 | -42.9 | 172 | -73.8 | 173.7 | -158.3 | 0 | 0 | 111.1 | Q97 K98 D104 A105 | Q97-E101 WeakPolarHBondContact O-CG 3.38Å; Q97-E101 PolarHBondContact O-N 3.31Å; K98-E101 WeakPolarHBondContact CD-OE2 3.34Å; K98-E101 IonicContact NZ-OE1 3.43Å; K98-E101 PolarHBondContact NZ-OE1 3.35Å; K98-E101 IonicContact NZ-OE2 2.71Å; K98-E101 PolarHBondContact NZ-OE2 2.93Å; E101-D104 PolarHBondContact O-N 3.24Å; E101-A105 WeakPolarHBondContact O-CB 3.39Å; E101-A105 PolarHBondContact O-N 2.93Å |
| 102 | L | 77.1 | Confident | 70.5 | Confident | 111 Ų | 111 | 94 Ų | 94 | 58% | 0.581 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.8 | -42.6 | 174.2 | -106.3 | 137.5 | 0 | 0 | 0 | 111.5 | K98 L99 N100 D104 A105 S106 | K98-L102 WeakPolarHBondContact O-CB 3.49Å; K98-L102 PolarHBondContact O-N 3.14Å; L99-L102 PolarHBondContact O-N 3.29Å; N100-L102 VanDerWaalsContact C-N 3.27Å; N100-L102 PolarHBondContact O-N 2.83Å; L102-D104 VanDerWaalsContact C-N 3.31Å; L102-D104 PolarHBondContact O-N 2.99Å; L102-A105 PolarHBondContact O-N 2.98Å; L102-S106 VanDerWaalsContact O-CA 3.28Å; L102-S106 WeakPolarHBondContact O-CA 3.44Å; L102-S106 WeakPolarHBondContact O-CB 3.26Å; L102-S106 PolarHBondContact O-N 3.49Å; L102-S106 PolarHBondContact O-OG 2.85Å |
| 103 | R | 74.7 | Confident | 68.7 | Low | 163 Ų | 163 | 95.1 Ų | 95.1 | 62% | 0.615 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.2 | -37 | 177.8 | -169 | -173 | 69.3 | 165.6 | 0.7 | 112.2 | L99 N100 S106 | L99-R103 WeakPolarHBondContact O-CB 3.5Å; L99-R103 PolarHBondContact O-N 3.42Å; N100-R103 PolarHBondContact O-N 3.2Å; N100-R103 VanDerWaalsContact O-N 3.1Å; R103-S106 CarbonylContact O-C 3.6Å |
| 104 | D | 71.6 | Confident | 66.7 | Low | 116 Ų | 116 | 94.8 Ų | 94.8 | 62% | 0.62 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -80.4 | -33.4 | -179.5 | -61.1 | -17.6 | 0 | 0 | 0 | 111.2 | N100 E101 L102 | N100-D104 WeakPolarHBondContact O-CB 3.36Å; N100-D104 PolarHBondContact O-N 2.89Å; E101-D104 PolarHBondContact O-N 3.24Å; L102-D104 VanDerWaalsContact C-N 3.31Å; L102-D104 PolarHBondContact O-N 2.99Å |
| 105 | A | 65.2 | Low | 64.6 | Low | 86 Ų | 86 | 98.3 Ų | 98.3 | 71% | 0.711 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -79.1 | -27.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | E101 L102 S107 | E101-A105 WeakPolarHBondContact O-CB 3.39Å; E101-A105 PolarHBondContact O-N 2.93Å; L102-A105 PolarHBondContact O-N 2.98Å; A105-S107 PolarHBondContact O-N 2.97Å |
| 106 | S | 48.6 | Very low | 62.2 | Low | 34 Ų | 34 | 95.6 Ų | 95.6 | 24% | 0.238 | 55% | 0.549 | C | S | . | . | trans | -100.6 | 79.2 | 176.2 | 83.6 | 0 | 0 | 0 | 0 | 108.7 | L102 R103 F108 | L102-S106 VanDerWaalsContact O-CA 3.28Å; L102-S106 WeakPolarHBondContact O-CA 3.44Å; L102-S106 WeakPolarHBondContact O-CB 3.26Å; L102-S106 PolarHBondContact O-N 3.49Å; L102-S106 PolarHBondContact O-OG 2.85Å; R103-S106 CarbonylContact O-C 3.6Å; S106-F108 PolarHBondContact O-N 3.26Å; S106-F108 WeakPolarHBondContact OG-CD2 3.25Å | ||
| 107 | S | 50.4 | Low | 60 | Low | 75 Ų | 75 | 97.9 Ų | 97.9 | 52% | 0.524 | 57% | 0.565 | S | S | . | * | trans | -49.3 | 90.5 | 137.5 | 45.8 | 0 | 0 | 0 | 0 | 108 | A105 A109 S110 | A105-S107 PolarHBondContact O-N 2.97Å; S107-A109 PolarHBondContact O-N 2.91Å; S107-S110 PolarHBondContact O-N 2.97Å | ||
| 108 | F | 47.5 | Very low | 57.8 | Low | 137 Ų | 137 | 99.2 Ų | 99.2 | 60% | 0.601 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.9 | -4.8 | 174.7 | -116.2 | -87.8 | 0 | 0 | 0 | 112.6 | S106 S110 T112 | S106-F108 PolarHBondContact O-N 3.26Å; S106-F108 WeakPolarHBondContact OG-CD2 3.25Å; F108-S110 PolarHBondContact O-N 3.45Å; F108-T112 WeakPolarHBondContact O-CB 3.39Å; F108-T112 PolarHBondContact O-N 3.2Å; F108-T112 PolarHBondContact O-OG1 3.41Å |
| 109 | A | 48.4 | Very low | 55.5 | Low | 70 Ų | 70 | 99.7 Ų | 99.7 | 58% | 0.579 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -54.4 | -33.7 | 162.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | S107 A113 | S107-A109 PolarHBondContact O-N 2.91Å; A109-A113 WeakPolarHBondContact O-CB 3.35Å; A109-A113 PolarHBondContact O-N 3.3Å |
| 110 | S | 49.6 | Very low | 53.1 | Low | 82 Ų | 82 | 101 Ų | 101 | 57% | 0.573 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -81.2 | -26.1 | -173.9 | -56.8 | 0 | 0 | 0 | 0 | 114.7 | S107 F108 | S107-S110 PolarHBondContact O-N 2.97Å; F108-S110 PolarHBondContact O-N 3.45Å |
| 111 | L | 44.2 | Very low | 51.1 | Low | 114 Ų | 114 | 101.8 Ų | 101.8 | 60% | 0.597 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -87.9 | -28 | 173.2 | -71.1 | 172.4 | 0 | 0 | 0 | 112.3 | L115 | L111-L115 WeakPolarHBondContact O-CD1 3.18Å; L111-L115 WeakPolarHBondContact O-CG 3.41Å |
| 112 | T | 46.1 | Very low | 48.9 | Very low | 92 Ų | 92 | 104.3 Ų | 104.3 | 56% | 0.564 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -80.1 | -32.3 | 176.9 | -48.8 | 0 | 0 | 0 | 0 | 111.8 | F108 L115 S116 | F108-T112 WeakPolarHBondContact O-CB 3.39Å; F108-T112 PolarHBondContact O-N 3.2Å; F108-T112 PolarHBondContact O-OG1 3.41Å; T112-L115 PolarHBondContact O-N 3.03Å; T112-S116 PolarHBondContact O-N 3.49Å |
| 113 | A | 47.9 | Very low | 47 | Very low | 72 Ų | 72 | 106.4 Ų | 106.4 | 60% | 0.595 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -70.9 | -28.4 | 171.7 | 0 | 0 | 0 | 0 | 0 | 113 | A109 L115 | A109-A113 WeakPolarHBondContact O-CB 3.35Å; A109-A113 PolarHBondContact O-N 3.3Å; A113-L115 PolarHBondContact O-N 2.96Å |
| 114 | A | 46.3 | Very low | 44.9 | Very low | 81 Ų | 81 | 105 Ų | 105 | 67% | 0.669 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | -10.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 115 | L | 40.6 | Very low | 43.2 | Very low | 155 Ų | 155 | 104.7 Ų | 104.7 | 81% | 0.812 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.3 | 9.1 | -177 | -67.9 | 170.2 | 0 | 0 | 0 | 113.1 | L111 T112 A113 | L111-L115 WeakPolarHBondContact O-CD1 3.18Å; L111-L115 WeakPolarHBondContact O-CG 3.41Å; T112-L115 PolarHBondContact O-N 3.03Å; A113-L115 PolarHBondContact O-N 2.96Å |
| 116 | S | 39.3 | Very low | 41.9 | Very low | 79 Ų | 79 | 103.4 Ų | 103.4 | 55% | 0.552 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -111.9 | 130.4 | 176.9 | -164.4 | 0 | 0 | 0 | 0 | 110.4 | T112 V118 | T112-S116 PolarHBondContact O-N 3.49Å; S116-V118 PolarHBondContact O-N 2.94Å |
| 117 | P | 40.9 | Very low | 41.3 | Very low | 121 Ų | 121 | 110 Ų | 110 | 79% | 0.786 | 70% | 0.697 | S | S | * | * | trans | -76.3 | 88.4 | -176.2 | 30.9 | -32.3 | 0 | 0 | 0 | 109.9 | T119 | P117-T119 PolarHBondContact O-N 2.91Š| ||
| 118 | V | 43.3 | Very low | 40.5 | Very low | 142 Ų | 142 | 115.5 Ų | 115.5 | 86% | 0.861 | 71% | 0.708 | S | S | * | * | trans | -82.8 | 104.1 | 171.4 | 89.5 | 0 | 0 | 0 | 0 | 109.2 | S116 | S116-V118 PolarHBondContact O-N 2.94Š| ||
| 119 | T | 35.5 | Very low | 40 | Very low | 118 Ų | 118 | 115.8 Ų | 115.8 | 72% | 0.724 | 72% | 0.715 | S | S | * | * | trans | -77.2 | 141.1 | 169.7 | 1.5 | 0 | 0 | 0 | 0 | 108.5 | P117 | P117-T119 PolarHBondContact O-N 2.91Š| ||
| 120 | S | 33.9 | Very low | 39.8 | Very low | 116 Ų | 116 | 120 Ų | 120 | 81% | 0.811 | 73% | 0.727 | S | S | * | * | trans | 84.8 | 105.5 | 160.9 | -28.3 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 121 | A | 39.9 | Very low | 39.2 | Very low | 90 Ų | 90 | 123.2 Ų | 123.2 | 74% | 0.744 | 74% | 0.737 | S | S | * | * | 172.6 | 106.1 | 127.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 122 | V | 35.8 | Very low | 39 | Very low | 137 Ų | 137 | 124.3 Ų | 124.3 | 83% | 0.83 | 74% | 0.743 | S | S | * | * | trans | 37.1 | 113.6 | 132.1 | -123.8 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 123 | N | 37.3 | Very low | 38.9 | Very low | 155 Ų | 155 | 123.9 Ų | 123.9 | 83% | 0.829 | 75% | 0.748 | S | S | * | * | 168.4 | 133.8 | 88.9 | -157.3 | 3.2 | 0 | 0 | 0 | 110.3 | |||||
| 124 | N | 31.3 | Very low | 38.2 | Very low | 133 Ų | 133 | 127.5 Ų | 127.5 | 71% | 0.711 | 76% | 0.758 | S | S | * | * | trans | -84.5 | 131.2 | -177 | -148.3 | 7.4 | 0 | 0 | 0 | 108.1 | ||||
| 125 | S | 35 | Very low | 38 | Very low | 110 Ų | 110 | 129.9 Ų | 129.9 | 77% | 0.769 | 75% | 0.753 | S | S | * | * | trans | 150.5 | 106.9 | 155.3 | -70.6 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 126 | G | 38.2 | Very low | 38 | Very low | 58 Ų | 58 | 129.4 Ų | 129.4 | 60% | 0.598 | 75% | 0.752 | S | S | * | * | S | Bend | trans | 169.8 | -25.7 | 162 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||
| 127 | L | 34.9 | Very low | 38.1 | Very low | 173 Ų | 173 | 130.5 Ų | 130.5 | 91% | 0.906 | 76% | 0.759 | S | S | * | * | trans | -134.1 | 73 | -164.3 | -61.2 | 175.2 | 0 | 0 | 0 | 113.2 | ||||
| 128 | Y | 35.3 | Very low | 38.4 | Very low | 191 Ų | 191 | 134.6 Ų | 134.6 | 75% | 0.749 | 77% | 0.768 | S | S | * | * | trans | -114.5 | 89.3 | 161.1 | -12.6 | -91 | 0 | 0 | 0 | 108 | ||||
| 129 | N | 35.4 | Very low | 38.5 | Very low | 143 Ų | 143 | 134.6 Ų | 134.6 | 77% | 0.765 | 76% | 0.763 | S | S | * | * | trans | -172.2 | 88 | 148.1 | -148.6 | 5 | 0 | 0 | 0 | 111 | ||||
| 130 | I | 44.4 | Very low | 39.3 | Very low | 159 Ų | 159 | 135.2 Ų | 135.2 | 82% | 0.815 | 76% | 0.762 | S | S | * | * | trans | -127.9 | 114.2 | 152.5 | -63.1 | -162.7 | 0 | 0 | 0 | 107.5 | L132 | I130-L132 PolarHBondContact O-N 3.47Š| ||
| 131 | N | 38.1 | Very low | 40.6 | Very low | 149 Ų | 149 | 132.7 Ų | 132.7 | 80% | 0.797 | 74% | 0.742 | S | S | * | * | trans | -60.7 | 117.1 | 175 | -114.7 | -39.2 | 0 | 0 | 0 | 109.5 | A133 | N131-A133 PolarHBondContact O-N 2.93Š| ||
| 132 | L | 39.3 | Very low | 41.8 | Very low | 137 Ų | 137 | 133.9 Ų | 133.9 | 72% | 0.717 | 74% | 0.736 | S | S | * | * | trans | -91.7 | 77.1 | -179.7 | -145.4 | 76 | 0 | 0 | 0 | 108.7 | I130 F135 | I130-L132 PolarHBondContact O-N 3.47Å; L132-F135 HydrophobicContact CD1-CE2 3.98Å; L132-F135 HydrophobicContact CG-CD2 4.22Å; L132-F135 HydrophobicContact CG-CE2 3.99Å | ||
| 133 | A | 44.2 | Very low | 43.4 | Very low | 82 Ų | 82 | 133.4 Ų | 133.4 | 68% | 0.678 | 72% | 0.723 | S | S | * | * | trans | -80 | 125.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | N131 | N131-A133 PolarHBondContact O-N 2.93Š| ||
| 134 | D | 33.2 | Very low | 45 | Very low | 149 Ų | 149 | 128.8 Ų | 128.8 | 80% | 0.797 | 71% | 0.706 | S | S | * | * | trans | 44.5 | 80.7 | 159.1 | -74.3 | -33 | 0 | 0 | 0 | 119.6 | N136 | D134-N136 PolarHBondContact O-N 3.48Š| ||
| 135 | F | 42.8 | Very low | 46.8 | Very low | 130 Ų | 130 | 126 Ų | 126 | 57% | 0.57 | 69% | 0.689 | S | S | * | * | trans | -86.9 | 47.6 | 159.3 | -78.9 | -81.3 | 0 | 0 | 0 | 112.4 | L132 | L132-F135 HydrophobicContact CD1-CE2 3.98Å; L132-F135 HydrophobicContact CG-CD2 4.22Å; L132-F135 HydrophobicContact CG-CE2 3.99Å | ||
| 136 | N | 39.3 | Very low | 48.5 | Very low | 145 Ų | 145 | 125.1 Ų | 125.1 | 78% | 0.775 | 68% | 0.675 | S | S | * | * | trans | -120.3 | 61.3 | 177.3 | -152.2 | 24.4 | 0 | 0 | 0 | 110.6 | D134 | D134-N136 PolarHBondContact O-N 3.48Š| ||
| 137 | S | 41.9 | Very low | 49.9 | Very low | 102 Ų | 102 | 125.3 Ų | 125.3 | 71% | 0.713 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -159.6 | 132.9 | 166.4 | -80 | 0 | 0 | 0 | 0 | 109.7 | N139 | S137-N139 PolarHBondContact O-N 3.28Š|
| 138 | Q | 47.5 | Very low | 51.8 | Low | 207 Ų | 207 | 123.5 Ų | 123.5 | 97% | 0.967 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -68.3 | 37.2 | -176.5 | -66.2 | -178.6 | -20.6 | 0 | 0 | 114.2 | ||
| 139 | N | 46.2 | Very low | 53.5 | Low | 143 Ų | 143 | 119.8 Ų | 119.8 | 77% | 0.765 | 64% | 0.637 | S | S | * | * | trans | -141.1 | 69.3 | -175 | -126.5 | -49 | 0 | 0 | 0 | 109.9 | S137 P141 | S137-N139 PolarHBondContact O-N 3.28Å; N139-P141 WeakPolarHBondContact O-CD 3.44Å | ||
| 140 | L | 51.1 | Low | 54.6 | Low | 131 Ų | 131 | 116.4 Ų | 116.4 | 69% | 0.686 | 63% | 0.629 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 122.8 | 161.2 | -98.8 | 79.7 | 0 | 0 | 0 | 106.9 | N142 | L140-N142 PolarHBondContact O-N 3.08Å; L140-N142 VanDerWaalsContact O-N 3.12Å |
| 141 | P | 60.7 | Low | 55.5 | Low | 63 Ų | 63 | 113.2 Ų | 113.2 | 41% | 0.409 | 62% | 0.621 | S | S | . | * | P | Polyproline II helix | trans | -57.2 | 125.1 | 172.6 | 22.7 | -30.1 | 0 | 0 | 0 | 108 | N139 F143 E145 L146 | N139-P141 WeakPolarHBondContact O-CD 3.44Å; P141-F143 PolarHBondContact O-N 3.26Å; P141-E145 HydrophobicContact CB-CB 4.21Å; P141-L146 HydrophobicContact CB-CD1 4.4Å; P141-L146 HydrophobicContact CB-CG 4.35Å; P141-L146 HydrophobicContact CG-CD1 3.93Å; P141-L146 HydrophobicContact CG-CG 4.14Å |
| 142 | N | 65.3 | Low | 56.5 | Low | 115 Ų | 115 | 112.4 Ų | 112.4 | 62% | 0.615 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 140 | 167.2 | 177.1 | -8.1 | 0 | 0 | 0 | 107.7 | L140 A144 E145 L146 | L140-N142 PolarHBondContact O-N 3.08Å; L140-N142 VanDerWaalsContact O-N 3.12Å; N142-A144 PolarHBondContact O-N 2.88Å; N142-A144 PolarHBondContact OD1-N 3.35Å; N142-E145 WeakPolarHBondContact O-CA 3.35Å; N142-E145 WeakPolarHBondContact O-CB 3.33Å; N142-E145 PolarHBondContact O-N 3.47Å; N142-L146 PolarHBondContact O-N 3.42Å |
| 143 | F | 70.2 | Confident | 56.9 | Low | 127 Ų | 127 | 109 Ų | 109 | 56% | 0.557 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -47 | -34.8 | 173.7 | 179.6 | -103.3 | 0 | 0 | 0 | 112.2 | P141 E145 L146 C147 | P141-F143 PolarHBondContact O-N 3.26Å; F143-E145 VanDerWaalsContact C-N 3.34Å; F143-E145 PolarHBondContact O-N 2.86Å; F143-L146 PolarHBondContact O-N 3.08Å; F143-C147 PolarHBondContact O-N 3.31Å; F143-C147 PolarHBondContact O-SG 3.16Å; F143-C147 VanDerWaalsContact O-SG 3.42Å |
| 144 | A | 70.1 | Confident | 56.6 | Low | 57 Ų | 57 | 109 Ų | 109 | 47% | 0.471 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -59.2 | -38.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | N142 R148 | N142-A144 PolarHBondContact O-N 2.88Å; N142-A144 PolarHBondContact OD1-N 3.35Å; A144-R148 WeakPolarHBondContact O-CB 3.48Å; A144-R148 PolarHBondContact O-N 3.45Å |
| 145 | E | 69.3 | Low | 57 | Low | 74 Ų | 74 | 107.9 Ų | 107.9 | 35% | 0.346 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -73.8 | -37.6 | 178.6 | -161.7 | 60.2 | -141.8 | 0 | 0 | 111.7 | P141 N142 F143 R148 Q149 | P141-E145 HydrophobicContact CB-CB 4.21Å; N142-E145 WeakPolarHBondContact O-CA 3.35Å; N142-E145 WeakPolarHBondContact O-CB 3.33Å; N142-E145 PolarHBondContact O-N 3.47Å; F143-E145 VanDerWaalsContact C-N 3.34Å; F143-E145 PolarHBondContact O-N 2.86Å; E145-R148 PolarHBondContact O-N 3.3Å; E145-R148 IonicContact OE1-NE 3.55Å; E145-R148 IonicContact OE1-NH2 3.98Å; E145-Q149 WeakPolarHBondContact O-CG 3.47Å; E145-Q149 PolarHBondContact O-N 2.9Å |
| 146 | L | 71.4 | Confident | 56.7 | Low | 92 Ų | 92 | 109.8 Ų | 109.8 | 48% | 0.482 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -61.5 | -44.4 | 172.1 | -93.8 | 152.1 | 0 | 0 | 0 | 111.8 | P141 N142 F143 R148 Q149 A150 | P141-L146 HydrophobicContact CB-CD1 4.4Å; P141-L146 HydrophobicContact CB-CG 4.35Å; P141-L146 HydrophobicContact CG-CD1 3.93Å; P141-L146 HydrophobicContact CG-CG 4.14Å; N142-L146 PolarHBondContact O-N 3.42Å; F143-L146 PolarHBondContact O-N 3.08Å; L146-R148 VanDerWaalsContact C-N 3.31Å; L146-R148 PolarHBondContact O-N 3.1Å; L146-Q149 PolarHBondContact O-N 3.19Å; L146-A150 WeakPolarHBondContact O-CB 3.43Å; L146-A150 PolarHBondContact O-N 3.5Å |
| 147 | C | 67.7 | Low | 56.7 | Low | 62 Ų | 62 | 108.3 Ų | 108.3 | 42% | 0.419 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -64.4 | -34.6 | 174 | -70.4 | 0 | 0 | 0 | 0 | 112.5 | F143 S151 | F143-C147 PolarHBondContact O-N 3.31Å; F143-C147 PolarHBondContact O-SG 3.16Å; F143-C147 VanDerWaalsContact O-SG 3.42Å; C147-S151 PolarHBondContact O-N 2.79Å; C147-S151 PolarHBondContact O-OG 3.41Å |
| 148 | R | 74.5 | Confident | 56.7 | Low | 136 Ų | 136 | 109.6 Ų | 109.6 | 51% | 0.513 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -70.3 | -38.1 | 176.7 | -141.9 | -175.7 | 77.9 | 137.5 | 8.8 | 112.2 | A144 E145 L146 S151 Q152 | A144-R148 WeakPolarHBondContact O-CB 3.48Å; A144-R148 PolarHBondContact O-N 3.45Å; E145-R148 PolarHBondContact O-N 3.3Å; E145-R148 IonicContact OE1-NE 3.55Å; E145-R148 IonicContact OE1-NH2 3.98Å; L146-R148 VanDerWaalsContact C-N 3.31Å; L146-R148 PolarHBondContact O-N 3.1Å; R148-S151 WeakPolarHBondContact CA-OG 3.37Å; R148-S151 PolarHBondContact O-N 3.47Å; R148-S151 PolarHBondContact O-OG 3.18Å; R148-Q152 WeakPolarHBondContact O-CG 3.3Å; R148-Q152 PolarHBondContact O-N 2.96Å |
| 149 | Q | 70.6 | Confident | 56.3 | Low | 113 Ų | 113 | 105.7 Ų | 105.7 | 53% | 0.528 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -68.3 | -42.2 | 176 | -74.6 | 177.1 | 4.7 | 0 | 0 | 111.5 | E145 L146 S151 Q152 S153 | E145-Q149 WeakPolarHBondContact O-CG 3.47Å; E145-Q149 PolarHBondContact O-N 2.9Å; L146-Q149 PolarHBondContact O-N 3.19Å; Q149-S151 PolarHBondContact O-N 3.12Å; Q149-Q152 PolarHBondContact O-N 3.39Å; Q149-S153 PolarHBondContact O-N 2.93Å |
| 150 | A | 59.9 | Low | 55.8 | Low | 72 Ų | 72 | 103.2 Ų | 103.2 | 60% | 0.595 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -64 | -25.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | L146 | L146-A150 WeakPolarHBondContact O-CB 3.43Å; L146-A150 PolarHBondContact O-N 3.5Å |
| 151 | S | 62.3 | Low | 55 | Low | 92 Ų | 92 | 102.4 Ų | 102.4 | 64% | 0.643 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -88.3 | -13.3 | 178.5 | 41 | 0 | 0 | 0 | 0 | 114.3 | C147 R148 Q149 | C147-S151 PolarHBondContact O-N 2.79Å; C147-S151 PolarHBondContact O-OG 3.41Å; R148-S151 WeakPolarHBondContact CA-OG 3.37Å; R148-S151 PolarHBondContact O-N 3.47Å; R148-S151 PolarHBondContact O-OG 3.18Å; Q149-S151 PolarHBondContact O-N 3.12Å |
| 152 | Q | 59.4 | Low | 53.8 | Low | 132 Ų | 132 | 105.1 Ų | 105.1 | 62% | 0.617 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -98.7 | -18.8 | -179.6 | -69.9 | 179.1 | 27.7 | 0 | 0 | 113.8 | R148 Q149 G154 | R148-Q152 WeakPolarHBondContact O-CG 3.3Å; R148-Q152 PolarHBondContact O-N 2.96Å; Q149-Q152 PolarHBondContact O-N 3.39Å; Q152-G154 PolarHBondContact O-N 3.35Å |
| 153 | S | 48.1 | Very low | 52.4 | Low | 65 Ų | 65 | 107.8 Ų | 107.8 | 46% | 0.455 | 64% | 0.638 | S | S | . | * | trans | -85.3 | 94.6 | 171.5 | 57 | 0 | 0 | 0 | 0 | 110.5 | Q149 I155 | Q149-S153 PolarHBondContact O-N 2.93Å; S153-I155 PolarHBondContact O-N 3.42Å | ||
| 154 | G | 37.3 | Very low | 50.7 | Low | 83 Ų | 83 | 109.8 Ų | 109.8 | 86% | 0.856 | 65% | 0.647 | S | S | * | * | trans | -68.1 | 66.6 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q152 | Q152-G154 PolarHBondContact O-N 3.35Š| ||
| 155 | I | 42.4 | Very low | 48.8 | Very low | 124 Ų | 124 | 118.1 Ų | 118.1 | 64% | 0.636 | 67% | 0.667 | S | S | * | * | trans | -120.8 | 113 | 177.2 | -45.5 | 178.3 | 0 | 0 | 0 | 108.3 | S153 T157 | S153-I155 PolarHBondContact O-N 3.42Å; I155-T157 VanDerWaalsContact C-N 3.29Å; I155-T157 HydrophobicContact CG2-CG2 4.28Å; I155-T157 PolarHBondContact O-N 2.93Å | ||
| 156 | N | 36.4 | Very low | 46.9 | Very low | 170 Ų | 170 | 119.5 Ų | 119.5 | 91% | 0.909 | 69% | 0.685 | S | S | * | * | trans | -57.4 | 84.7 | 172.8 | -64.3 | -40.5 | 0 | 0 | 0 | 110.8 | ||||
| 157 | T | 39.4 | Very low | 45.4 | Very low | 115 Ų | 115 | 119.7 Ų | 119.7 | 71% | 0.706 | 69% | 0.692 | S | S | * | * | trans | -145.1 | 138.6 | 168.9 | 56.7 | 0 | 0 | 0 | 0 | 110.1 | I155 | I155-T157 VanDerWaalsContact C-N 3.29Å; I155-T157 HydrophobicContact CG2-CG2 4.28Å; I155-T157 PolarHBondContact O-N 2.93Å | ||
| 158 | T | 40.5 | Very low | 43.7 | Very low | 129 Ų | 129 | 120.8 Ų | 120.8 | 79% | 0.791 | 71% | 0.706 | S | S | * | * | trans | -41.2 | 146.8 | -177.2 | 46 | 0 | 0 | 0 | 0 | 115.3 | A160 | T158-A160 PolarHBondContact O-N 3.18Š| ||
| 159 | P | 39.5 | Very low | 41.7 | Very low | 124 Ų | 124 | 119.8 Ų | 119.8 | 81% | 0.805 | 72% | 0.718 | S | S | * | * | trans | -66.4 | 119.4 | -173.9 | 28.7 | -33 | 0 | 0 | 0 | 110.8 | S161 | P159-S161 PolarHBondContact O-N 3.39Š| ||
| 160 | A | 35.4 | Very low | 39.9 | Very low | 91 Ų | 91 | 124.7 Ų | 124.7 | 75% | 0.752 | 74% | 0.738 | S | S | * | * | trans | -63.6 | 119.5 | 171.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | T158 I162 | T158-A160 PolarHBondContact O-N 3.18Å; A160-I162 PolarHBondContact O-N 3.42Å | ||
| 161 | S | 34 | Very low | 38.5 | Very low | 115 Ų | 115 | 129.1 Ų | 129.1 | 80% | 0.804 | 75% | 0.752 | S | S | * | * | trans | -72.5 | 113.5 | 175.6 | -64.1 | 0 | 0 | 0 | 0 | 109.6 | P159 L163 | P159-S161 PolarHBondContact O-N 3.39Å; S161-L163 PolarHBondContact O-N 3.03Å | ||
| 162 | I | 36.2 | Very low | 37.3 | Very low | 120 Ų | 120 | 129.5 Ų | 129.5 | 62% | 0.615 | 76% | 0.76 | S | S | * | * | trans | -86.2 | 104.9 | 170.7 | -57.7 | 174.7 | 0 | 0 | 0 | 107.3 | A160 F164 | A160-I162 PolarHBondContact O-N 3.42Å; I162-F164 HydrophobicContact CB-CE2 4.38Å; I162-F164 HydrophobicContact CG2-CD2 3.93Å; I162-F164 HydrophobicContact CG2-CE2 3.47Å; I162-F164 VanDerWaalsContact CG2-CE2 3.47Å; I162-F164 HydrophobicContact CG2-CZ 3.9Å | ||
| 163 | L | 36.7 | Very low | 36.1 | Very low | 170 Ų | 170 | 131.6 Ų | 131.6 | 89% | 0.89 | 77% | 0.77 | S | S | * | * | trans | -80.3 | 115.3 | 172.3 | -78.6 | 168.6 | 0 | 0 | 0 | 109.8 | S161 | S161-L163 PolarHBondContact O-N 3.03Š| ||
| 164 | F | 32.9 | Very low | 35.3 | Very low | 170 Ų | 170 | 133.4 Ų | 133.4 | 75% | 0.746 | 78% | 0.783 | S | S | * | * | trans | -95.7 | 119.9 | 166.3 | -75.2 | -81.6 | 0 | 0 | 0 | 109.4 | I162 | I162-F164 HydrophobicContact CB-CE2 4.38Å; I162-F164 HydrophobicContact CG2-CD2 3.93Å; I162-F164 HydrophobicContact CG2-CE2 3.47Å; I162-F164 VanDerWaalsContact CG2-CE2 3.47Å; I162-F164 HydrophobicContact CG2-CZ 3.9Å | ||
| 165 | Y | 31.9 | Very low | 35.1 | Very low | 231 Ų | 231 | 139.3 Ų | 139.3 | 91% | 0.906 | 79% | 0.785 | S | S | * | * | trans | -97.4 | 126 | 173.5 | -143.5 | -92 | 0 | 0 | 0 | 108.8 | ||||
| 166 | S | 28.6 | Very low | 34.6 | Very low | 104 Ų | 104 | 139 Ų | 139 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | -123 | 127 | 171.8 | 178 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 167 | P | 38.9 | Very low | 34.2 | Very low | 96 Ų | 96 | 136.3 Ų | 136.3 | 62% | 0.623 | 79% | 0.786 | S | S | * | * | trans | -96.6 | 120.2 | 172.7 | 33.2 | -23.6 | 0 | 0 | 0 | 110 | ||||
| 168 | A | 33.4 | Very low | 33.9 | Very low | 85 Ų | 85 | 137 Ų | 137 | 70% | 0.702 | 79% | 0.79 | S | S | * | * | trans | -128.3 | 142.1 | 165.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 169 | C | 31.5 | Very low | 33.5 | Very low | 115 Ų | 115 | 138.7 Ų | 138.7 | 78% | 0.777 | 79% | 0.789 | S | S | * | * | trans | 86.8 | 103.3 | 160.1 | -55.1 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 170 | F | 33.2 | Very low | 33 | Very low | 215 Ų | 215 | 138.2 Ų | 138.2 | 94% | 0.943 | 78% | 0.784 | S | S | * | * | trans | -140.6 | 105.8 | 133.3 | -91.2 | -74.8 | 0 | 0 | 0 | 109.7 | ||||
| 171 | D | 30.6 | Very low | 32.9 | Very low | 165 Ų | 165 | 140.5 Ų | 140.5 | 88% | 0.882 | 79% | 0.788 | S | S | * | * | trans | -74.4 | 124.9 | 160.8 | -127.8 | -20.1 | 0 | 0 | 0 | 107.2 | ||||
| 172 | A | 36.7 | Very low | 32.9 | Very low | 100 Ų | 100 | 141.2 Ų | 141.2 | 83% | 0.826 | 79% | 0.788 | S | S | * | * | trans | -104.7 | 103 | 179.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 173 | Q | 35 | Very low | 32.8 | Very low | 177 Ų | 177 | 141.7 Ų | 141.7 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | trans | -78.2 | 133 | 163.2 | -75 | -155.3 | -14 | 0 | 0 | 111.3 | ||||
| 174 | S | 30.3 | Very low | 32.5 | Very low | 103 Ų | 103 | 136.6 Ų | 136.6 | 72% | 0.72 | 79% | 0.787 | S | S | * | * | trans | -4 | 134.4 | 157.6 | 59.5 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 175 | F | 32.7 | Very low | 32.3 | Very low | 206 Ų | 206 | 136.7 Ų | 136.7 | 90% | 0.904 | 79% | 0.794 | S | S | * | * | trans | -126.9 | 142 | 147 | -78.9 | -78.1 | 0 | 0 | 0 | 110.3 | ||||
| 176 | P | 33.1 | Very low | 32.3 | Very low | 117 Ų | 117 | 132.3 Ų | 132.3 | 76% | 0.76 | 79% | 0.791 | S | S | * | * | trans | -95.7 | 144.6 | -176.7 | 35.6 | -31.3 | 0 | 0 | 0 | 114.7 | ||||
| 177 | S | 27.5 | Very low | 32.2 | Very low | 114 Ų | 114 | 131.3 Ų | 131.3 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | trans | 37.4 | 122 | 137.8 | -157.9 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 178 | V | 32.7 | Very low | 31.7 | Very low | 129 Ų | 129 | 137 Ų | 137 | 78% | 0.782 | 81% | 0.805 | S | S | * | * | trans | -155.5 | 111.4 | 137.7 | 175.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 179 | Q | 32.9 | Very low | 31.4 | Very low | 165 Ų | 165 | 141.2 Ų | 141.2 | 77% | 0.771 | 81% | 0.81 | S | S | * | * | trans | 53.9 | 114.3 | 135.3 | -62.9 | -177.9 | 14.2 | 0 | 0 | 122.2 | ||||
| 180 | T | 29.1 | Very low | 31.6 | Very low | 115 Ų | 115 | 141.1 Ų | 141.1 | 71% | 0.706 | 81% | 0.808 | S | S | * | * | 92.7 | 126.9 | 96.5 | -48.4 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 181 | V | 33.2 | Very low | 31.6 | Very low | 138 Ų | 138 | 138.4 Ų | 138.4 | 84% | 0.836 | 80% | 0.798 | S | S | * | * | -167.4 | 143.7 | 63.9 | -145.4 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 182 | T | 33 | Very low | 31.5 | Very low | 130 Ų | 130 | 138.2 Ų | 138.2 | 80% | 0.798 | 79% | 0.792 | S | S | * | * | trans | -75.8 | 167.5 | 169.7 | -2.9 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 183 | P | 35.9 | Very low | 31.2 | Very low | 130 Ų | 130 | 139.1 Ų | 139.1 | 84% | 0.844 | 79% | 0.787 | S | S | * | * | -143.7 | 172.8 | 65.1 | 33.9 | -11.8 | 0 | 0 | 0 | 113.4 | |||||
| 184 | G | 30.1 | Very low | 31 | Very low | 63 Ų | 63 | 137.8 Ų | 137.8 | 65% | 0.649 | 79% | 0.786 | S | S | * | * | cis | 136.3 | 112.2 | 13.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 185 | L | 27.5 | Very low | 31 | Very low | 172 Ų | 172 | 138.2 Ų | 138.2 | 90% | 0.901 | 79% | 0.789 | S | S | * | * | trans | 51.5 | 140.7 | 156.3 | -68.6 | 153.5 | 0 | 0 | 0 | 118.2 | ||||
| 186 | V | 32.7 | Very low | 31.1 | Very low | 139 Ų | 139 | 134 Ų | 134 | 84% | 0.842 | 78% | 0.78 | S | S | * | * | -167.3 | 154.3 | 60.3 | -152.4 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 187 | A | 25.4 | Very low | 31 | Very low | 84 Ų | 84 | 135.6 Ų | 135.6 | 69% | 0.694 | 78% | 0.782 | S | S | * | * | trans | -74.8 | 149.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 188 | F | 29.2 | Very low | 31.1 | Very low | 216 Ų | 216 | 135.6 Ų | 135.6 | 95% | 0.947 | 78% | 0.782 | S | S | * | * | trans | -155.5 | 127.6 | 152.2 | -104.4 | -82.1 | 0 | 0 | 0 | 110.7 | ||||
| 189 | Q | 26.8 | Very low | 31 | Very low | 173 Ų | 173 | 136.3 Ų | 136.3 | 81% | 0.808 | 79% | 0.787 | S | S | * | * | trans | -89 | 148.9 | 162.3 | -146.7 | -175.8 | -30 | 0 | 0 | 107 | ||||
| 190 | P | 35.1 | Very low | 30.9 | Very low | 112 Ų | 112 | 132.5 Ų | 132.5 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | -156.1 | 155.9 | 83.1 | 35.6 | -12.6 | 0 | 0 | 0 | 117.4 | |||||
| 191 | Q | 33.6 | Very low | 30.9 | Very low | 158 Ų | 158 | 136.4 Ų | 136.4 | 74% | 0.738 | 79% | 0.789 | S | S | * | * | trans | 44.6 | 125.1 | 132.9 | -125.8 | 170 | -7.4 | 0 | 0 | 123.5 | ||||
| 192 | Q | 28.1 | Very low | 30.8 | Very low | 161 Ų | 161 | 138.1 Ų | 138.1 | 75% | 0.752 | 79% | 0.788 | S | S | * | * | trans | 44.9 | 116.3 | 140.9 | -72 | 175.9 | -6.5 | 0 | 0 | 120 | ||||
| 193 | T | 32 | Very low | 30.6 | Very low | 119 Ų | 119 | 136.9 Ų | 136.9 | 73% | 0.73 | 79% | 0.785 | S | S | * | * | 173.1 | 135.7 | 95.3 | 42.4 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 194 | D | 30.6 | Very low | 30.4 | Very low | 149 Ų | 149 | 137.7 Ų | 137.7 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | trans | 60.7 | 112.7 | 145 | -55.3 | -27 | 0 | 0 | 0 | 122.9 | ||||
| 195 | S | 29.5 | Very low | 30.5 | Very low | 112 Ų | 112 | 140.7 Ų | 140.7 | 78% | 0.783 | 79% | 0.786 | S | S | * | * | trans | 73.1 | 118.5 | 132.1 | -151.6 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 196 | V | 35.9 | Very low | 30.7 | Very low | 117 Ų | 117 | 139.7 Ų | 139.7 | 71% | 0.709 | 78% | 0.781 | S | S | * | * | trans | 132.5 | 120.2 | 131.9 | -172.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 197 | N | 31.2 | Very low | 30.9 | Very low | 151 Ų | 151 | 137.8 Ų | 137.8 | 81% | 0.807 | 77% | 0.769 | S | S | * | * | trans | 82.6 | 97.1 | 162.9 | -72.2 | -4.5 | 0 | 0 | 0 | 120.3 | ||||
| 198 | S | 27.9 | Very low | 31.2 | Very low | 115 Ų | 115 | 141.6 Ų | 141.6 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | trans | -55.8 | 130 | 163 | -36.5 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 199 | T | 31 | Very low | 31.5 | Very low | 144 Ų | 144 | 137 Ų | 137 | 88% | 0.883 | 76% | 0.763 | S | S | * | * | trans | -148 | 84.1 | 148.3 | -42.1 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 200 | S | 31.6 | Very low | 32.1 | Very low | 85 Ų | 85 | 137.9 Ų | 137.9 | 59% | 0.594 | 77% | 0.767 | S | S | * | * | trans | -100 | 112.8 | 175.2 | 57.5 | 0 | 0 | 0 | 0 | 109.6 | Q202 | S200-Q202 PolarHBondContact O-N 2.89Š| ||
| 201 | E | 29 | Very low | 32.3 | Very low | 196 Ų | 196 | 139.7 Ų | 139.7 | 92% | 0.916 | 77% | 0.771 | S | S | * | * | trans | -55.2 | 121.8 | 160.4 | -63.9 | -179.1 | 135 | 0 | 0 | 109 | ||||
| 202 | Q | 30.9 | Very low | 32.3 | Very low | 174 Ų | 174 | 135.3 Ų | 135.3 | 81% | 0.813 | 76% | 0.757 | S | S | * | * | trans | -112.8 | 109 | 173.1 | -73.1 | -173.7 | 6.4 | 0 | 0 | 109.6 | S200 | S200-Q202 PolarHBondContact O-N 2.89Š| ||
| 203 | S | 28.4 | Very low | 32.6 | Very low | 105 Ų | 105 | 132.2 Ų | 132.2 | 73% | 0.734 | 75% | 0.745 | S | S | * | * | trans | -68.3 | 132.6 | 177.2 | -175.2 | 0 | 0 | 0 | 0 | 111.3 | T205 | S203-T205 PolarHBondContact O-N 3.12Š| ||
| 204 | I | 30.9 | Very low | 32.8 | Very low | 147 Ų | 147 | 130.5 Ų | 130.5 | 75% | 0.754 | 74% | 0.738 | S | S | * | * | trans | -65 | 116.1 | 168.3 | -58.6 | 169.4 | 0 | 0 | 0 | 107.6 | L206 | I204-L206 HydrophobicContact CG2-CD1 3.83Å; I204-L206 HydrophobicContact CG2-CG 4.47Å | ||
| 205 | T | 32.7 | Very low | 33.3 | Very low | 125 Ų | 125 | 127.6 Ų | 127.6 | 77% | 0.767 | 72% | 0.722 | S | S | * | * | trans | -98 | 109.5 | 171.8 | 29.5 | 0 | 0 | 0 | 0 | 108.8 | S203 | S203-T205 PolarHBondContact O-N 3.12Š| ||
| 206 | L | 33.1 | Very low | 33.8 | Very low | 151 Ų | 151 | 126.6 Ų | 126.6 | 79% | 0.791 | 72% | 0.715 | S | S | * | * | trans | -89.1 | 115.1 | 169.8 | -77.7 | 106 | 0 | 0 | 0 | 109.4 | I204 | I204-L206 HydrophobicContact CG2-CD1 3.83Å; I204-L206 HydrophobicContact CG2-CG 4.47Å | ||
| 207 | T | 36.5 | Very low | 34.1 | Very low | 99 Ų | 99 | 126.3 Ų | 126.3 | 61% | 0.607 | 71% | 0.709 | S | S | * | * | trans | -95.6 | 125 | 168.9 | 52.6 | 0 | 0 | 0 | 0 | 110.1 | L209 | T207-L209 PolarHBondContact O-N 3.43Š| ||
| 208 | N | 31.5 | Very low | 34.3 | Very low | 165 Ų | 165 | 125.1 Ų | 125.1 | 88% | 0.882 | 71% | 0.709 | S | S | * | * | trans | -85.3 | 99.6 | -177.1 | -142.8 | -48.1 | 0 | 0 | 0 | 109.9 | ||||
| 209 | L | 35.3 | Very low | 34.7 | Very low | 120 Ų | 120 | 126.5 Ų | 126.5 | 63% | 0.628 | 71% | 0.708 | S | S | * | * | trans | -114.3 | 125.1 | 162.8 | -85.9 | 141.6 | 0 | 0 | 0 | 106.7 | T207 N211 S212 | T207-L209 PolarHBondContact O-N 3.43Å; L209-N211 PolarHBondContact O-N 3.3Å; L209-S212 PolarHBondContact O-N 3.36Å | ||
| 210 | Q | 38.5 | Very low | 34.9 | Very low | 191 Ų | 191 | 125.3 Ų | 125.3 | 89% | 0.893 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -46.6 | 116.1 | -177.9 | -80.3 | 169.5 | -55.3 | 0 | 0 | 110.7 | ||
| 211 | N | 40.4 | Very low | 34.9 | Very low | 150 Ų | 150 | 127.5 Ų | 127.5 | 80% | 0.802 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 79.4 | 21.3 | 173 | -54.6 | -2.8 | 0 | 0 | 0 | 118.6 | L209 | L209-N211 PolarHBondContact O-N 3.3Š|
| 212 | S | 33.7 | Very low | 35.3 | Very low | 65 Ų | 65 | 125.9 Ų | 125.9 | 46% | 0.455 | 70% | 0.702 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -126.2 | 135.2 | 167.7 | 62.2 | 0 | 0 | 0 | 0 | 113.3 | L209 | L209-S212 PolarHBondContact O-N 3.36Å |
| 213 | L | 34.2 | Very low | 35.4 | Very low | 96 Ų | 96 | 123.9 Ų | 123.9 | 50% | 0.503 | 70% | 0.704 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -106.5 | 124.6 | 166 | -169.9 | 87.1 | 0 | 0 | 0 | 106.8 | I215 L240 | L213-I215 HydrophobicContact CD2-CD1 3.9Å; L213-I215 HydrophobicContact CD2-CG1 4.08Å; L213-I215 HydrophobicContact CG-CG1 4.41Å; L213-L240 HydrophobicContact CB-CD1 4.47Å; L213-L240 HydrophobicContact CD2-CD1 4.28Å; L213-L240 WeakPolarHBondContact O-CD1 3.49Å |
| 214 | S | 36.9 | Very low | 35.7 | Very low | 83 Ų | 83 | 124.4 Ų | 124.4 | 58% | 0.58 | 70% | 0.703 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -113.6 | 127.9 | 172.9 | 36.1 | 0 | 0 | 0 | 0 | 109.1 | ||
| 215 | I | 39.7 | Very low | 36 | Very low | 88 Ų | 88 | 123.4 Ų | 123.4 | 45% | 0.451 | 70% | 0.704 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -119.1 | 116 | 176.5 | -57.1 | 174.3 | 0 | 0 | 0 | 106.7 | L213 L217 | L213-I215 HydrophobicContact CD2-CD1 3.9Å; L213-I215 HydrophobicContact CD2-CG1 4.08Å; L213-I215 HydrophobicContact CG-CG1 4.41Å; I215-L217 HydrophobicContact CG2-CD1 4.21Å |
| 216 | S | 40.6 | Very low | 36.4 | Very low | 91 Ų | 91 | 126.3 Ų | 126.3 | 64% | 0.636 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -94.3 | 122.5 | 168.9 | -168.7 | 0 | 0 | 0 | 0 | 108.1 | ||
| 217 | L | 42.7 | Very low | 37.1 | Very low | 111 Ų | 111 | 122.9 Ų | 122.9 | 58% | 0.581 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 129.9 | 176.5 | -82.8 | 83.4 | 0 | 0 | 0 | 109.7 | I215 N219 | I215-L217 HydrophobicContact CG2-CD1 4.21Å; L217-N219 PolarHBondContact O-N 2.85Å |
| 218 | P | 34.2 | Very low | 37.6 | Very low | 126 Ų | 126 | 124.8 Ų | 124.8 | 82% | 0.818 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 117 | 172 | 29.6 | -29.8 | 0 | 0 | 0 | 109.4 | ||
| 219 | N | 37.1 | Very low | 38.5 | Very low | 145 Ų | 145 | 121.2 Ų | 121.2 | 78% | 0.775 | 68% | 0.684 | S | S | * | * | trans | -142.4 | 114.5 | 157.3 | -140.2 | 5.1 | 0 | 0 | 0 | 112.7 | L217 | L217-N219 PolarHBondContact O-N 2.85Š| ||
| 220 | T | 34.7 | Very low | 39.4 | Very low | 118 Ų | 118 | 116 Ų | 116 | 72% | 0.724 | 66% | 0.657 | S | S | * | * | trans | 22.4 | 104.1 | 146.1 | -34.2 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 221 | V | 32.4 | Very low | 40.1 | Very low | 132 Ų | 132 | 109.5 Ų | 109.5 | 80% | 0.8 | 63% | 0.63 | S | S | * | * | trans | 60.5 | 90.1 | 143.9 | -170.4 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 222 | Q | 36.5 | Very low | 40.5 | Very low | 162 Ų | 162 | 102.9 Ų | 102.9 | 76% | 0.757 | 60% | 0.595 | S | S | * | * | 179.9 | 137.7 | 127.8 | -102.7 | -172.8 | 3.1 | 0 | 0 | 110.2 | V224 | Q222-V224 PolarHBondContact O-N 3.49Š| |||
| 223 | P | 33.5 | Very low | 41.3 | Very low | 131 Ų | 131 | 105.2 Ų | 105.2 | 85% | 0.851 | 60% | 0.599 | S | S | * | * | trans | -83.7 | 101 | 173.5 | 32.5 | -26.6 | 0 | 0 | 0 | 108.5 | ||||
| 224 | V | 35 | Very low | 42.3 | Very low | 116 Ų | 116 | 103.2 Ų | 103.2 | 70% | 0.703 | 59% | 0.588 | S | S | * | * | trans | -119.7 | 124.2 | 166.9 | -176.7 | 0 | 0 | 0 | 0 | 108.3 | Q222 E226 | Q222-V224 PolarHBondContact O-N 3.49Å; V224-E226 PolarHBondContact O-N 2.95Å | ||
| 225 | T | 37.3 | Very low | 42.8 | Very low | 127 Ų | 127 | 105.3 Ų | 105.3 | 78% | 0.779 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -68.9 | 113.6 | 177.1 | 47.2 | 0 | 0 | 0 | 0 | 109.5 | ||
| 226 | E | 40.9 | Very low | 43.6 | Very low | 186 Ų | 186 | 107.6 Ų | 107.6 | 87% | 0.869 | 61% | 0.613 | S | S | * | * | trans | 139.9 | 96.3 | 161.3 | -79.9 | 174.3 | -170.2 | 0 | 0 | 109 | V224 | V224-E226 PolarHBondContact O-N 2.95Š| ||
| 227 | S | 47.2 | Very low | 44.2 | Very low | 79 Ų | 79 | 105.9 Ų | 105.9 | 55% | 0.552 | 61% | 0.609 | S | S | * | * | trans | -92.7 | 103.6 | 177.4 | -152.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 228 | E | 47 | Very low | 44.6 | Very low | 138 Ų | 138 | 105.2 Ų | 105.2 | 65% | 0.645 | 61% | 0.606 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -82.6 | 117.7 | 176.2 | -162 | 175.7 | 177.8 | 0 | 0 | 109.3 | T230 T244 | E228-T230 PolarHBondContact O-N 3.36Å; E228-T244 PolarHBondContact O-N 3.49Å |
| 229 | V | 51.2 | Low | 45.4 | Very low | 91 Ų | 91 | 105.3 Ų | 105.3 | 55% | 0.552 | 59% | 0.59 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -84.6 | 105.4 | 176.4 | 179.2 | 0 | 0 | 0 | 0 | 108.2 | T243 | V229-T243 HydrophobicContact CG2-CG2 4.3Å |
| 230 | T | 54 | Low | 45.9 | Very low | 11 Ų | 11 | 99.7 Ų | 99.7 | 7% | 0.067 | 56% | 0.56 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -87.1 | 112.5 | 171.2 | -65.5 | 0 | 0 | 0 | 0 | 109 | E228 V232 I242 T244 Q249 | E228-T230 PolarHBondContact O-N 3.36Å; T230-V232 HydrophobicContact CG2-CG2 4.44Å; T230-I242 PolarHBondContact N-O 2.93Å; T230-I242 PolarHBondContact O-N 3.49Å; T230-T244 PolarHBondContact OG1-OG1 3.36Å; T230-Q249 HydrophobicContact CG2-CB 4.41Å; T230-Q249 HydrophobicContact CG2-CG 3.64Å |
| 231 | T | 52.4 | Low | 46.8 | Very low | 53 Ų | 53 | 94.9 Ų | 94.9 | 33% | 0.325 | 53% | 0.533 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.3 | 120.4 | 171.3 | 5.3 | 0 | 0 | 0 | 0 | 110.7 | R239 L240 | T231-R239 HydrophobicContact CG2-CB 4.5Å; T231-L240 WeakPolarHBondContact CA-O 3.31Å |
| 232 | V | 50 | Low | 47.9 | Very low | 11 Ų | 11 | 89.2 Ų | 89.2 | 7% | 0.067 | 50% | 0.499 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.2 | 120.5 | 171.1 | -179.3 | 0 | 0 | 0 | 0 | 108.5 | T230 L240 L253 | T230-V232 HydrophobicContact CG2-CG2 4.44Å; V232-L240 PolarHBondContact N-O 2.96Å; V232-L240 PolarHBondContact O-N 3.33Å; V232-L253 HydrophobicContact CG1-CD2 3.66Å |
| 233 | Q | 49.8 | Very low | 48.8 | Very low | 115 Ų | 115 | 84 Ų | 84 | 54% | 0.537 | 48% | 0.477 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90 | 112.6 | 176.3 | -170.3 | 98.4 | 18.6 | 0 | 0 | 108.7 | ||
| 234 | L | 55.9 | Low | 50 | Low | 53 Ų | 53 | 78.3 Ų | 78.3 | 28% | 0.277 | 44% | 0.441 | S | S | . | . | trans | -81 | 154.9 | 174.8 | -69.3 | 155.2 | 0 | 0 | 0 | 110.4 | N236 G237 L238 I258 | L234-N236 PolarHBondContact O-N 3.36Å; L234-G237 PolarHBondContact O-N 3.31Å; L234-G237 VanDerWaalsContact O-N 3.1Å; L234-L238 HydrophobicContact CB-CB 4.13Å; L234-L238 WeakPolarHBondContact CB-O 3.33Å; L234-L238 HydrophobicContact CD1-CB 3.91Å; L234-L238 PolarHBondContact N-O 2.67Å; L234-I258 HydrophobicContact CD2-CD1 3.92Å | ||
| 235 | P | 45.7 | Very low | 50.9 | Low | 127 Ų | 127 | 79.6 Ų | 79.6 | 83% | 0.825 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.6 | -18.7 | -176.7 | -25 | 32.9 | 0 | 0 | 0 | 115.1 | ||
| 236 | N | 58 | Low | 51.8 | Low | 137 Ų | 137 | 77 Ų | 77 | 73% | 0.733 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.1 | 13.1 | -173.7 | -50.4 | -2.9 | 0 | 0 | 0 | 112.6 | L234 L238 | L234-N236 PolarHBondContact O-N 3.36Å; N236-L238 PolarHBondContact O-N 3.33Å |
| 237 | G | 53.3 | Low | 52.6 | Low | 54 Ų | 54 | 69.8 Ų | 69.8 | 56% | 0.557 | 41% | 0.414 | S | S | * | . | S | Bend | trans | 75 | 4.9 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | L234 R239 | L234-G237 PolarHBondContact O-N 3.31Å; L234-G237 VanDerWaalsContact O-N 3.1Å; G237-R239 PolarHBondContact O-N 2.88Å |
| 238 | L | 49.8 | Very low | 53.4 | Low | 97 Ų | 97 | 69.7 Ų | 69.7 | 51% | 0.508 | 41% | 0.414 | S | S | . | . | trans | -72.7 | 121.2 | 170.2 | -89.4 | 160.3 | 0 | 0 | 0 | 109.5 | L234 N236 | L234-L238 HydrophobicContact CB-CB 4.13Å; L234-L238 WeakPolarHBondContact CB-O 3.33Å; L234-L238 HydrophobicContact CD1-CB 3.91Å; L234-L238 PolarHBondContact N-O 2.67Å; N236-L238 PolarHBondContact O-N 3.33Å | ||
| 239 | R | 52.1 | Low | 54.1 | Low | 129 Ų | 129 | 68.5 Ų | 68.5 | 49% | 0.487 | 41% | 0.408 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.2 | 116.9 | 170.8 | -76.7 | -174.9 | 129.5 | -124.6 | -3.5 | 109.3 | T231 G237 | T231-R239 HydrophobicContact CG2-CB 4.5Å; G237-R239 PolarHBondContact O-N 2.88Å |
| 240 | L | 46.3 | Very low | 54.6 | Low | 27 Ų | 27 | 66.8 Ų | 66.8 | 14% | 0.141 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 111.1 | 171.7 | -172.7 | 68.9 | 0 | 0 | 0 | 108 | L213 T231 V232 I242 L256 | L213-L240 HydrophobicContact CB-CD1 4.47Å; L213-L240 HydrophobicContact CD2-CD1 4.28Å; L213-L240 WeakPolarHBondContact O-CD1 3.49Å; T231-L240 WeakPolarHBondContact CA-O 3.31Å; V232-L240 PolarHBondContact N-O 2.96Å; V232-L240 PolarHBondContact O-N 3.33Å; L240-I242 HydrophobicContact CD2-CD1 3.75Å; L240-I242 HydrophobicContact CD2-CG1 4.13Å; L240-I242 HydrophobicContact CG-CD1 4.13Å; L240-I242 HydrophobicContact CG-CG1 3.97Å; L240-L256 HydrophobicContact CD2-CD1 4.14Å |
| 241 | G | 53.7 | Low | 55.2 | Low | 16 Ų | 16 | 68.7 Ų | 68.7 | 17% | 0.165 | 42% | 0.417 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.7 | 117.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 242 | I | 57.1 | Low | 55.7 | Low | 14 Ų | 14 | 66.5 Ų | 66.5 | 7% | 0.072 | 40% | 0.403 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 119.9 | 176.3 | -55.5 | 171.7 | 0 | 0 | 0 | 107.3 | T230 L240 T244 V252 L256 | T230-I242 PolarHBondContact N-O 2.93Å; T230-I242 PolarHBondContact O-N 3.49Å; L240-I242 HydrophobicContact CD2-CD1 3.75Å; L240-I242 HydrophobicContact CD2-CG1 4.13Å; L240-I242 HydrophobicContact CG-CD1 4.13Å; L240-I242 HydrophobicContact CG-CG1 3.97Å; I242-T244 HydrophobicContact CB-CG2 4.38Å; I242-T244 HydrophobicContact CG2-CG2 3.71Å; I242-T244 PolarHBondContact O-N 3.34Å; I242-V252 HydrophobicContact CB-CG1 4.44Å; I242-V252 HydrophobicContact CD1-CG1 3.28Å; I242-V252 HydrophobicContact CG1-CG1 4.42Å; I242-V252 HydrophobicContact CG2-CG1 4.37Å; I242-L256 HydrophobicContact CD1-CD1 3.75Å |
| 243 | T | 54.5 | Low | 56.4 | Low | 51 Ų | 51 | 67.6 Ų | 67.6 | 31% | 0.313 | 41% | 0.409 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.7 | 110.3 | 168.6 | 52.8 | 0 | 0 | 0 | 0 | 107.4 | V229 | V229-T243 HydrophobicContact CG2-CG2 4.3Å |
| 244 | T | 58.3 | Low | 57.4 | Low | 13 Ų | 13 | 69.2 Ų | 69.2 | 8% | 0.08 | 42% | 0.417 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.6 | 126.8 | 176.4 | 59.8 | 0 | 0 | 0 | 0 | 109.3 | E228 T230 I242 G246 A247 V252 | E228-T244 PolarHBondContact O-N 3.49Å; T230-T244 PolarHBondContact OG1-OG1 3.36Å; I242-T244 HydrophobicContact CB-CG2 4.38Å; I242-T244 HydrophobicContact CG2-CG2 3.71Å; I242-T244 PolarHBondContact O-N 3.34Å; T244-G246 PolarHBondContact O-N 2.88Å; T244-A247 HydrophobicContact CG2-CB 4.31Å; T244-A247 PolarHBondContact OG1-O 2.98Å; T244-V252 HydrophobicContact CG2-CG2 3.49Å; T244-V252 VanDerWaalsContact CG2-CG2 3.49Å |
| 245 | N | 53.8 | Low | 57.6 | Low | 142 Ų | 142 | 73 Ų | 73 | 76% | 0.759 | 44% | 0.435 | S | S | * | . | S | Bend | trans | -79.8 | 68.7 | 172.8 | -64.8 | -14.5 | 0 | 0 | 0 | 108.6 | ||
| 246 | G | 56.5 | Low | 58.4 | Low | 72 Ų | 72 | 71.1 Ų | 71.1 | 74% | 0.742 | 42% | 0.417 | S | S | * | . | S | Bend | trans | 85.7 | 12.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 116.9 | T244 | T244-G246 PolarHBondContact O-N 2.88Š|
| 247 | A | 57.2 | Low | 58 | Low | 36 Ų | 36 | 67.9 Ų | 67.9 | 30% | 0.298 | 42% | 0.416 | S | S | . | . | trans | -85.2 | 129.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | T244 V252 | T244-A247 HydrophobicContact CG2-CB 4.31Å; T244-A247 PolarHBondContact OG1-O 2.98Å; A247-V252 HydrophobicContact CB-CG2 4.39Å | ||
| 248 | S | 65.8 | Low | 58.2 | Low | 77 Ų | 77 | 68.7 Ų | 68.7 | 54% | 0.538 | 41% | 0.407 | S | S | . | . | trans | -63.5 | 150.4 | 177.7 | 68.4 | 0 | 0 | 0 | 0 | 112 | A250 S251 V252 | S248-A250 PolarHBondContact O-N 3.35Å; S248-A250 VanDerWaalsContact O-N 3.1Å; S248-S251 WeakPolarHBondContact O-CB 3.42Å; S248-S251 PolarHBondContact O-N 3.33Å; S248-V252 PolarHBondContact O-N 3.35Å | ||
| 249 | Q | 60.6 | Low | 58.2 | Low | 113 Ų | 113 | 70.3 Ų | 70.3 | 53% | 0.528 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -51.7 | -37.9 | 179.6 | -54.9 | -159.4 | -9.4 | 0 | 0 | 112.7 | T230 S251 V252 L253 | T230-Q249 HydrophobicContact CG2-CB 4.41Å; T230-Q249 HydrophobicContact CG2-CG 3.64Å; Q249-S251 VanDerWaalsContact C-N 3.35Å; Q249-S251 PolarHBondContact O-N 3.44Å; Q249-V252 PolarHBondContact O-N 3.19Å; Q249-L253 WeakPolarHBondContact O-CB 3.47Å; Q249-L253 WeakPolarHBondContact O-CG 3.36Å; Q249-L253 PolarHBondContact O-N 3.42Å |
| 250 | A | 62.9 | Low | 57.9 | Low | 55 Ų | 55 | 67.8 Ų | 67.8 | 46% | 0.455 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -62.4 | -40 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | S248 V252 L253 Q254 | S248-A250 PolarHBondContact O-N 3.35Å; S248-A250 VanDerWaalsContact O-N 3.1Å; A250-V252 VanDerWaalsContact C-N 3.34Å; A250-L253 PolarHBondContact O-N 2.99Å; A250-Q254 VanDerWaalsContact O-CB 3.3Å; A250-Q254 WeakPolarHBondContact O-CB 3.21Å; A250-Q254 PolarHBondContact O-N 2.96Å |
| 251 | S | 65.6 | Low | 57.6 | Low | 50 Ų | 50 | 73.5 Ų | 73.5 | 35% | 0.35 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -67.7 | -37.4 | 177.6 | -165.1 | 0 | 0 | 0 | 0 | 111.5 | S248 Q249 Q254 M255 | S248-S251 WeakPolarHBondContact O-CB 3.42Å; S248-S251 PolarHBondContact O-N 3.33Å; Q249-S251 VanDerWaalsContact C-N 3.35Å; Q249-S251 PolarHBondContact O-N 3.44Å; S251-Q254 PolarHBondContact O-N 3.04Å; S251-M255 WeakPolarHBondContact O-CB 3.41Å; S251-M255 PolarHBondContact O-N 2.73Å |
| 252 | V | 63 | Low | 57.2 | Low | 7 Ų | 7 | 77.8 Ų | 77.8 | 4% | 0.042 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -66.7 | -45.6 | 175.9 | -176.5 | 0 | 0 | 0 | 0 | 111.5 | I242 T244 A247 S248 Q249 A250 Q254 M255 L256 | I242-V252 HydrophobicContact CB-CG1 4.44Å; I242-V252 HydrophobicContact CD1-CG1 3.28Å; I242-V252 HydrophobicContact CG1-CG1 4.42Å; I242-V252 HydrophobicContact CG2-CG1 4.37Å; T244-V252 HydrophobicContact CG2-CG2 3.49Å; T244-V252 VanDerWaalsContact CG2-CG2 3.49Å; A247-V252 HydrophobicContact CB-CG2 4.39Å; S248-V252 PolarHBondContact O-N 3.35Å; Q249-V252 PolarHBondContact O-N 3.19Å; A250-V252 VanDerWaalsContact C-N 3.34Å; V252-Q254 VanDerWaalsContact C-N 3.34Å; V252-M255 PolarHBondContact O-N 3.01Å; V252-L256 HydrophobicContact CG1-CD1 4.07Å; V252-L256 WeakPolarHBondContact O-CG 3.42Å; V252-L256 PolarHBondContact O-N 2.88Å |
| 253 | L | 64.8 | Low | 56.2 | Low | 34 Ų | 34 | 85.7 Ų | 85.7 | 18% | 0.178 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -62.8 | -41.3 | 176.9 | -73.9 | 169.4 | 0 | 0 | 0 | 111.6 | V232 Q249 A250 L256 G257 I258 | V232-L253 HydrophobicContact CG1-CD2 3.66Å; Q249-L253 WeakPolarHBondContact O-CB 3.47Å; Q249-L253 WeakPolarHBondContact O-CG 3.36Å; Q249-L253 PolarHBondContact O-N 3.42Å; A250-L253 PolarHBondContact O-N 2.99Å; L253-L256 CarbonylContact O-C 3.46Å; L253-L256 PolarHBondContact O-N 2.9Å; L253-G257 PolarHBondContact O-N 2.94Å; L253-I258 CarbonylContact C-O 3.4Å; L253-I258 HydrophobicContact CB-CB 4.46Å; L253-I258 HydrophobicContact CD2-CB 4.04Å; L253-I258 HydrophobicContact CD2-CD1 4.03Å; L253-I258 HydrophobicContact CD2-CG2 4.05Å; L253-I258 PolarHBondContact O-N 3.42Å |
| 254 | Q | 69.8 | Low | 55.3 | Low | 150 Ų | 150 | 91.3 Ų | 91.3 | 70% | 0.701 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.4 | -40.3 | 176 | -169.7 | 169.6 | 37.2 | 0 | 0 | 112 | A250 S251 V252 L256 G257 | A250-Q254 VanDerWaalsContact O-CB 3.3Å; A250-Q254 WeakPolarHBondContact O-CB 3.21Å; A250-Q254 PolarHBondContact O-N 2.96Å; S251-Q254 PolarHBondContact O-N 3.04Å; V252-Q254 VanDerWaalsContact C-N 3.34Å; Q254-L256 VanDerWaalsContact C-N 3.26Å; Q254-L256 PolarHBondContact O-N 3.27Å; Q254-G257 PolarHBondContact O-N 3.27Å; Q254-G257 VanDerWaalsContact O-N 3.12Å |
| 255 | M | 60.3 | Low | 53.9 | Low | 133 Ų | 133 | 95.2 Ų | 95.2 | 66% | 0.655 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -67.2 | -28.3 | 176.3 | -150.3 | -175.4 | -39.8 | 0 | 0 | 112.4 | S251 V252 G257 | S251-M255 WeakPolarHBondContact O-CB 3.41Å; S251-M255 PolarHBondContact O-N 2.73Å; V252-M255 PolarHBondContact O-N 3.01Å; M255-G257 VanDerWaalsContact C-N 3.32Å |
| 256 | L | 62.3 | Low | 53 | Low | 86 Ų | 86 | 96.1 Ų | 96.1 | 45% | 0.45 | 55% | 0.549 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.1 | 1.7 | 173.9 | -70.2 | 168.1 | 0 | 0 | 0 | 113.8 | L240 I242 V252 L253 Q254 I258 | L240-L256 HydrophobicContact CD2-CD1 4.14Å; I242-L256 HydrophobicContact CD1-CD1 3.75Å; V252-L256 HydrophobicContact CG1-CD1 4.07Å; V252-L256 WeakPolarHBondContact O-CG 3.42Å; V252-L256 PolarHBondContact O-N 2.88Å; L253-L256 CarbonylContact O-C 3.46Å; L253-L256 PolarHBondContact O-N 2.9Å; Q254-L256 VanDerWaalsContact C-N 3.26Å; Q254-L256 PolarHBondContact O-N 3.27Å; L256-I258 VanDerWaalsContact C-N 3.26Å; L256-I258 HydrophobicContact CB-CD1 4.26Å; L256-I258 HydrophobicContact CB-CG1 4.25Å; L256-I258 PolarHBondContact O-N 3.4Å |
| 257 | G | 50.6 | Low | 51.8 | Low | 70 Ų | 70 | 100.7 Ų | 100.7 | 72% | 0.722 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 69.2 | 20.8 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | L253 Q254 M255 | L253-G257 PolarHBondContact O-N 2.94Å; Q254-G257 PolarHBondContact O-N 3.27Å; Q254-G257 VanDerWaalsContact O-N 3.12Å; M255-G257 VanDerWaalsContact C-N 3.32Å |
| 258 | I | 57.3 | Low | 50.5 | Low | 70 Ų | 70 | 103.8 Ų | 103.8 | 36% | 0.359 | 58% | 0.576 | S | S | . | * | trans | -97.4 | 108.4 | 175.8 | -55.3 | 175 | 0 | 0 | 0 | 107.6 | L234 L253 L256 P260 | L234-I258 HydrophobicContact CD2-CD1 3.92Å; L253-I258 CarbonylContact C-O 3.4Å; L253-I258 HydrophobicContact CB-CB 4.46Å; L253-I258 HydrophobicContact CD2-CB 4.04Å; L253-I258 HydrophobicContact CD2-CD1 4.03Å; L253-I258 HydrophobicContact CD2-CG2 4.05Å; L253-I258 PolarHBondContact O-N 3.42Å; L256-I258 VanDerWaalsContact C-N 3.26Å; L256-I258 HydrophobicContact CB-CD1 4.26Å; L256-I258 HydrophobicContact CB-CG1 4.25Å; L256-I258 PolarHBondContact O-N 3.4Å; I258-P260 WeakPolarHBondContact O-CD 3.47Å | ||
| 259 | E | 49.2 | Very low | 48.7 | Very low | 131 Ų | 131 | 107.8 Ų | 107.8 | 61% | 0.612 | 59% | 0.586 | S | S | * | * | trans | -73.6 | 123.3 | -178.4 | -161 | -96.3 | 145.9 | 0 | 0 | 110.8 | Q261 | E259-Q261 PolarHBondContact O-N 3.18Å; E259-Q261 PolarHBondContact OE2-NE2 2.96Å | ||
| 260 | P | 45.8 | Very low | 47.3 | Very low | 76 Ų | 76 | 109.4 Ų | 109.4 | 49% | 0.494 | 60% | 0.597 | S | S | . | * | trans | -82.2 | 105.1 | 179.6 | 30.3 | -30.2 | 0 | 0 | 0 | 111.1 | I258 | I258-P260 WeakPolarHBondContact O-CD 3.47Š| ||
| 261 | Q | 40.1 | Very low | 46 | Very low | 148 Ų | 148 | 114.7 Ų | 114.7 | 69% | 0.692 | 61% | 0.612 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 139.3 | 173.2 | -78 | -76.6 | -37.5 | 0 | 0 | 111.9 | E259 | E259-Q261 PolarHBondContact O-N 3.18Å; E259-Q261 PolarHBondContact OE2-NE2 2.96Å |
| 262 | P | 45 | Very low | 44.3 | Very low | 105 Ų | 105 | 119.5 Ų | 119.5 | 68% | 0.682 | 63% | 0.634 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 131.2 | -177.7 | 29.4 | -32.7 | 0 | 0 | 0 | 112.9 | I264 | P262-I264 PolarHBondContact O-N 3.46Š|
| 263 | E | 36.4 | Very low | 43.2 | Very low | 181 Ų | 181 | 124.6 Ų | 124.6 | 85% | 0.846 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 126.4 | 176.4 | -71.4 | -160.4 | 153.8 | 0 | 0 | 112.7 | ||
| 264 | I | 35.6 | Very low | 42 | Very low | 168 Ų | 168 | 128.7 Ų | 128.7 | 86% | 0.862 | 70% | 0.698 | S | S | * | * | trans | -91.7 | 101.2 | 162.7 | -59.7 | 173.1 | 0 | 0 | 0 | 107.6 | P262 | P262-I264 PolarHBondContact O-N 3.46Š| ||
| 265 | V | 30.5 | Very low | 40.4 | Very low | 96 Ų | 96 | 129.8 Ų | 129.8 | 58% | 0.582 | 71% | 0.708 | S | S | * | * | trans | -75.3 | 132.9 | 164.3 | 176.4 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 266 | H | 34.4 | Very low | 39.1 | Very low | 161 Ų | 161 | 130.3 Ų | 130.3 | 75% | 0.745 | 71% | 0.714 | S | S | * | * | trans | -174.3 | 104 | 138.9 | -90.7 | -69.7 | 0 | 0 | 0 | 112.1 | ||||
| 267 | H | 31.3 | Very low | 37.9 | Very low | 168 Ų | 168 | 131.9 Ų | 131.9 | 78% | 0.778 | 73% | 0.729 | S | S | * | * | trans | 61.6 | 107.2 | 144.2 | -62.1 | -14.5 | 0 | 0 | 0 | 122.5 | ||||
| 268 | A | 29.2 | Very low | 37.5 | Very low | 100 Ų | 100 | 133 Ų | 133 | 83% | 0.826 | 73% | 0.726 | S | S | * | * | trans | -82.5 | 133 | 158.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 269 | H | 28 | Very low | 36.7 | Very low | 161 Ų | 161 | 137.7 Ų | 137.7 | 75% | 0.745 | 75% | 0.751 | S | S | * | * | trans | -112.1 | 121.7 | 161.6 | -175.1 | 69 | 0 | 0 | 0 | 108.5 | ||||
| 270 | I | 31.7 | Very low | 36.5 | Very low | 147 Ų | 147 | 143.2 Ų | 143.2 | 75% | 0.754 | 77% | 0.766 | S | S | * | * | trans | -94.6 | 123.6 | -179.6 | -66 | 173.3 | 0 | 0 | 0 | 109 | ||||
| 271 | Q | 35.9 | Very low | 36 | Very low | 166 Ų | 166 | 145.5 Ų | 145.5 | 78% | 0.776 | 78% | 0.781 | S | S | * | * | trans | -141.9 | 113.9 | 152.9 | -75.5 | -172.6 | -10.3 | 0 | 0 | 109.6 | ||||
| 272 | N | 30.2 | Very low | 35.7 | Very low | 151 Ų | 151 | 146 Ų | 146 | 81% | 0.807 | 79% | 0.787 | S | S | * | * | trans | -65.9 | 164.3 | 155.7 | -86.7 | -21.5 | 0 | 0 | 0 | 109 | ||||
| 273 | P | 39.6 | Very low | 35.1 | Very low | 115 Ų | 115 | 146.8 Ų | 146.8 | 75% | 0.747 | 79% | 0.786 | S | S | * | * | cis | -150.3 | 174.7 | 32.3 | 38.2 | -15.7 | 0 | 0 | 0 | 117.4 | ||||
| 274 | S | 38.1 | Very low | 35.2 | Very low | 119 Ų | 119 | 144.7 Ų | 144.7 | 83% | 0.832 | 78% | 0.779 | S | S | * | * | 145.4 | 131.3 | 127.3 | 63.7 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 275 | L | 37.3 | Very low | 35.1 | Very low | 174 Ų | 174 | 143.2 Ų | 143.2 | 91% | 0.911 | 77% | 0.768 | S | S | * | * | trans | -78.1 | 143.5 | -173.1 | -64.9 | 102 | 0 | 0 | 0 | 112 | ||||
| 276 | D | 32.4 | Very low | 35.3 | Very low | 144 Ų | 144 | 144.6 Ų | 144.6 | 77% | 0.77 | 78% | 0.777 | S | S | * | * | trans | -129.8 | 120 | 155 | -161.6 | 9.7 | 0 | 0 | 0 | 109.3 | S278 | D276-S278 PolarHBondContact O-N 2.9Š| ||
| 277 | P | 37.9 | Very low | 35.4 | Very low | 118 Ų | 118 | 143.5 Ų | 143.5 | 77% | 0.766 | 78% | 0.777 | S | S | * | * | trans | -94.2 | 97.2 | -172.1 | 33.6 | -28.4 | 0 | 0 | 0 | 111.6 | ||||
| 278 | S | 41.4 | Very low | 35.6 | Very low | 93 Ų | 93 | 143.5 Ų | 143.5 | 65% | 0.65 | 78% | 0.782 | S | S | * | * | trans | -154.2 | 44.8 | 171.4 | 57.4 | 0 | 0 | 0 | 0 | 114.6 | D276 | D276-S278 PolarHBondContact O-N 2.9Š| ||
| 279 | L | 41.2 | Very low | 36.1 | Very low | 169 Ų | 169 | 143.7 Ų | 143.7 | 89% | 0.885 | 77% | 0.774 | S | S | * | * | trans | -136.2 | 98.6 | 169.1 | -87.6 | 160.6 | 0 | 0 | 0 | 110.2 | ||||
| 280 | W | 44.1 | Very low | 36.6 | Very low | 248 Ų | 248 | 142 Ų | 142 | 94% | 0.939 | 78% | 0.781 | S | S | * | * | trans | -73.1 | 125.2 | 170 | -75.3 | 67 | 0 | 0 | 0 | 109.6 | ||||
| 281 | P | 36.4 | Very low | 36.9 | Very low | 124 Ų | 124 | 141.9 Ų | 141.9 | 81% | 0.805 | 78% | 0.782 | S | S | * | * | trans | -91.8 | 109.5 | 172 | 32 | -24.7 | 0 | 0 | 0 | 109.5 | N283 | P281-N283 PolarHBondContact O-N 3.46Š| ||
| 282 | L | 32.4 | Very low | 37.3 | Very low | 157 Ų | 157 | 141.2 Ų | 141.2 | 82% | 0.822 | 78% | 0.784 | S | S | * | * | trans | -85.5 | 97 | 170.7 | -120.1 | 149.8 | 0 | 0 | 0 | 109 | I284 | L282-I284 HydrophobicContact CD2-CD1 4.48Å; L282-I284 HydrophobicContact CD2-CG1 4.21Å | ||
| 283 | N | 33.5 | Very low | 37.7 | Very low | 122 Ų | 122 | 139.5 Ų | 139.5 | 65% | 0.652 | 78% | 0.779 | S | S | * | * | trans | -71.5 | 117.6 | 167.8 | -178.1 | 13.4 | 0 | 0 | 0 | 109.2 | P281 Q285 | P281-N283 PolarHBondContact O-N 3.46Å; N283-Q285 PolarHBondContact OD1-N 3.39Å | ||
| 284 | I | 37.3 | Very low | 38 | Very low | 137 Ų | 137 | 139.9 Ų | 139.9 | 70% | 0.703 | 78% | 0.784 | S | S | * | * | trans | -117.8 | 86.6 | 165.9 | -55.7 | 178.3 | 0 | 0 | 0 | 107.4 | L282 T286 | L282-I284 HydrophobicContact CD2-CD1 4.48Å; L282-I284 HydrophobicContact CD2-CG1 4.21Å; I284-T286 PolarHBondContact O-N 3.37Å | ||
| 285 | Q | 34.6 | Very low | 38.1 | Very low | 137 Ų | 137 | 141.6 Ų | 141.6 | 64% | 0.64 | 78% | 0.784 | S | S | * | * | trans | -69.6 | 115.2 | 167.3 | -162.8 | 102.6 | 34.3 | 0 | 0 | 108.2 | N283 | N283-Q285 PolarHBondContact OD1-N 3.39Š| ||
| 286 | T | 34.9 | Very low | 38.3 | Very low | 125 Ų | 125 | 139.4 Ų | 139.4 | 77% | 0.767 | 78% | 0.783 | S | S | * | * | trans | -87.4 | 107.8 | 165.8 | 49.7 | 0 | 0 | 0 | 0 | 107.8 | I284 | I284-T286 PolarHBondContact O-N 3.37Š| ||
| 287 | N | 36.7 | Very low | 38.6 | Very low | 139 Ų | 139 | 144 Ų | 144 | 74% | 0.743 | 79% | 0.79 | S | S | * | * | trans | -135.3 | 121.4 | 164.1 | -85.7 | -28.3 | 0 | 0 | 0 | 107.7 | ||||
| 288 | L | 34.8 | Very low | 38.8 | Very low | 168 Ų | 168 | 150.4 Ų | 150.4 | 88% | 0.88 | 80% | 0.799 | S | S | * | * | trans | -110.6 | 166 | 174.5 | -150.7 | 80.5 | 0 | 0 | 0 | 106.7 | ||||
| 289 | P | 39 | Very low | 38.6 | Very low | 103 Ų | 103 | 152.9 Ų | 152.9 | 67% | 0.669 | 81% | 0.81 | S | S | * | * | -120 | 170.6 | -62.4 | 33.2 | -18.9 | 0 | 0 | 0 | 111.4 | |||||
| 290 | S | 39.3 | Very low | 38.6 | Very low | 125 Ų | 125 | 149.8 Ų | 149.8 | 87% | 0.874 | 81% | 0.809 | S | S | * | * | trans | -151.5 | 125.1 | 152.7 | -78.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 291 | N | 38.5 | Very low | 38.2 | Very low | 145 Ų | 145 | 143.9 Ų | 143.9 | 78% | 0.775 | 81% | 0.805 | S | S | * | * | trans | -36.9 | 131.8 | 168.3 | -162.4 | 35.3 | 0 | 0 | 0 | 114.7 | ||||
| 292 | D | 43.5 | Very low | 38.4 | Very low | 153 Ų | 153 | 142.1 Ų | 142.1 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | -157.6 | 149.6 | 139.2 | -115.4 | -21.2 | 0 | 0 | 0 | 113 | ||||
| 293 | T | 39 | Very low | 38.8 | Very low | 115 Ų | 115 | 140 Ų | 140 | 71% | 0.706 | 80% | 0.799 | S | S | * | * | trans | -94.9 | 139.5 | -152.2 | -4.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 294 | S | 46 | Very low | 38.8 | Very low | 122 Ų | 122 | 140 Ų | 140 | 85% | 0.853 | 81% | 0.809 | S | S | * | * | trans | -175.1 | 132.8 | 140.7 | 30.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 295 | D | 40 | Very low | 39.4 | Very low | 155 Ų | 155 | 139.4 Ų | 139.4 | 83% | 0.829 | 81% | 0.814 | S | S | * | * | trans | -59.9 | 140.7 | -171.6 | -70 | -74.3 | 0 | 0 | 0 | 116.6 | ||||
| 296 | S | 41 | Very low | 39.6 | Very low | 129 Ų | 129 | 141.7 Ų | 141.7 | 90% | 0.902 | 83% | 0.825 | S | S | * | * | trans | -158.9 | 106.5 | 135.5 | -87.9 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 297 | R | 39.3 | Very low | 39.8 | Very low | 240 Ų | 240 | 143.3 Ų | 143.3 | 91% | 0.906 | 83% | 0.829 | S | S | * | * | trans | -29.9 | 130.3 | 168.4 | -70.3 | 168.8 | 169.5 | -138 | -2.9 | 115.4 | ||||
| 298 | R | 41.1 | Very low | 40.2 | Very low | 252 Ų | 252 | 141.3 Ų | 141.3 | 95% | 0.951 | 82% | 0.824 | S | S | * | * | -169.4 | 117.7 | 118 | -101.1 | 167.3 | -167.7 | -118.4 | 4.2 | 110.5 | |||||
| 299 | T | 38 | Very low | 40.8 | Very low | 145 Ų | 145 | 140.5 Ų | 140.5 | 89% | 0.89 | 82% | 0.82 | S | S | * | * | trans | -74.4 | 130.6 | 176.5 | 46.8 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 300 | A | 40.3 | Very low | 41 | Very low | 104 Ų | 104 | 142.9 Ų | 142.9 | 86% | 0.86 | 83% | 0.827 | S | S | * | * | trans | -163.9 | 106.8 | 146.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 301 | S | 35.8 | Very low | 41.3 | Very low | 124 Ų | 124 | 141 Ų | 141 | 87% | 0.867 | 82% | 0.819 | S | S | * | * | trans | -75.5 | 133 | 168.5 | 40 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 302 | A | 40.4 | Very low | 41.4 | Very low | 87 Ų | 87 | 144.5 Ų | 144.5 | 72% | 0.719 | 82% | 0.822 | S | S | * | * | trans | -166.8 | 95.2 | 153.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 303 | S | 41.6 | Very low | 41.5 | Very low | 112 Ų | 112 | 142.9 Ų | 142.9 | 78% | 0.783 | 82% | 0.819 | S | S | * | * | 56.3 | 108.1 | 94.1 | 59.7 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 304 | S | 34.6 | Very low | 41.7 | Very low | 123 Ų | 123 | 141.1 Ų | 141.1 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | trans | -68.8 | 137.3 | 169.6 | -168.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 305 | P | 48.8 | Very low | 41.4 | Very low | 125 Ų | 125 | 140.1 Ų | 140.1 | 81% | 0.812 | 81% | 0.805 | S | S | * | * | trans | -105.9 | 131.3 | 159.8 | -4.1 | 24.9 | 0 | 0 | 0 | 112 | ||||
| 306 | Q | 38.8 | Very low | 41.8 | Very low | 185 Ų | 185 | 139.1 Ų | 139.1 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | trans | -90.9 | 125.7 | 171.5 | 175.8 | 173.7 | -28.4 | 0 | 0 | 107.1 | ||||
| 307 | D | 40.2 | Very low | 41.8 | Very low | 159 Ų | 159 | 140.7 Ų | 140.7 | 85% | 0.85 | 80% | 0.802 | S | S | * | * | trans | -104.2 | 120.3 | 173.3 | -110.6 | -29.9 | 0 | 0 | 0 | 110.8 | ||||
| 308 | P | 44.7 | Very low | 42.3 | Very low | 97 Ų | 97 | 136.4 Ų | 136.4 | 63% | 0.63 | 80% | 0.796 | S | S | * | * | trans | -98.7 | 119.2 | 166.4 | 34.2 | -22.2 | 0 | 0 | 0 | 109.9 | ||||
| 309 | D | 46.7 | Very low | 42.1 | Very low | 150 Ų | 150 | 132.5 Ų | 132.5 | 80% | 0.802 | 79% | 0.794 | S | S | * | * | trans | -171.6 | 96.3 | 158.3 | -87.5 | -37.9 | 0 | 0 | 0 | 106.3 | ||||
| 310 | D | 43.1 | Very low | 42.7 | Very low | 153 Ų | 153 | 132.7 Ų | 132.7 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | 73.5 | 130.1 | 87 | -95.1 | -38.3 | 0 | 0 | 0 | 116.8 | |||||
| 311 | A | 45.9 | Very low | 42.7 | Very low | 85 Ų | 85 | 135.8 Ų | 135.8 | 70% | 0.702 | 79% | 0.785 | S | S | * | * | trans | 62.7 | 97.4 | 141.9 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 312 | R | 40.2 | Very low | 43 | Very low | 220 Ų | 220 | 139 Ų | 139 | 83% | 0.83 | 79% | 0.787 | S | S | * | * | trans | -27.4 | 145.1 | 141.1 | 170.4 | -176.6 | 151.6 | -170.1 | -5.9 | 115.6 | ||||
| 313 | P | 45.6 | Very low | 43 | Very low | 119 Ų | 119 | 141.6 Ų | 141.6 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | -133.9 | 119.9 | 125.2 | 33.5 | -20.3 | 0 | 0 | 0 | 110.7 | |||||
| 314 | S | 44.2 | Very low | 43.2 | Very low | 77 Ų | 77 | 144.1 Ų | 144.1 | 54% | 0.538 | 79% | 0.793 | S | S | . | * | 36.9 | 117.3 | 94.4 | -159 | 0 | 0 | 0 | 0 | 117.2 | |||||
| 315 | S | 39.3 | Very low | 43.5 | Very low | 102 Ų | 102 | 143.7 Ų | 143.7 | 71% | 0.713 | 79% | 0.787 | S | S | * | * | trans | 64.5 | 104.8 | 149.4 | 43 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 316 | V | 48.5 | Very low | 43.3 | Very low | 134 Ų | 134 | 145.1 Ų | 145.1 | 81% | 0.812 | 79% | 0.785 | S | S | * | * | trans | -141.3 | 112.8 | 146.7 | -153.6 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 317 | D | 41.5 | Very low | 43.5 | Very low | 162 Ų | 162 | 147 Ų | 147 | 87% | 0.866 | 78% | 0.784 | S | S | * | * | trans | -63.8 | 139.2 | 162.4 | -74.1 | -62.4 | 0 | 0 | 0 | 109.7 | ||||
| 318 | I | 48.9 | Very low | 43.4 | Very low | 150 Ų | 150 | 146.5 Ų | 146.5 | 77% | 0.769 | 78% | 0.782 | S | S | * | * | trans | -131 | 93.3 | 174.6 | -25.3 | 174.9 | 0 | 0 | 0 | 107.8 | ||||
| 319 | N | 37.9 | Very low | 43.4 | Very low | 169 Ų | 169 | 147.5 Ų | 147.5 | 90% | 0.904 | 79% | 0.786 | S | S | * | * | trans | -78.7 | 126.6 | 156.4 | -108.7 | -46.2 | 0 | 0 | 0 | 107.2 | ||||
| 320 | L | 49.6 | Very low | 43.1 | Very low | 150 Ų | 150 | 150.9 Ų | 150.9 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | trans | -133.7 | 112.5 | 169.8 | -163.8 | 65.4 | 0 | 0 | 0 | 109.6 | ||||
| 321 | E | 40.6 | Very low | 43.2 | Very low | 169 Ų | 169 | 149 Ų | 149 | 79% | 0.79 | 79% | 0.786 | S | S | * | * | trans | -19.1 | 142.7 | 174 | -62.7 | 178 | 98.9 | 0 | 0 | 120.8 | ||||
| 322 | Q | 42.9 | Very low | 43.1 | Very low | 192 Ų | 192 | 150 Ų | 150 | 90% | 0.897 | 79% | 0.787 | S | S | * | * | trans | -153.9 | 106.2 | 136.5 | -114.7 | 170 | -12.4 | 0 | 0 | 111.6 | ||||
| 323 | N | 40.2 | Very low | 43.2 | Very low | 141 Ų | 141 | 145.1 Ų | 145.1 | 75% | 0.754 | 79% | 0.787 | S | S | * | * | trans | 26.7 | 118.2 | 149 | -67.5 | -11.5 | 0 | 0 | 0 | 121.2 | ||||
| 324 | D | 45.6 | Very low | 43.3 | Very low | 165 Ų | 165 | 146 Ų | 146 | 88% | 0.882 | 79% | 0.79 | S | S | * | * | trans | -159.5 | 136.7 | 130.8 | -100.9 | -36.2 | 0 | 0 | 0 | 110.2 | ||||
| 325 | P | 41.1 | Very low | 43.4 | Very low | 114 Ų | 114 | 147 Ų | 147 | 74% | 0.74 | 80% | 0.797 | S | S | * | * | trans | -96.3 | 165.6 | -171.7 | 37.4 | -32.8 | 0 | 0 | 0 | 113.9 | ||||
| 326 | M | 43.3 | Very low | 43.5 | Very low | 154 Ų | 154 | 147.1 Ų | 147.1 | 76% | 0.759 | 80% | 0.798 | S | S | * | * | trans | 87 | 95.6 | 167 | -68.7 | -175.6 | 66.9 | 0 | 0 | 118.2 | ||||
| 327 | R | 43.5 | Very low | 43.3 | Very low | 225 Ų | 225 | 148.2 Ų | 148.2 | 85% | 0.849 | 80% | 0.804 | S | S | * | * | 173.6 | 138 | 99 | -93 | 171.8 | -170.4 | -176.2 | 3.8 | 111.5 | |||||
| 328 | D | 39 | Very low | 43.2 | Very low | 149 Ų | 149 | 146 Ų | 146 | 80% | 0.797 | 80% | 0.802 | S | S | * | * | trans | -52.5 | 154.9 | -178.2 | -62.6 | -75.8 | 0 | 0 | 0 | 116 | ||||
| 329 | V | 43.1 | Very low | 42.9 | Very low | 118 Ų | 118 | 144.1 Ų | 144.1 | 72% | 0.715 | 80% | 0.802 | S | S | * | * | 160.9 | 111.1 | 107.9 | 166.5 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 330 | R | 42 | Very low | 43.1 | Very low | 221 Ų | 221 | 141.3 Ų | 141.3 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | trans | 67.2 | 111.6 | 141.5 | -64.6 | 175.9 | -179.8 | 175.5 | -5.7 | 120.2 | ||||
| 331 | S | 45 | Very low | 43.1 | Very low | 113 Ų | 113 | 139.3 Ų | 139.3 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | 90.2 | 134.1 | 96.1 | -61.1 | 0 | 0 | 0 | 0 | 111 | |||||
| 332 | S | 44.2 | Very low | 43.3 | Very low | 105 Ų | 105 | 140.7 Ų | 140.7 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | cis | -175.9 | 123.3 | 22.7 | 33.3 | 0 | 0 | 0 | 0 | 106 | ||||
| 333 | S | 42.3 | Very low | 43.2 | Very low | 119 Ų | 119 | 134.9 Ų | 134.9 | 83% | 0.832 | 79% | 0.792 | S | S | * | * | 58.6 | 111.1 | 93.9 | -51.9 | 0 | 0 | 0 | 0 | 117.3 | |||||
| 334 | V | 47.9 | Very low | 43.5 | Very low | 137 Ų | 137 | 136.4 Ų | 136.4 | 83% | 0.83 | 80% | 0.801 | S | S | * | * | trans | -154.7 | 99.9 | 139.8 | -79.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 335 | S | 46.2 | Very low | 43.5 | Very low | 99 Ų | 99 | 133.4 Ų | 133.4 | 69% | 0.692 | 79% | 0.792 | S | S | * | * | 57.6 | 102.9 | 93.4 | 58.8 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 336 | S | 41.1 | Very low | 43.8 | Very low | 104 Ų | 104 | 133.5 Ų | 133.5 | 73% | 0.727 | 80% | 0.796 | S | S | * | * | 93.1 | 123.6 | 67.7 | 64.1 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 337 | V | 44.1 | Very low | 44.1 | Very low | 156 Ų | 156 | 136.7 Ų | 136.7 | 95% | 0.945 | 80% | 0.799 | S | S | * | * | trans | -159.5 | 130.2 | 139.8 | -96.9 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 338 | S | 39.8 | Very low | 44.4 | Very low | 116 Ų | 116 | 133 Ų | 133 | 81% | 0.811 | 80% | 0.797 | S | S | * | * | trans | -118.3 | 146.2 | -174.3 | -45.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 339 | S | 42.1 | Very low | 44.8 | Very low | 111 Ų | 111 | 133.1 Ų | 133.1 | 78% | 0.776 | 80% | 0.796 | S | S | * | * | trans | -173.8 | 92.8 | 154.9 | 39.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 340 | S | 42 | Very low | 44.9 | Very low | 110 Ų | 110 | 132.4 Ų | 132.4 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | 57.4 | 109.9 | 82.8 | 73 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 341 | S | 48.6 | Very low | 45.1 | Very low | 108 Ų | 108 | 128.2 Ų | 128.2 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | 164.6 | 121.2 | 108.6 | 54.3 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 342 | Q | 46.3 | Very low | 45.5 | Very low | 197 Ų | 197 | 127.3 Ų | 127.3 | 92% | 0.921 | 80% | 0.795 | S | S | * | * | trans | 49.7 | 121.6 | 132.7 | -62.7 | 178.5 | 7.3 | 0 | 0 | 121.7 | ||||
| 343 | G | 41 | Very low | 45.8 | Very low | 70 Ų | 70 | 129.7 Ų | 129.7 | 72% | 0.722 | 80% | 0.8 | S | S | * | * | 114 | 94.9 | 117.5 | 0 | 0 | 0 | 0 | 0 | 117 | |||||
| 344 | N | 44.5 | Very low | 46.3 | Very low | 174 Ų | 174 | 131.7 Ų | 131.7 | 93% | 0.93 | 80% | 0.801 | S | S | * | * | -169.7 | 114.7 | 117.8 | -99.7 | -5 | 0 | 0 | 0 | 111.9 | |||||
| 345 | S | 46 | Very low | 46.7 | Very low | 101 Ų | 101 | 134.1 Ų | 134.1 | 71% | 0.706 | 80% | 0.8 | S | S | * | * | trans | -85.2 | 131.2 | 165.8 | -63.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 346 | S | 47.6 | Very low | 47 | Very low | 117 Ų | 117 | 135.4 Ų | 135.4 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -160.8 | 87.6 | 149.7 | -77.8 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 347 | R | 50.1 | Low | 48 | Very low | 220 Ų | 220 | 136.8 Ų | 136.8 | 83% | 0.83 | 80% | 0.803 | S | S | * | * | 47.9 | 92.9 | 90.9 | -68.8 | -168.6 | -101.1 | 176.7 | -6.1 | 112.8 | |||||
| 348 | N | 49 | Very low | 48.6 | Very low | 148 Ų | 148 | 140.6 Ų | 140.6 | 79% | 0.791 | 80% | 0.8 | S | S | * | * | trans | -175.5 | 99 | 137.2 | -87.6 | -31.9 | 0 | 0 | 0 | 108.5 | ||||
| 349 | L | 47.8 | Very low | 50 | Low | 151 Ų | 151 | 137.4 Ų | 137.4 | 79% | 0.791 | 77% | 0.774 | S | S | * | * | 68.1 | 82.3 | 92 | -85.8 | 130.2 | 0 | 0 | 0 | 113.8 | |||||
| 350 | A | 44.8 | Very low | 51.8 | Low | 104 Ų | 104 | 136.5 Ų | 136.5 | 86% | 0.86 | 76% | 0.761 | S | S | * | * | trans | -140 | 83.8 | 148.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | S352 | A350-S352 PolarHBondContact O-N 2.83Š| ||
| 351 | V | 46.8 | Very low | 53.8 | Low | 132 Ų | 132 | 135.7 Ų | 135.7 | 80% | 0.8 | 75% | 0.753 | S | S | * | * | trans | -64.5 | 113.2 | 171 | 165.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 352 | S | 53.1 | Low | 55.8 | Low | 94 Ų | 94 | 135.5 Ų | 135.5 | 66% | 0.657 | 75% | 0.747 | S | S | * | * | trans | -172.8 | 131.2 | 136 | 53.4 | 0 | 0 | 0 | 0 | 110.9 | A350 | A350-S352 PolarHBondContact O-N 2.83Š| ||
| 353 | N | 50.1 | Low | 57.8 | Low | 155 Ų | 155 | 130.6 Ų | 130.6 | 83% | 0.829 | 72% | 0.724 | S | S | * | * | trans | 84.3 | 29.4 | 168 | -53.9 | -62.4 | 0 | 0 | 0 | 120 | K355 | N353-K355 VanDerWaalsContact C-N 3.29Å; N353-K355 PolarHBondContact O-N 3.38Å | ||
| 354 | L | 53.5 | Low | 60.1 | Low | 162 Ų | 162 | 131.3 Ų | 131.3 | 85% | 0.848 | 71% | 0.709 | S | S | * | * | trans | -92.1 | 64.8 | 157.5 | -161.7 | 74.1 | 0 | 0 | 0 | 110.4 | ||||
| 355 | K | 55.9 | Low | 62.3 | Low | 188 Ų | 188 | 126.3 Ų | 126.3 | 82% | 0.817 | 69% | 0.687 | S | S | * | * | trans | -144.2 | 61.6 | 174.6 | -162.6 | 159.9 | -172.5 | 174.9 | 0 | 109 | N353 | N353-K355 VanDerWaalsContact C-N 3.29Å; N353-K355 PolarHBondContact O-N 3.38Å | ||
| 356 | D | 52.5 | Low | 64.6 | Low | 125 Ų | 125 | 130.9 Ų | 130.9 | 67% | 0.668 | 69% | 0.689 | S | S | * | * | trans | 179.3 | 50.3 | 162 | -93.6 | -23.6 | 0 | 0 | 0 | 113.3 | R358 L359 | D356-R358 PolarHBondContact O-N 2.91Å; D356-L359 HydrophobicContact CB-CD2 4.11Å | ||
| 357 | T | 62.4 | Low | 66.6 | Low | 134 Ų | 134 | 128.9 Ų | 128.9 | 82% | 0.822 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | 18.2 | 169.2 | 14.5 | 0 | 0 | 0 | 0 | 113.5 | ||
| 358 | R | 56.9 | Low | 68.8 | Low | 235 Ų | 235 | 125 Ų | 125 | 89% | 0.887 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -141.5 | 53.4 | 176.5 | -149.4 | -176.6 | -175 | -166.5 | 1.1 | 111.7 | D356 D360 | D356-R358 PolarHBondContact O-N 2.91Å; R358-D360 PolarHBondContact O-N 3.28Å |
| 359 | L | 68.4 | Low | 71 | Confident | 50 Ų | 50 | 121.9 Ų | 121.9 | 26% | 0.262 | 64% | 0.636 | S | S | . | * | trans | -54 | 132.4 | 170.3 | -60.8 | 175.9 | 0 | 0 | 0 | 109.7 | D356 M367 | D356-L359 HydrophobicContact CB-CD2 4.11Å; L359-M367 HydrophobicContact CD1-CE 3.86Å | ||
| 360 | D | 80.2 | Confident | 73.3 | Confident | 91 Ų | 91 | 118.5 Ų | 118.5 | 49% | 0.487 | 62% | 0.616 | S | S | . | * | trans | -52 | 138.9 | 173.8 | 178.8 | 58.2 | 0 | 0 | 0 | 110.1 | R358 T362 E363 Q364 | R358-D360 PolarHBondContact O-N 3.28Å; D360-T362 PolarHBondContact O-N 2.98Å; D360-T362 WeakPolarHBondContact OD2-CB 3.33Å; D360-T362 PolarHBondContact OD2-N 3.23Å; D360-T362 PolarHBondContact OD2-OG1 2.98Å; D360-E363 HydrophobicContact CB-CB 4.3Å; D360-E363 WeakPolarHBondContact O-CA 3.49Å; D360-E363 WeakPolarHBondContact O-CB 3.09Å; D360-E363 PolarHBondContact O-N 3.04Å; D360-Q364 PolarHBondContact O-N 3.45Å | ||
| 361 | P | 84.7 | Confident | 75.7 | Confident | 94 Ų | 94 | 120.7 Ų | 120.7 | 61% | 0.61 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -51.3 | -31.3 | -179.6 | -31.2 | 37.4 | 0 | 0 | 0 | 114.4 | S365 | P361-S365 WeakPolarHBondContact O-CB 3.46Å; P361-S365 PolarHBondContact O-N 2.79Å; P361-S365 VanDerWaalsContact O-N 3.13Å; P361-S365 PolarHBondContact O-OG 3.25Å |
| 362 | T | 89.4 | Confident | 78.1 | Confident | 103 Ų | 103 | 120.9 Ų | 120.9 | 63% | 0.632 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.3 | -43.5 | 175.8 | -42 | 0 | 0 | 0 | 0 | 111.6 | D360 S365 R366 | D360-T362 PolarHBondContact O-N 2.98Å; D360-T362 WeakPolarHBondContact OD2-CB 3.33Å; D360-T362 PolarHBondContact OD2-N 3.23Å; D360-T362 PolarHBondContact OD2-OG1 2.98Å; T362-S365 WeakPolarHBondContact O-CB 3.37Å; T362-S365 PolarHBondContact O-N 3.24Å; T362-R366 PolarHBondContact O-N 3.27Å |
| 363 | E | 88.9 | Confident | 80.3 | Confident | 95 Ų | 95 | 122 Ų | 122 | 44% | 0.444 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -68.2 | -43 | 179 | -172.1 | 176.1 | -168.2 | 0 | 0 | 111.8 | D360 S365 R366 M367 | D360-E363 HydrophobicContact CB-CB 4.3Å; D360-E363 WeakPolarHBondContact O-CA 3.49Å; D360-E363 WeakPolarHBondContact O-CB 3.09Å; D360-E363 PolarHBondContact O-N 3.04Å; E363-S365 VanDerWaalsContact C-N 3.26Å; E363-S365 PolarHBondContact O-N 3.03Å; E363-R366 WeakPolarHBondContact O-CB 3.46Å; E363-R366 PolarHBondContact O-N 3.21Å; E363-M367 PolarHBondContact O-N 3.44Å |
| 364 | Q | 89.8 | Confident | 82.5 | Confident | 84 Ų | 84 | 116.5 Ų | 116.5 | 39% | 0.393 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -59.5 | -39.7 | 174.3 | -168.4 | -178.3 | 64.7 | 0 | 0 | 111.3 | D360 M367 R368 | D360-Q364 PolarHBondContact O-N 3.45Å; Q364-M367 PolarHBondContact O-N 3.37Å; Q364-R368 VanDerWaalsContact O-CG 3.31Å; Q364-R368 WeakPolarHBondContact O-CG 3.32Å; Q364-R368 PolarHBondContact O-N 2.91Å |
| 365 | S | 90.8 | Very high | 84.6 | Confident | 69 Ų | 69 | 116.2 Ų | 116.2 | 48% | 0.483 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -66 | -43.8 | 176.1 | -64.1 | 0 | 0 | 0 | 0 | 112.2 | P361 T362 E363 M367 R368 L369 | P361-S365 WeakPolarHBondContact O-CB 3.46Å; P361-S365 PolarHBondContact O-N 2.79Å; P361-S365 VanDerWaalsContact O-N 3.13Å; P361-S365 PolarHBondContact O-OG 3.25Å; T362-S365 WeakPolarHBondContact O-CB 3.37Å; T362-S365 PolarHBondContact O-N 3.24Å; E363-S365 VanDerWaalsContact C-N 3.26Å; E363-S365 PolarHBondContact O-N 3.03Å; S365-M367 VanDerWaalsContact C-N 3.34Å; S365-M367 PolarHBondContact O-N 2.88Å; S365-R368 PolarHBondContact O-N 2.75Å; S365-L369 PolarHBondContact O-N 3.49Å |
| 366 | R | 93.6 | Very high | 86.7 | Confident | 198 Ų | 198 | 112.6 Ų | 112.6 | 75% | 0.747 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -59 | -45.2 | 174.5 | -176.7 | -174.6 | 171.2 | 95.4 | -0.7 | 111.3 | T362 E363 L369 E370 | T362-R366 PolarHBondContact O-N 3.27Å; E363-R366 WeakPolarHBondContact O-CB 3.46Å; E363-R366 PolarHBondContact O-N 3.21Å; R366-L369 PolarHBondContact O-N 2.81Å; R366-E370 PolarHBondContact O-N 3.43Å |
| 367 | M | 91 | Very high | 88.8 | Confident | 75 Ų | 75 | 113.6 Ų | 113.6 | 37% | 0.369 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.5 | -43.2 | 178.9 | -171.9 | -176.5 | -65.6 | 0 | 0 | 112.1 | L359 E363 Q364 S365 L369 E370 R371 | L359-M367 HydrophobicContact CD1-CE 3.86Å; E363-M367 PolarHBondContact O-N 3.44Å; Q364-M367 PolarHBondContact O-N 3.37Å; S365-M367 VanDerWaalsContact C-N 3.34Å; S365-M367 PolarHBondContact O-N 2.88Å; M367-L369 VanDerWaalsContact C-N 3.31Å; M367-L369 PolarHBondContact O-N 2.94Å; M367-E370 PolarHBondContact O-N 2.89Å; M367-R371 WeakPolarHBondContact O-CG 3.36Å; M367-R371 PolarHBondContact O-N 2.82Å; M367-R371 PolarHBondContact SD-NH2 3.45Å; M367-R371 VanDerWaalsContact SD-NH2 3.42Å |
| 368 | R | 94.6 | Very high | 90.5 | Very high | 138 Ų | 138 | 110.7 Ų | 110.7 | 52% | 0.521 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61 | -40.5 | 175.1 | -74.4 | 173.3 | 179 | 170.6 | 2.5 | 111.7 | Q364 S365 K372 | Q364-R368 VanDerWaalsContact O-CG 3.31Å; Q364-R368 WeakPolarHBondContact O-CG 3.32Å; Q364-R368 PolarHBondContact O-N 2.91Å; S365-R368 PolarHBondContact O-N 2.75Å; R368-K372 WeakPolarHBondContact O-CG 3.45Å; R368-K372 PolarHBondContact O-N 2.98Å |
| 369 | L | 94.9 | Very high | 92.5 | Very high | 82 Ų | 82 | 102.1 Ų | 102.1 | 43% | 0.429 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.4 | -44.1 | 176.9 | -179.6 | 61.2 | 0 | 0 | 0 | 111.8 | S365 R366 M367 R371 K372 R373 | S365-L369 PolarHBondContact O-N 3.49Å; R366-L369 PolarHBondContact O-N 2.81Å; M367-L369 VanDerWaalsContact C-N 3.31Å; M367-L369 PolarHBondContact O-N 2.94Å; L369-R371 PolarHBondContact O-N 3.36Å; L369-K372 WeakPolarHBondContact O-CB 3.41Å; L369-K372 PolarHBondContact O-N 3.42Å; L369-K372 VanDerWaalsContact O-N 3.16Å; L369-R373 HydrophobicContact CD1-CG 4.46Å; L369-R373 WeakPolarHBondContact O-CG 3.38Å; L369-R373 PolarHBondContact O-N 2.86Å |
| 370 | E | 96.3 | Very high | 94 | Very high | 81 Ų | 81 | 101.6 Ų | 101.6 | 38% | 0.379 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.2 | -38.3 | 179.2 | -165 | 57 | -148.3 | 0 | 0 | 111.7 | R366 M367 K372 R373 A374 R377 | R366-E370 PolarHBondContact O-N 3.43Å; M367-E370 PolarHBondContact O-N 2.89Å; E370-K372 PolarHBondContact O-N 3.19Å; E370-R373 PolarHBondContact O-N 2.81Å; E370-R373 IonicContact OE2-NH1 3.92Å; E370-A374 WeakPolarHBondContact O-CB 3.49Å; E370-A374 PolarHBondContact O-N 3.35Å; E370-R377 IonicContact OE1-CZ 3.93Å; E370-R377 IonicContact OE1-NH1 3.31Å; E370-R377 PolarHBondContact OE1-NH1 3.3Å; E370-R377 IonicContact OE1-NH2 3.73Å |
| 371 | R | 96.8 | Very high | 94.8 | Very high | 150 Ų | 150 | 105 Ų | 105 | 57% | 0.566 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.6 | -41.9 | 170.4 | -70.5 | 178.5 | -174.9 | 179.8 | 2.8 | 112.3 | M367 L369 R375 | M367-R371 WeakPolarHBondContact O-CG 3.36Å; M367-R371 PolarHBondContact O-N 2.82Å; M367-R371 PolarHBondContact SD-NH2 3.45Å; M367-R371 VanDerWaalsContact SD-NH2 3.42Å; L369-R371 PolarHBondContact O-N 3.36Å; R371-R375 WeakPolarHBondContact O-CG 3.36Å; R371-R375 PolarHBondContact O-N 3.03Å |
| 372 | K | 97.3 | Very high | 95.5 | Very high | 135 Ų | 135 | 107.2 Ų | 107.2 | 59% | 0.587 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.5 | -42.5 | 174.4 | -76.5 | 179.7 | 178.1 | -175.5 | 0 | 111.4 | R368 L369 E370 N376 | R368-K372 WeakPolarHBondContact O-CG 3.45Å; R368-K372 PolarHBondContact O-N 2.98Å; L369-K372 WeakPolarHBondContact O-CB 3.41Å; L369-K372 PolarHBondContact O-N 3.42Å; L369-K372 VanDerWaalsContact O-N 3.16Å; E370-K372 PolarHBondContact O-N 3.19Å; K372-N376 WeakPolarHBondContact O-CB 3.49Å; K372-N376 PolarHBondContact O-N 3.18Å |
| 373 | R | 97.4 | Very high | 95.9 | Very high | 117 Ų | 117 | 106.3 Ų | 106.3 | 44% | 0.442 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.8 | -45.8 | 177 | -72.8 | 175.1 | 175.7 | 179.9 | -0.3 | 112.2 | L369 E370 R375 N376 R377 | L369-R373 HydrophobicContact CD1-CG 4.46Å; L369-R373 WeakPolarHBondContact O-CG 3.38Å; L369-R373 PolarHBondContact O-N 2.86Å; E370-R373 PolarHBondContact O-N 2.81Å; E370-R373 IonicContact OE2-NH1 3.92Å; R373-R375 PolarHBondContact O-N 3.37Å; R373-N376 PolarHBondContact O-N 2.92Å; R373-R377 WeakPolarHBondContact O-CG 3.46Å; R373-R377 PolarHBondContact O-N 3.36Å |
| 374 | A | 97.7 | Very high | 96.4 | Very high | 40 Ų | 40 | 110.1 Ų | 110.1 | 33% | 0.331 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58 | -48.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | E370 N376 R377 D378 | E370-A374 WeakPolarHBondContact O-CB 3.49Å; E370-A374 PolarHBondContact O-N 3.35Å; A374-N376 VanDerWaalsContact C-N 3.32Å; A374-N376 PolarHBondContact O-N 2.82Å; A374-R377 WeakPolarHBondContact O-CB 3.49Å; A374-R377 PolarHBondContact O-N 3.03Å; A374-D378 PolarHBondContact O-N 2.66Å |
| 375 | R | 98 | Very high | 96.8 | Very high | 156 Ų | 156 | 110.4 Ų | 110.4 | 59% | 0.589 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60 | -38.9 | 175.3 | -72.5 | -173.1 | -64.5 | -136 | 3.1 | 113.1 | R371 R373 D378 A379 | R371-R375 WeakPolarHBondContact O-CG 3.36Å; R371-R375 PolarHBondContact O-N 3.03Å; R373-R375 PolarHBondContact O-N 3.37Å; R375-D378 PolarHBondContact O-N 3.42Å; R375-A379 VanDerWaalsContact O-CB 3.29Å; R375-A379 WeakPolarHBondContact O-CB 3.35Å; R375-A379 PolarHBondContact O-N 3.29Å |
| 376 | N | 98.5 | Very high | 97.2 | Very high | 113 Ų | 113 | 115.9 Ų | 115.9 | 60% | 0.604 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -68.1 | -39.5 | 176.8 | -175.6 | -92.3 | 0 | 0 | 0 | 112.2 | K372 R373 A374 D378 A379 A380 | K372-N376 WeakPolarHBondContact O-CB 3.49Å; K372-N376 PolarHBondContact O-N 3.18Å; R373-N376 PolarHBondContact O-N 2.92Å; A374-N376 VanDerWaalsContact C-N 3.32Å; A374-N376 PolarHBondContact O-N 2.82Å; N376-D378 VanDerWaalsContact C-N 3.32Å; N376-D378 PolarHBondContact O-N 3.45Å; N376-A379 PolarHBondContact O-N 3.45Å; N376-A380 WeakPolarHBondContact O-CB 3.38Å; N376-A380 PolarHBondContact O-N 3.48Å |
| 377 | R | 98.3 | Very high | 97.4 | Very high | 146 Ų | 146 | 113.2 Ų | 113.2 | 55% | 0.551 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -57 | -47.3 | 172.2 | -70.3 | 174.7 | -175.2 | 145.5 | 4.6 | 110.8 | E370 R373 A374 A380 R381 | E370-R377 IonicContact OE1-CZ 3.93Å; E370-R377 IonicContact OE1-NH1 3.31Å; E370-R377 PolarHBondContact OE1-NH1 3.3Å; E370-R377 IonicContact OE1-NH2 3.73Å; R373-R377 WeakPolarHBondContact O-CG 3.46Å; R373-R377 PolarHBondContact O-N 3.36Å; A374-R377 WeakPolarHBondContact O-CB 3.49Å; A374-R377 PolarHBondContact O-N 3.03Å; R377-A380 PolarHBondContact O-N 3.49Å; R377-R381 PolarHBondContact O-N 2.72Å |
| 378 | D | 98.2 | Very high | 97.8 | Very high | 72 Ų | 72 | 114 Ų | 114 | 39% | 0.385 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -67.6 | -39.9 | 178.4 | -69.7 | -31.1 | 0 | 0 | 0 | 112.4 | A374 R375 N376 R381 K382 | A374-D378 PolarHBondContact O-N 2.66Å; R375-D378 PolarHBondContact O-N 3.42Å; N376-D378 VanDerWaalsContact C-N 3.32Å; N376-D378 PolarHBondContact O-N 3.45Å; D378-R381 PolarHBondContact O-N 2.8Å; D378-R381 IonicContact OD1-CZ 3.89Å; D378-R381 IonicContact OD1-NH1 2.96Å; D378-R381 PolarHBondContact OD1-NH1 3.1Å; D378-K382 WeakPolarHBondContact O-CB 2.97Å; D378-K382 WeakPolarHBondContact O-CG 3.28Å; D378-K382 PolarHBondContact O-N 2.82Å |
| 379 | A | 98.4 | Very high | 98 | Very high | 56 Ų | 56 | 114 Ų | 114 | 46% | 0.463 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.3 | -42.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | R375 N376 K382 C383 | R375-A379 VanDerWaalsContact O-CB 3.29Å; R375-A379 WeakPolarHBondContact O-CB 3.35Å; R375-A379 PolarHBondContact O-N 3.29Å; N376-A379 PolarHBondContact O-N 3.45Å; A379-K382 PolarHBondContact O-N 3.4Å; A379-C383 VanDerWaalsContact O-CB 3.27Å; A379-C383 WeakPolarHBondContact O-CB 3.45Å; A379-C383 PolarHBondContact O-N 3.05Å |
| 380 | A | 98.5 | Very high | 98.1 | Very high | 39 Ų | 39 | 115 Ų | 115 | 32% | 0.322 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.2 | -42 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | N376 R377 C383 R384 | N376-A380 WeakPolarHBondContact O-CB 3.38Å; N376-A380 PolarHBondContact O-N 3.48Å; R377-A380 PolarHBondContact O-N 3.49Å; A380-C383 PolarHBondContact O-N 3.5Å; A380-R384 WeakPolarHBondContact O-CG 3.47Å; A380-R384 PolarHBondContact O-N 3.31Å |
| 381 | R | 98.5 | Very high | 98.2 | Very high | 162 Ų | 162 | 114.7 Ų | 114.7 | 61% | 0.611 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -58.8 | -51.5 | 172.9 | -173.6 | -168.5 | -69.3 | 133.4 | -1.4 | 110.9 | R377 D378 C383 R384 E385 | R377-R381 PolarHBondContact O-N 2.72Å; D378-R381 PolarHBondContact O-N 2.8Å; D378-R381 IonicContact OD1-CZ 3.89Å; D378-R381 IonicContact OD1-NH1 2.96Å; D378-R381 PolarHBondContact OD1-NH1 3.1Å; R381-C383 VanDerWaalsContact C-N 3.31Å; R381-C383 PolarHBondContact O-N 2.84Å; R381-R384 PolarHBondContact O-N 2.79Å; R381-E385 WeakPolarHBondContact O-CB 3.29Å; R381-E385 PolarHBondContact O-N 3.22Å |
| 382 | K | 98.7 | Very high | 98.3 | Very high | 140 Ų | 140 | 114.1 Ų | 114.1 | 61% | 0.609 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.1 | -37.6 | 178.1 | -73.1 | -179.9 | -179.1 | -176 | 0 | 112.6 | D378 A379 E385 R386 | D378-K382 WeakPolarHBondContact O-CB 2.97Å; D378-K382 WeakPolarHBondContact O-CG 3.28Å; D378-K382 PolarHBondContact O-N 2.82Å; A379-K382 PolarHBondContact O-N 3.4Å; K382-E385 PolarHBondContact O-N 2.9Å; K382-R386 WeakPolarHBondContact O-CB 3.43Å; K382-R386 PolarHBondContact O-N 2.92Å |
| 383 | C | 98.6 | Very high | 98.4 | Very high | 85 Ų | 85 | 110.4 Ų | 110.4 | 57% | 0.574 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.4 | -49 | 175.9 | -175.3 | 0 | 0 | 0 | 0 | 111.4 | A379 A380 R381 E385 R386 K387 | A379-C383 VanDerWaalsContact O-CB 3.27Å; A379-C383 WeakPolarHBondContact O-CB 3.45Å; A379-C383 PolarHBondContact O-N 3.05Å; A380-C383 PolarHBondContact O-N 3.5Å; R381-C383 VanDerWaalsContact C-N 3.31Å; R381-C383 PolarHBondContact O-N 2.84Å; C383-E385 VanDerWaalsContact C-N 3.34Å; C383-E385 PolarHBondContact O-N 3.21Å; C383-R386 PolarHBondContact O-N 2.84Å; C383-K387 PolarHBondContact O-N 3.45Å |
| 384 | R | 98.6 | Very high | 98.4 | Very high | 175 Ų | 175 | 109.2 Ų | 109.2 | 66% | 0.66 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.3 | -45.1 | 174.7 | -70.3 | 172.9 | -177.5 | 178.5 | -0.2 | 111.6 | A380 R381 R386 K387 I388 | A380-R384 WeakPolarHBondContact O-CG 3.47Å; A380-R384 PolarHBondContact O-N 3.31Å; R381-R384 PolarHBondContact O-N 2.79Å; R384-R386 PolarHBondContact O-N 3.45Å; R384-K387 WeakPolarHBondContact O-CB 3.32Å; R384-K387 PolarHBondContact O-N 3.37Å; R384-I388 WeakPolarHBondContact O-CG1 3.4Å; R384-I388 PolarHBondContact O-N 2.91Å |
| 385 | E | 98.6 | Very high | 98.5 | Very high | 89 Ų | 89 | 112.6 Ų | 112.6 | 42% | 0.416 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.4 | -42 | 179.6 | -161 | -165.5 | -166.6 | 0 | 0 | 112 | R381 K382 C383 I388 R389 | R381-E385 WeakPolarHBondContact O-CB 3.29Å; R381-E385 PolarHBondContact O-N 3.22Å; K382-E385 PolarHBondContact O-N 2.9Å; C383-E385 VanDerWaalsContact C-N 3.34Å; C383-E385 PolarHBondContact O-N 3.21Å; E385-I388 PolarHBondContact O-N 2.99Å; E385-R389 WeakPolarHBondContact O-CG 3.4Å; E385-R389 PolarHBondContact O-N 3.02Å; E385-R389 IonicContact OE1-CZ 3.37Å; E385-R389 IonicContact OE1-NH1 3.5Å; E385-R389 IonicContact OE1-NH2 2.67Å; E385-R389 PolarHBondContact OE1-NH2 3.44Å; E385-R389 IonicContact OE2-CZ 3.54Å; E385-R389 IonicContact OE2-NH1 2.88Å; E385-R389 PolarHBondContact OE2-NH1 3.42Å; E385-R389 IonicContact OE2-NH2 3.33Å; E385-R389 PolarHBondContact OE2-NH2 3.34Å |
| 386 | R | 98.5 | Very high | 98.5 | Very high | 184 Ų | 184 | 112.5 Ų | 112.5 | 69% | 0.694 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.4 | -42.4 | 173.6 | -172.8 | -178.2 | -67.1 | 162 | -3.2 | 111.6 | K382 C383 R384 I388 R389 L390 | K382-R386 WeakPolarHBondContact O-CB 3.43Å; K382-R386 PolarHBondContact O-N 2.92Å; C383-R386 PolarHBondContact O-N 2.84Å; R384-R386 PolarHBondContact O-N 3.45Å; R386-I388 PolarHBondContact O-N 2.98Å; R386-R389 PolarHBondContact O-N 2.71Å; R386-L390 WeakPolarHBondContact O-CB 3.34Å; R386-L390 PolarHBondContact O-N 3.2Å |
| 387 | K | 98.6 | Very high | 98.5 | Very high | 143 Ų | 143 | 110.5 Ų | 110.5 | 62% | 0.622 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.8 | -44 | 176.2 | -173.1 | 176.7 | -179.6 | 179.3 | 0 | 111.5 | C383 R384 L390 I391 | C383-K387 PolarHBondContact O-N 3.45Å; R384-K387 WeakPolarHBondContact O-CB 3.32Å; R384-K387 PolarHBondContact O-N 3.37Å; K387-L390 PolarHBondContact O-N 3.02Å; K387-I391 HydrophobicContact CG-CD1 4.14Å; K387-I391 WeakPolarHBondContact O-CG1 3.27Å; K387-I391 PolarHBondContact O-N 3.48Å |
| 388 | I | 98.5 | Very high | 98.5 | Very high | 91 Ų | 91 | 108.2 Ų | 108.2 | 47% | 0.467 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.9 | -44.2 | 177 | -66.6 | 163.8 | 0 | 0 | 0 | 111.1 | R384 E385 R386 L390 I391 K392 | R384-I388 WeakPolarHBondContact O-CG1 3.4Å; R384-I388 PolarHBondContact O-N 2.91Å; E385-I388 PolarHBondContact O-N 2.99Å; R386-I388 PolarHBondContact O-N 2.98Å; I388-L390 VanDerWaalsContact C-N 3.31Å; I388-L390 PolarHBondContact O-N 3.01Å; I388-I391 PolarHBondContact O-N 2.98Å; I388-K392 HydrophobicContact CG2-CD 4.36Å; I388-K392 WeakPolarHBondContact O-CG 3.42Å; I388-K392 PolarHBondContact O-N 2.84Å |
| 389 | R | 98.4 | Very high | 98.5 | Very high | 139 Ų | 139 | 109.6 Ų | 109.6 | 53% | 0.525 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.3 | -43.2 | 175.3 | -73.6 | -176.4 | -174.6 | 102 | -1.1 | 112 | E385 R386 K392 S393 | E385-R389 WeakPolarHBondContact O-CG 3.4Å; E385-R389 PolarHBondContact O-N 3.02Å; E385-R389 IonicContact OE1-CZ 3.37Å; E385-R389 IonicContact OE1-NH1 3.5Å; E385-R389 IonicContact OE1-NH2 2.67Å; E385-R389 PolarHBondContact OE1-NH2 3.44Å; E385-R389 IonicContact OE2-CZ 3.54Å; E385-R389 IonicContact OE2-NH1 2.88Å; E385-R389 PolarHBondContact OE2-NH1 3.42Å; E385-R389 IonicContact OE2-NH2 3.33Å; E385-R389 PolarHBondContact OE2-NH2 3.34Å; R386-R389 PolarHBondContact O-N 2.71Å; R389-K392 PolarHBondContact O-N 3.34Å; R389-S393 PolarHBondContact O-N 3.26Å |
| 390 | L | 98.4 | Very high | 98.5 | Very high | 101 Ų | 101 | 112.4 Ų | 112.4 | 53% | 0.529 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.1 | -47.3 | 177.9 | 179 | 60.5 | 0 | 0 | 0 | 111.3 | R386 K387 I388 K392 S393 L394 | R386-L390 WeakPolarHBondContact O-CB 3.34Å; R386-L390 PolarHBondContact O-N 3.2Å; K387-L390 PolarHBondContact O-N 3.02Å; I388-L390 VanDerWaalsContact C-N 3.31Å; I388-L390 PolarHBondContact O-N 3.01Å; L390-K392 VanDerWaalsContact C-N 3.34Å; L390-K392 PolarHBondContact O-N 3.16Å; L390-S393 WeakPolarHBondContact O-CB 3.39Å; L390-S393 PolarHBondContact O-N 3.21Å; L390-L394 HydrophobicContact CD1-CD1 4.16Å; L390-L394 HydrophobicContact CD1-CG 4.16Å; L390-L394 HydrophobicContact CG-CD1 4.04Å; L390-L394 HydrophobicContact CG-CG 4.46Å; L390-L394 WeakPolarHBondContact O-CG 3.33Å; L390-L394 PolarHBondContact O-N 3.45Å |
| 391 | I | 98.4 | Very high | 98.5 | Very high | 75 Ų | 75 | 114.9 Ų | 114.9 | 39% | 0.385 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -55.9 | -49.5 | 176.4 | -69.7 | 165.5 | 0 | 0 | 0 | 110.5 | K387 I388 S393 L394 E395 | K387-I391 HydrophobicContact CG-CD1 4.14Å; K387-I391 WeakPolarHBondContact O-CG1 3.27Å; K387-I391 PolarHBondContact O-N 3.48Å; I388-I391 PolarHBondContact O-N 2.98Å; I391-S393 VanDerWaalsContact C-N 3.32Å; I391-S393 PolarHBondContact O-N 3.29Å; I391-L394 PolarHBondContact O-N 3.43Å; I391-E395 HydrophobicContact CG2-CG 4.35Å; I391-E395 WeakPolarHBondContact CG2-OE1 3.39Å; I391-E395 WeakPolarHBondContact O-CG 3.08Å; I391-E395 PolarHBondContact O-N 2.87Å |
| 392 | K | 98.5 | Very high | 98.5 | Very high | 138 Ų | 138 | 110.8 Ų | 110.8 | 60% | 0.6 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -60.4 | -38.6 | 178.1 | -71.3 | -178.9 | 175.9 | -171.6 | 0 | 113.3 | I388 R389 L390 K396 | I388-K392 HydrophobicContact CG2-CD 4.36Å; I388-K392 WeakPolarHBondContact O-CG 3.42Å; I388-K392 PolarHBondContact O-N 2.84Å; R389-K392 PolarHBondContact O-N 3.34Å; L390-K392 VanDerWaalsContact C-N 3.34Å; L390-K392 PolarHBondContact O-N 3.16Å; K392-K396 WeakPolarHBondContact O-CB 3.34Å; K392-K396 PolarHBondContact O-N 3.38Å; K392-K396 VanDerWaalsContact O-N 3.08Å |
| 393 | S | 98.4 | Very high | 98.5 | Very high | 57 Ų | 57 | 108.7 Ų | 108.7 | 40% | 0.399 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.9 | -48.8 | 175.4 | -166.3 | 0 | 0 | 0 | 0 | 110.6 | R389 L390 I391 E395 K396 D397 | R389-S393 PolarHBondContact O-N 3.26Å; L390-S393 WeakPolarHBondContact O-CB 3.39Å; L390-S393 PolarHBondContact O-N 3.21Å; I391-S393 VanDerWaalsContact C-N 3.32Å; I391-S393 PolarHBondContact O-N 3.29Å; S393-E395 VanDerWaalsContact C-N 3.33Å; S393-E395 PolarHBondContact O-N 3.43Å; S393-K396 WeakPolarHBondContact O-CB 3.41Å; S393-K396 PolarHBondContact O-N 3.47Å; S393-K396 VanDerWaalsContact O-N 3.16Å; S393-D397 PolarHBondContact O-N 3.32Å |
| 394 | L | 98.6 | Very high | 98.5 | Very high | 93 Ų | 93 | 107.8 Ų | 107.8 | 49% | 0.487 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.8 | -39.5 | 179.8 | -68.5 | 173.1 | 0 | 0 | 0 | 112 | L390 I391 D397 V398 | L390-L394 HydrophobicContact CD1-CD1 4.16Å; L390-L394 HydrophobicContact CD1-CG 4.16Å; L390-L394 HydrophobicContact CG-CD1 4.04Å; L390-L394 HydrophobicContact CG-CG 4.46Å; L390-L394 WeakPolarHBondContact O-CG 3.33Å; L390-L394 PolarHBondContact O-N 3.45Å; I391-L394 PolarHBondContact O-N 3.43Å; L394-D397 PolarHBondContact O-N 2.89Å; L394-V398 WeakPolarHBondContact O-CB 3.44Å; L394-V398 WeakPolarHBondContact O-CG2 3.47Å; L394-V398 PolarHBondContact O-N 3.46Å |
| 395 | E | 98.5 | Very high | 98.4 | Very high | 111 Ų | 111 | 103 Ų | 103 | 52% | 0.519 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.1 | -44.8 | 173.8 | -72.4 | 169.5 | 165.7 | 0 | 0 | 111.6 | I391 S393 V398 I399 | I391-E395 HydrophobicContact CG2-CG 4.35Å; I391-E395 WeakPolarHBondContact CG2-OE1 3.39Å; I391-E395 WeakPolarHBondContact O-CG 3.08Å; I391-E395 PolarHBondContact O-N 2.87Å; S393-E395 VanDerWaalsContact C-N 3.33Å; S393-E395 PolarHBondContact O-N 3.43Å; E395-V398 PolarHBondContact O-N 3.39Å; E395-I399 VanDerWaalsContact O-CG1 3.31Å; E395-I399 WeakPolarHBondContact O-CG1 3.44Å; E395-I399 PolarHBondContact O-N 2.82Å; E395-I399 VanDerWaalsContact O-N 3.08Å |
| 396 | K | 98.6 | Very high | 98.4 | Very high | 153 Ų | 153 | 105.3 Ų | 105.3 | 67% | 0.665 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.5 | -45.2 | 175.2 | -177.3 | -176.2 | 176.2 | -177.7 | 0 | 111.6 | K392 S393 I399 H400 | K392-K396 WeakPolarHBondContact O-CB 3.34Å; K392-K396 PolarHBondContact O-N 3.38Å; K392-K396 VanDerWaalsContact O-N 3.08Å; S393-K396 WeakPolarHBondContact O-CB 3.41Å; S393-K396 PolarHBondContact O-N 3.47Å; S393-K396 VanDerWaalsContact O-N 3.16Å; K396-I399 PolarHBondContact O-N 2.76Å; K396-H400 PolarHBondContact O-N 3.12Å |
| 397 | D | 98.5 | Very high | 98.4 | Very high | 71 Ų | 71 | 98.9 Ų | 98.9 | 38% | 0.38 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.3 | -42.5 | -179 | -63.7 | -22.7 | 0 | 0 | 0 | 110.7 | S393 L394 I399 H400 L401 | S393-D397 PolarHBondContact O-N 3.32Å; L394-D397 PolarHBondContact O-N 2.89Å; D397-I399 VanDerWaalsContact C-N 3.33Å; D397-I399 PolarHBondContact O-N 3.28Å; D397-H400 PolarHBondContact O-N 3.03Å; D397-L401 HydrophobicContact CB-CD1 4.45Å; D397-L401 WeakPolarHBondContact O-CB 3.39Å; D397-L401 WeakPolarHBondContact O-CD1 3.46Å; D397-L401 PolarHBondContact O-N 3.35Å |
| 398 | V | 98.7 | Very high | 98.4 | Very high | 98 Ų | 98 | 96 Ų | 96 | 59% | 0.594 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -59.5 | -42.9 | 175.1 | 167.2 | 0 | 0 | 0 | 0 | 111.5 | L394 E395 S402 | L394-V398 WeakPolarHBondContact O-CB 3.44Å; L394-V398 WeakPolarHBondContact O-CG2 3.47Å; L394-V398 PolarHBondContact O-N 3.46Å; E395-V398 PolarHBondContact O-N 3.39Å; V398-S402 WeakPolarHBondContact O-CB 3.39Å; V398-S402 PolarHBondContact O-N 3.46Å |
| 399 | I | 98.3 | Very high | 98.4 | Very high | 102 Ų | 102 | 100 Ų | 100 | 52% | 0.523 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.7 | -52.9 | 175.1 | -67.6 | 164.5 | 0 | 0 | 0 | 109.6 | E395 K396 D397 L401 S402 E403 | E395-I399 VanDerWaalsContact O-CG1 3.31Å; E395-I399 WeakPolarHBondContact O-CG1 3.44Å; E395-I399 PolarHBondContact O-N 2.82Å; E395-I399 VanDerWaalsContact O-N 3.08Å; K396-I399 PolarHBondContact O-N 2.76Å; D397-I399 VanDerWaalsContact C-N 3.33Å; D397-I399 PolarHBondContact O-N 3.28Å; I399-L401 PolarHBondContact O-N 3.45Å; I399-S402 WeakPolarHBondContact O-CB 3.27Å; I399-S402 PolarHBondContact O-N 3.33Å; I399-S402 VanDerWaalsContact O-N 3.14Å; I399-E403 HydrophobicContact CG2-CG 4.46Å; I399-E403 WeakPolarHBondContact O-CG 3.33Å; I399-E403 PolarHBondContact O-N 3.34Å |
| 400 | H | 98.3 | Very high | 98.4 | Very high | 114 Ų | 114 | 97.8 Ų | 97.8 | 53% | 0.528 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -56.2 | -51 | 179.7 | 178.1 | -83.8 | 0 | 0 | 0 | 112.5 | K396 D397 S402 E403 E404 | K396-H400 PolarHBondContact O-N 3.12Å; D397-H400 PolarHBondContact O-N 3.03Å; H400-S402 VanDerWaalsContact C-N 3.28Å; H400-S402 PolarHBondContact O-N 3.13Å; H400-E403 PolarHBondContact O-N 3.17Å; H400-E404 IonicContact CE1-OE2 3.53Å; H400-E404 IonicContact ND1-OE2 3.87Å; H400-E404 WeakPolarHBondContact O-CB 3.4Å; H400-E404 PolarHBondContact O-N 3Å |
| 401 | L | 98.4 | Very high | 98.4 | Very high | 92 Ų | 92 | 101.6 Ų | 101.6 | 48% | 0.482 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.1 | -35.5 | 178.2 | -83.6 | 147.3 | 0 | 0 | 0 | 112.2 | D397 I399 N405 | D397-L401 HydrophobicContact CB-CD1 4.45Å; D397-L401 WeakPolarHBondContact O-CB 3.39Å; D397-L401 WeakPolarHBondContact O-CD1 3.46Å; D397-L401 PolarHBondContact O-N 3.35Å; I399-L401 PolarHBondContact O-N 3.45Å; L401-N405 VanDerWaalsContact O-CB 3.26Å; L401-N405 WeakPolarHBondContact O-CB 3.31Å; L401-N405 PolarHBondContact O-N 3.29Å; L401-N405 PolarHBondContact O-ND2 2.9Å |
| 402 | S | 98.2 | Very high | 98.4 | Very high | 75 Ų | 75 | 102.4 Ų | 102.4 | 52% | 0.524 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.5 | -43.7 | 175.8 | -174.6 | 0 | 0 | 0 | 0 | 111.6 | V398 I399 H400 N405 R406 | V398-S402 WeakPolarHBondContact O-CB 3.39Å; V398-S402 PolarHBondContact O-N 3.46Å; I399-S402 WeakPolarHBondContact O-CB 3.27Å; I399-S402 PolarHBondContact O-N 3.33Å; I399-S402 VanDerWaalsContact O-N 3.14Å; H400-S402 VanDerWaalsContact C-N 3.28Å; H400-S402 PolarHBondContact O-N 3.13Å; S402-N405 PolarHBondContact O-N 2.94Å; S402-R406 WeakPolarHBondContact O-CB 3.48Å; S402-R406 PolarHBondContact O-N 2.84Å |
| 403 | E | 98.3 | Very high | 98.3 | Very high | 96 Ų | 96 | 98.7 Ų | 98.7 | 45% | 0.449 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.5 | -42.3 | 177.5 | -65.1 | -168.1 | 139.2 | 0 | 0 | 112.6 | I399 H400 R406 A407 | I399-E403 HydrophobicContact CG2-CG 4.46Å; I399-E403 WeakPolarHBondContact O-CG 3.33Å; I399-E403 PolarHBondContact O-N 3.34Å; H400-E403 PolarHBondContact O-N 3.17Å; E403-R406 WeakPolarHBondContact O-CB 3.4Å; E403-R406 PolarHBondContact O-N 2.95Å; E403-R406 IonicContact OE1-NH2 3.41Å; E403-R406 PolarHBondContact OE1-NH2 3.34Å; E403-A407 PolarHBondContact O-N 2.86Å |
| 404 | E | 98.2 | Very high | 98.3 | Very high | 67 Ų | 67 | 104.5 Ų | 104.5 | 31% | 0.313 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.8 | -47.8 | 175.1 | -172.4 | -176.8 | 170.9 | 0 | 0 | 111.1 | H400 R406 A407 L408 | H400-E404 IonicContact CE1-OE2 3.53Å; H400-E404 IonicContact ND1-OE2 3.87Å; H400-E404 WeakPolarHBondContact O-CB 3.4Å; H400-E404 PolarHBondContact O-N 3Å; E404-R406 VanDerWaalsContact C-N 3.29Å; E404-R406 PolarHBondContact O-N 3.2Å; E404-A407 WeakPolarHBondContact O-CB 3.17Å; E404-A407 PolarHBondContact O-N 3.47Å; E404-A407 VanDerWaalsContact O-N 3.1Å; E404-L408 HydrophobicContact CG-CD1 4.27Å; E404-L408 WeakPolarHBondContact O-CG 3.18Å; E404-L408 PolarHBondContact O-N 2.98Å |
| 405 | N | 98 | Very high | 98.3 | Very high | 73 Ų | 73 | 103 Ų | 103 | 39% | 0.39 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.3 | -41.1 | 175.4 | -87.3 | -59 | 0 | 0 | 0 | 112 | L401 S402 L408 R409 | L401-N405 VanDerWaalsContact O-CB 3.26Å; L401-N405 WeakPolarHBondContact O-CB 3.31Å; L401-N405 PolarHBondContact O-N 3.29Å; L401-N405 PolarHBondContact O-ND2 2.9Å; S402-N405 PolarHBondContact O-N 2.94Å; N405-L408 PolarHBondContact O-N 3.36Å; N405-R409 WeakPolarHBondContact O-CB 3.49Å; N405-R409 VanDerWaalsContact O-CG 3.25Å; N405-R409 WeakPolarHBondContact O-CG 3.5Å; N405-R409 PolarHBondContact O-N 3.41Å |
| 406 | R | 98.3 | Very high | 98.3 | Very high | 138 Ų | 138 | 104.3 Ų | 104.3 | 52% | 0.521 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.9 | -45.6 | 173.9 | 178.5 | -178 | 64.6 | -159.5 | -2.5 | 110.9 | S402 E403 E404 R409 N410 | S402-R406 WeakPolarHBondContact O-CB 3.48Å; S402-R406 PolarHBondContact O-N 2.84Å; E403-R406 WeakPolarHBondContact O-CB 3.4Å; E403-R406 PolarHBondContact O-N 2.95Å; E403-R406 IonicContact OE1-NH2 3.41Å; E403-R406 PolarHBondContact OE1-NH2 3.34Å; E404-R406 VanDerWaalsContact C-N 3.29Å; E404-R406 PolarHBondContact O-N 3.2Å; R406-R409 PolarHBondContact O-N 2.83Å; R406-N410 VanDerWaalsContact O-CG 3.23Å; R406-N410 PolarHBondContact O-N 3.33Å; R406-N410 PolarHBondContact O-ND2 2.89Å |
| 407 | A | 98.4 | Very high | 98.2 | Very high | 49 Ų | 49 | 102.2 Ų | 102.2 | 41% | 0.405 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.3 | -43.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | E403 E404 N410 R411 | E403-A407 PolarHBondContact O-N 2.86Å; E404-A407 WeakPolarHBondContact O-CB 3.17Å; E404-A407 PolarHBondContact O-N 3.47Å; E404-A407 VanDerWaalsContact O-N 3.1Å; A407-N410 PolarHBondContact O-N 2.54Å; A407-R411 WeakPolarHBondContact O-CG 3.21Å; A407-R411 PolarHBondContact O-N 3.47Å |
| 408 | L | 98.3 | Very high | 98.2 | Very high | 82 Ų | 82 | 105 Ų | 105 | 43% | 0.429 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.6 | -42.9 | 176.8 | -70.8 | 174 | 0 | 0 | 0 | 111.9 | E404 N405 N410 R411 L412 | E404-L408 HydrophobicContact CG-CD1 4.27Å; E404-L408 WeakPolarHBondContact O-CG 3.18Å; E404-L408 PolarHBondContact O-N 2.98Å; N405-L408 PolarHBondContact O-N 3.36Å; L408-N410 VanDerWaalsContact C-N 3.33Å; L408-N410 PolarHBondContact O-N 2.93Å; L408-R411 PolarHBondContact O-N 2.96Å; L408-L412 WeakPolarHBondContact O-CB 3.43Å; L408-L412 PolarHBondContact O-N 3.36Å |
| 409 | R | 98.1 | Very high | 98.1 | Very high | 176 Ų | 176 | 103.7 Ų | 103.7 | 66% | 0.664 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -60.3 | -42.1 | 174 | -74.7 | 174.6 | -178.5 | 158.6 | 1.7 | 111.9 | N405 R406 L412 S413 | N405-R409 WeakPolarHBondContact O-CB 3.49Å; N405-R409 VanDerWaalsContact O-CG 3.25Å; N405-R409 WeakPolarHBondContact O-CG 3.5Å; N405-R409 PolarHBondContact O-N 3.41Å; R406-R409 PolarHBondContact O-N 2.83Å; R409-L412 PolarHBondContact O-N 3.08Å; R409-S413 WeakPolarHBondContact O-CB 3.4Å; R409-S413 PolarHBondContact O-N 3.03Å |
| 410 | N | 98.4 | Very high | 98.1 | Very high | 93 Ų | 93 | 103.7 Ų | 103.7 | 50% | 0.497 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.5 | -42.5 | 175.8 | -70.9 | -16.2 | 0 | 0 | 0 | 112 | R406 A407 L408 S413 R414 | R406-N410 VanDerWaalsContact O-CG 3.23Å; R406-N410 PolarHBondContact O-N 3.33Å; R406-N410 PolarHBondContact O-ND2 2.89Å; A407-N410 PolarHBondContact O-N 2.54Å; L408-N410 VanDerWaalsContact C-N 3.33Å; L408-N410 PolarHBondContact O-N 2.93Å; N410-S413 PolarHBondContact O-N 2.88Å; N410-R414 WeakPolarHBondContact O-CG 3.3Å; N410-R414 PolarHBondContact O-N 2.96Å |
| 411 | R | 98.2 | Very high | 98 | Very high | 181 Ų | 181 | 108 Ų | 108 | 68% | 0.683 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.4 | -44.7 | 175.6 | -72.4 | 174.8 | 66.6 | 178 | 1.2 | 111.8 | A407 L408 S413 R414 S415 | A407-R411 WeakPolarHBondContact O-CG 3.21Å; A407-R411 PolarHBondContact O-N 3.47Å; L408-R411 PolarHBondContact O-N 2.96Å; R411-S413 VanDerWaalsContact C-N 3.35Å; R411-R414 PolarHBondContact O-N 2.83Å; R411-S415 WeakPolarHBondContact O-CB 3.38Å; R411-S415 PolarHBondContact O-N 2.9Å |
| 412 | L | 98.4 | Very high | 98 | Very high | 92 Ų | 92 | 108.8 Ų | 108.8 | 48% | 0.482 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.8 | -43.5 | 176.6 | -179.3 | 62.2 | 0 | 0 | 0 | 111.3 | L408 R409 S415 R416 | L408-L412 WeakPolarHBondContact O-CB 3.43Å; L408-L412 PolarHBondContact O-N 3.36Å; R409-L412 PolarHBondContact O-N 3.08Å; L412-S415 PolarHBondContact O-N 2.92Å; L412-R416 HydrophobicContact CD1-CG 4.37Å; L412-R416 WeakPolarHBondContact O-CB 3.31Å; L412-R416 VanDerWaalsContact O-CG 3.28Å; L412-R416 WeakPolarHBondContact O-CG 3.33Å; L412-R416 PolarHBondContact O-N 2.59Å |
| 413 | S | 98.1 | Very high | 97.8 | Very high | 60 Ų | 60 | 110.8 Ų | 110.8 | 42% | 0.42 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.5 | -47.8 | 176.4 | 175.9 | 0 | 0 | 0 | 0 | 111.8 | R409 N410 R411 S415 R416 I417 | R409-S413 WeakPolarHBondContact O-CB 3.4Å; R409-S413 PolarHBondContact O-N 3.03Å; N410-S413 PolarHBondContact O-N 2.88Å; R411-S413 VanDerWaalsContact C-N 3.35Å; S413-S415 PolarHBondContact O-N 3.28Å; S413-R416 PolarHBondContact O-N 3.41Å; S413-I417 WeakPolarHBondContact O-CG1 3.38Å; S413-I417 PolarHBondContact O-N 3.35Å |
| 414 | R | 98.1 | Very high | 97.7 | Very high | 179 Ų | 179 | 111 Ų | 111 | 68% | 0.675 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -57.8 | -49.1 | 175.8 | -72.6 | 174 | -177.9 | -114.9 | 1.4 | 112.1 | N410 R411 R416 I417 E418 | N410-R414 WeakPolarHBondContact O-CG 3.3Å; N410-R414 PolarHBondContact O-N 2.96Å; R411-R414 PolarHBondContact O-N 2.83Å; R414-R416 VanDerWaalsContact C-N 3.34Å; R414-R416 PolarHBondContact O-N 3.48Å; R414-I417 PolarHBondContact O-N 3.37Å; R414-E418 WeakPolarHBondContact O-CG 3.32Å; R414-E418 PolarHBondContact O-N 2.91Å |
| 415 | S | 97.8 | Very high | 97.4 | Very high | 61 Ų | 61 | 113.5 Ų | 113.5 | 43% | 0.427 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.2 | -39.2 | 179.1 | -179.2 | 0 | 0 | 0 | 0 | 112.3 | R411 L412 S413 I417 E418 V419 | R411-S415 WeakPolarHBondContact O-CB 3.38Å; R411-S415 PolarHBondContact O-N 2.9Å; L412-S415 PolarHBondContact O-N 2.92Å; S413-S415 PolarHBondContact O-N 3.28Å; S415-I417 PolarHBondContact O-N 3.02Å; S415-E418 PolarHBondContact O-N 2.67Å; S415-V419 WeakPolarHBondContact O-CG2 3.49Å; S415-V419 PolarHBondContact O-N 3.31Å |
| 416 | R | 98 | Very high | 97.1 | Very high | 139 Ų | 139 | 113.5 Ų | 113.5 | 53% | 0.525 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.3 | -43.2 | 173.8 | -76.4 | 178.7 | 179.5 | -153.8 | 0.5 | 112 | L412 S413 R414 V419 E420 | L412-R416 HydrophobicContact CD1-CG 4.37Å; L412-R416 WeakPolarHBondContact O-CB 3.31Å; L412-R416 VanDerWaalsContact O-CG 3.28Å; L412-R416 WeakPolarHBondContact O-CG 3.33Å; L412-R416 PolarHBondContact O-N 2.59Å; S413-R416 PolarHBondContact O-N 3.41Å; R414-R416 VanDerWaalsContact C-N 3.34Å; R414-R416 PolarHBondContact O-N 3.48Å; R416-V419 PolarHBondContact O-N 2.85Å; R416-E420 WeakPolarHBondContact O-CB 3.22Å; R416-E420 PolarHBondContact O-N 3.4Å |
| 417 | I | 97.6 | Very high | 96.8 | Very high | 108 Ų | 108 | 110.3 Ų | 110.3 | 55% | 0.554 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.9 | -42.1 | 177 | -66.9 | 163.9 | 0 | 0 | 0 | 110.9 | S413 R414 S415 E420 R421 | S413-I417 WeakPolarHBondContact O-CG1 3.38Å; S413-I417 PolarHBondContact O-N 3.35Å; R414-I417 PolarHBondContact O-N 3.37Å; S415-I417 PolarHBondContact O-N 3.02Å; I417-E420 PolarHBondContact O-N 2.81Å; I417-R421 VanDerWaalsContact O-CB 3.28Å; I417-R421 WeakPolarHBondContact O-CB 3.28Å; I417-R421 PolarHBondContact O-N 2.76Å |
| 418 | E | 97.1 | Very high | 96.4 | Very high | 130 Ų | 130 | 111 Ų | 111 | 61% | 0.607 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63 | -44.1 | 176.6 | -73.4 | 170.7 | -165.5 | 0 | 0 | 112.1 | R414 S415 R421 L422 | R414-E418 WeakPolarHBondContact O-CG 3.32Å; R414-E418 PolarHBondContact O-N 2.91Å; S415-E418 PolarHBondContact O-N 2.67Å; E418-R421 PolarHBondContact O-N 2.95Å; E418-L422 WeakPolarHBondContact O-CB 3.49Å; E418-L422 PolarHBondContact O-N 2.72Å |
| 419 | V | 98.1 | Very high | 96 | Very high | 71 Ų | 71 | 110.2 Ų | 110.2 | 43% | 0.43 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62 | -44.6 | 175.3 | 169.7 | 0 | 0 | 0 | 0 | 110.8 | S415 R416 L422 K423 | S415-V419 WeakPolarHBondContact O-CG2 3.49Å; S415-V419 PolarHBondContact O-N 3.31Å; R416-V419 PolarHBondContact O-N 2.85Å; V419-L422 PolarHBondContact O-N 2.81Å; V419-K423 HydrophobicContact CG1-CD 4.17Å; V419-K423 HydrophobicContact CG1-CG 4.38Å; V419-K423 WeakPolarHBondContact O-CB 3.09Å; V419-K423 WeakPolarHBondContact O-CG 3.38Å; V419-K423 PolarHBondContact O-N 3.48Å |
| 420 | E | 97.5 | Very high | 95.5 | Very high | 102 Ų | 102 | 106.7 Ų | 106.7 | 48% | 0.477 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.4 | -40.6 | 179.9 | -164.3 | 55.9 | -143.1 | 0 | 0 | 111.9 | R416 I417 L422 K423 M424 | R416-E420 WeakPolarHBondContact O-CB 3.22Å; R416-E420 PolarHBondContact O-N 3.4Å; I417-E420 PolarHBondContact O-N 2.81Å; E420-L422 VanDerWaalsContact C-N 3.3Å; E420-L422 PolarHBondContact O-N 3.49Å; E420-K423 PolarHBondContact O-N 3.43Å; E420-M424 WeakPolarHBondContact O-CB 3.34Å; E420-M424 PolarHBondContact O-N 2.74Å |
| 421 | R | 96.9 | Very high | 95 | Very high | 203 Ų | 203 | 108.3 Ų | 108.3 | 77% | 0.766 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -58.1 | -43.7 | 171.4 | 179.8 | -177.1 | 175 | 175.9 | -0 | 111.4 | I417 E418 F425 | I417-R421 VanDerWaalsContact O-CB 3.28Å; I417-R421 WeakPolarHBondContact O-CB 3.28Å; I417-R421 PolarHBondContact O-N 2.76Å; E418-R421 PolarHBondContact O-N 2.95Å; R421-F425 WeakPolarHBondContact O-CB 3.16Å; R421-F425 PolarHBondContact O-N 3.31Å |
| 422 | L | 96.7 | Very high | 94.3 | Very high | 109 Ų | 109 | 107.2 Ų | 107.2 | 57% | 0.571 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -69.7 | -41.4 | 179.5 | -175.2 | 61.5 | 0 | 0 | 0 | 111.8 | E418 V419 E420 M424 F425 V426 | E418-L422 WeakPolarHBondContact O-CB 3.49Å; E418-L422 PolarHBondContact O-N 2.72Å; V419-L422 PolarHBondContact O-N 2.81Å; E420-L422 VanDerWaalsContact C-N 3.3Å; E420-L422 PolarHBondContact O-N 3.49Å; L422-M424 VanDerWaalsContact C-N 3.35Å; L422-M424 PolarHBondContact O-N 2.74Å; L422-F425 HydrophobicContact CD1-CD1 4.46Å; L422-F425 WeakPolarHBondContact O-CB 3.29Å; L422-F425 PolarHBondContact O-N 3.29Å; L422-V426 WeakPolarHBondContact O-CG2 3.16Å; L422-V426 PolarHBondContact O-N 2.76Å |
| 423 | K | 96.1 | Very high | 92.9 | Very high | 117 Ų | 117 | 109.6 Ų | 109.6 | 51% | 0.509 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -58 | -48.4 | 172.7 | -76.4 | 176.5 | 177.4 | -179.1 | 0 | 111.1 | V419 E420 F425 V426 V427 | V419-K423 HydrophobicContact CG1-CD 4.17Å; V419-K423 HydrophobicContact CG1-CG 4.38Å; V419-K423 WeakPolarHBondContact O-CB 3.09Å; V419-K423 WeakPolarHBondContact O-CG 3.38Å; V419-K423 PolarHBondContact O-N 3.48Å; E420-K423 PolarHBondContact O-N 3.43Å; K423-F425 VanDerWaalsContact C-N 3.28Å; K423-F425 PolarHBondContact O-N 3.24Å; K423-V426 PolarHBondContact O-N 3.3Å; K423-V426 VanDerWaalsContact O-N 3.16Å; K423-V427 WeakPolarHBondContact O-CG2 3.2Å; K423-V427 PolarHBondContact O-N 3.28Å |
| 424 | M | 94.2 | Very high | 91.6 | Very high | 100 Ų | 100 | 107.9 Ų | 107.9 | 49% | 0.493 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.1 | -41.3 | 176.4 | -171.2 | 58.9 | 63.6 | 0 | 0 | 111.4 | E420 L422 V427 N428 | E420-M424 WeakPolarHBondContact O-CB 3.34Å; E420-M424 PolarHBondContact O-N 2.74Å; L422-M424 VanDerWaalsContact C-N 3.35Å; L422-M424 PolarHBondContact O-N 2.74Å; M424-V427 PolarHBondContact O-N 2.94Å; M424-N428 WeakPolarHBondContact O-CB 3.49Å; M424-N428 PolarHBondContact O-N 3.07Å; M424-N428 PolarHBondContact O-ND2 2.77Å |
| 425 | F | 92.7 | Very high | 90.3 | Very high | 120 Ų | 120 | 104.5 Ų | 104.5 | 53% | 0.526 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.3 | -45.2 | 174.9 | -178.8 | -97 | 0 | 0 | 0 | 112.3 | R421 L422 K423 N428 H429 | R421-F425 WeakPolarHBondContact O-CB 3.16Å; R421-F425 PolarHBondContact O-N 3.31Å; L422-F425 HydrophobicContact CD1-CD1 4.46Å; L422-F425 WeakPolarHBondContact O-CB 3.29Å; L422-F425 PolarHBondContact O-N 3.29Å; K423-F425 VanDerWaalsContact C-N 3.28Å; K423-F425 PolarHBondContact O-N 3.24Å; F425-N428 PolarHBondContact O-N 3.25Å; F425-H429 AromaticContact CD1-CD2 3.78Å; F425-H429 AromaticContact CE1-CD2 3.4Å; F425-H429 WeakPolarHBondContact CE1-CD2 3.17Å; F425-H429 AromaticContact CE1-NE2 3.52Å; F425-H429 AromaticContact CE2-CD2 3.73Å; F425-H429 AromaticContact CE2-NE2 3.4Å; F425-H429 WeakPolarHBondContact CE2-NE2 3.38Å; F425-H429 AromaticContact CZ-CD2 3.38Å; F425-H429 WeakPolarHBondContact CZ-CD2 3.36Å; F425-H429 AromaticContact CZ-NE2 3.01Å; F425-H429 WeakPolarHBondContact CZ-NE2 3.24Å; F425-H429 PolarHBondContact O-CD2 2.93Å; F425-H429 VanDerWaalsContact O-CD2 3.32Å; F425-H429 PolarHBondContact O-N 2.9Å; F425-H429 VanDerWaalsContact O-N 3.09Å |
| 426 | V | 92.3 | Very high | 88.9 | Confident | 73 Ų | 73 | 105 Ų | 105 | 44% | 0.442 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.8 | -45.8 | 177.4 | 172.8 | 0 | 0 | 0 | 0 | 111.5 | L422 K423 N428 H429 L430 | L422-V426 WeakPolarHBondContact O-CG2 3.16Å; L422-V426 PolarHBondContact O-N 2.76Å; K423-V426 PolarHBondContact O-N 3.3Å; K423-V426 VanDerWaalsContact O-N 3.16Å; V426-N428 PolarHBondContact O-N 3.45Å; V426-H429 PolarHBondContact O-N 3.29Å; V426-H429 VanDerWaalsContact O-N 3.12Å; V426-L430 HydrophobicContact CG1-CD1 4.19Å; V426-L430 WeakPolarHBondContact O-CG 3.37Å; V426-L430 PolarHBondContact O-N 2.83Å |
| 427 | V | 91.2 | Very high | 87.2 | Confident | 72 Ų | 72 | 103.1 Ų | 103.1 | 44% | 0.436 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.8 | -47.1 | 177.3 | 172.5 | 0 | 0 | 0 | 0 | 110.8 | K423 M424 H429 L430 D431 | K423-V427 WeakPolarHBondContact O-CG2 3.2Å; K423-V427 PolarHBondContact O-N 3.28Å; M424-V427 PolarHBondContact O-N 2.94Å; V427-H429 PolarHBondContact O-N 3.5Å; V427-L430 PolarHBondContact O-N 3.13Å; V427-L430 VanDerWaalsContact O-N 3.07Å; V427-D431 PolarHBondContact O-N 3.04Å |
| 428 | N | 90 | Very high | 85.5 | Confident | 64 Ų | 64 | 102.6 Ų | 102.6 | 34% | 0.342 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.1 | -30.6 | 175.9 | -82.3 | -70.2 | 0 | 0 | 0 | 113.5 | M424 F425 V426 K432 | M424-N428 WeakPolarHBondContact O-CB 3.49Å; M424-N428 PolarHBondContact O-N 3.07Å; M424-N428 PolarHBondContact O-ND2 2.77Å; F425-N428 PolarHBondContact O-N 3.25Å; V426-N428 PolarHBondContact O-N 3.45Å; N428-K432 WeakPolarHBondContact O-CB 3.33Å; N428-K432 WeakPolarHBondContact O-CG 3.41Å; N428-K432 PolarHBondContact O-N 3.35Å |
| 429 | H | 89.4 | Confident | 83.8 | Confident | 64 Ų | 64 | 100.8 Ų | 100.8 | 30% | 0.296 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -76.5 | -31.2 | 175.9 | -93.4 | -76.6 | 0 | 0 | 0 | 113.1 | F425 V426 V427 C434 L437 | F425-H429 AromaticContact CD1-CD2 3.78Å; F425-H429 AromaticContact CE1-CD2 3.4Å; F425-H429 WeakPolarHBondContact CE1-CD2 3.17Å; F425-H429 AromaticContact CE1-NE2 3.52Å; F425-H429 AromaticContact CE2-CD2 3.73Å; F425-H429 AromaticContact CE2-NE2 3.4Å; F425-H429 WeakPolarHBondContact CE2-NE2 3.38Å; F425-H429 AromaticContact CZ-CD2 3.38Å; F425-H429 WeakPolarHBondContact CZ-CD2 3.36Å; F425-H429 AromaticContact CZ-NE2 3.01Å; F425-H429 WeakPolarHBondContact CZ-NE2 3.24Å; F425-H429 PolarHBondContact O-CD2 2.93Å; F425-H429 VanDerWaalsContact O-CD2 3.32Å; F425-H429 PolarHBondContact O-N 2.9Å; F425-H429 VanDerWaalsContact O-N 3.09Å; V426-H429 PolarHBondContact O-N 3.29Å; V426-H429 VanDerWaalsContact O-N 3.12Å; V427-H429 PolarHBondContact O-N 3.5Å; H429-C434 HydrophobicContact CB-CB 4.27Å; H429-C434 WeakPolarHBondContact ND1-CB 3.48Å; H429-C434 PolarHBondContact ND1-SG 3.03Å; H429-C434 WeakPolarHBondContact O-CB 3.07Å; H429-C434 PolarHBondContact O-N 3.46Å; H429-L437 HydrophobicContact CB-CD1 4.43Å |
| 430 | L | 88.1 | Confident | 82 | Confident | 103 Ų | 103 | 106.6 Ų | 106.6 | 54% | 0.539 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -72.1 | -42.5 | 173.6 | -68.2 | 170 | 0 | 0 | 0 | 111.1 | V426 V427 K432 D433 L437 | V426-L430 HydrophobicContact CG1-CD1 4.19Å; V426-L430 WeakPolarHBondContact O-CG 3.37Å; V426-L430 PolarHBondContact O-N 2.83Å; V427-L430 PolarHBondContact O-N 3.13Å; V427-L430 VanDerWaalsContact O-N 3.07Å; L430-K432 VanDerWaalsContact C-N 3.27Å; L430-K432 PolarHBondContact O-N 2.73Å; L430-D433 PolarHBondContact O-N 2.9Å; L430-L437 HydrophobicContact CD2-CD1 3.76Å; L430-L437 HydrophobicContact CG-CD1 4.41Å |
| 431 | D | 88.1 | Confident | 79.9 | Confident | 126 Ų | 126 | 108.2 Ų | 108.2 | 67% | 0.674 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -68.9 | -23 | 179.7 | -68.5 | -18.4 | 0 | 0 | 0 | 113.5 | V427 | V427-D431 PolarHBondContact O-N 3.04Å |
| 432 | K | 82.9 | Confident | 77.2 | Confident | 158 Ų | 158 | 106.9 Ų | 106.9 | 69% | 0.687 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.2 | 11.2 | -177.9 | -67.9 | -180 | -176.4 | -175.5 | 0 | 114.1 | N428 L430 C434 | N428-K432 WeakPolarHBondContact O-CB 3.33Å; N428-K432 WeakPolarHBondContact O-CG 3.41Å; N428-K432 PolarHBondContact O-N 3.35Å; L430-K432 VanDerWaalsContact C-N 3.27Å; L430-K432 PolarHBondContact O-N 2.73Å; K432-C434 PolarHBondContact O-N 2.81Å |
| 433 | D | 69.5 | Low | 76.2 | Confident | 142 Ų | 142 | 106.8 Ų | 106.8 | 76% | 0.759 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 44.5 | 58.6 | -175.4 | -71.2 | -40.7 | 0 | 0 | 0 | 112.2 | L430 P435 | L430-D433 PolarHBondContact O-N 2.9Å; D433-P435 WeakPolarHBondContact O-CD 3.14Å; D433-P435 VanDerWaalsContact O-N 3.16Å |
| 434 | C | 70.9 | Confident | 75.2 | Confident | 25 Ų | 25 | 106.2 Ų | 106.2 | 17% | 0.169 | 61% | 0.611 | C | S | . | * | trans | -58.9 | 123 | -179 | -173.2 | 0 | 0 | 0 | 0 | 110.4 | H429 K432 A436 L437 | H429-C434 HydrophobicContact CB-CB 4.27Å; H429-C434 WeakPolarHBondContact ND1-CB 3.48Å; H429-C434 PolarHBondContact ND1-SG 3.03Å; H429-C434 WeakPolarHBondContact O-CB 3.07Å; H429-C434 PolarHBondContact O-N 3.46Å; K432-C434 PolarHBondContact O-N 2.81Å; C434-A436 PolarHBondContact O-N 3.26Å; C434-L437 HydrophobicContact CB-CD1 4.47Å; C434-L437 PolarHBondContact O-N 2.73Å | ||
| 435 | P | 71 | Confident | 74.1 | Confident | 108 Ų | 108 | 106.6 Ų | 106.6 | 70% | 0.701 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -60.9 | -20.9 | -175.7 | 21 | -31.8 | 0 | 0 | 0 | 113 | D433 L437 S439 | D433-P435 WeakPolarHBondContact O-CD 3.14Å; D433-P435 VanDerWaalsContact O-N 3.16Å; P435-L437 VanDerWaalsContact C-N 3.34Å; P435-L437 PolarHBondContact O-N 3.04Å; P435-S439 PolarHBondContact O-N 3.32Å |
| 436 | A | 68.2 | Low | 73 | Confident | 71 Ų | 71 | 105.8 Ų | 105.8 | 59% | 0.587 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -66 | -32.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | C434 S439 | C434-A436 PolarHBondContact O-N 3.26Å; A436-S439 PolarHBondContact O-OG 3.11Å |
| 437 | L | 62.7 | Low | 71.8 | Confident | 99 Ų | 99 | 107.8 Ų | 107.8 | 52% | 0.518 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -85.5 | -30.6 | -179.8 | -64.8 | 174.7 | 0 | 0 | 0 | 112.3 | H429 L430 C434 P435 S439 | H429-L437 HydrophobicContact CB-CD1 4.43Å; L430-L437 HydrophobicContact CD2-CD1 3.76Å; L430-L437 HydrophobicContact CG-CD1 4.41Å; C434-L437 HydrophobicContact CB-CD1 4.47Å; C434-L437 PolarHBondContact O-N 2.73Å; P435-L437 VanDerWaalsContact C-N 3.34Å; P435-L437 PolarHBondContact O-N 3.04Å; L437-S439 VanDerWaalsContact C-N 3.3Å; L437-S439 PolarHBondContact O-N 3.23Å |
| 438 | S | 61.4 | Low | 70.5 | Confident | 98 Ų | 98 | 110.2 Ų | 110.2 | 69% | 0.685 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -71.3 | -22.1 | 178.7 | -169.5 | 0 | 0 | 0 | 0 | 113.2 | K440 | S438-K440 VanDerWaalsContact C-N 3.34Å; S438-K440 PolarHBondContact O-N 3.08Å |
| 439 | S | 61.3 | Low | 69.1 | Low | 92 Ų | 92 | 113.5 Ų | 113.5 | 64% | 0.643 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | 2.7 | -173.4 | 71 | 0 | 0 | 0 | 0 | 117.2 | P435 A436 L437 | P435-S439 PolarHBondContact O-N 3.32Å; A436-S439 PolarHBondContact O-OG 3.11Å; L437-S439 VanDerWaalsContact C-N 3.3Å; L437-S439 PolarHBondContact O-N 3.23Å |
| 440 | K | 59.9 | Low | 67.6 | Low | 192 Ų | 192 | 117.3 Ų | 117.3 | 84% | 0.835 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.7 | 9.9 | -177.4 | -95.4 | -170.1 | 177.9 | -173.2 | 0 | 115.8 | S438 | S438-K440 VanDerWaalsContact C-N 3.34Å; S438-K440 PolarHBondContact O-N 3.08Å |
| 441 | V | 53.5 | Low | 65.8 | Low | 137 Ų | 137 | 118.5 Ų | 118.5 | 83% | 0.83 | 71% | 0.711 | S | S | * | * | trans | -124.2 | 72.3 | 173.7 | -169.2 | 0 | 0 | 0 | 0 | 109 | ||||
| 442 | A | 40.7 | Very low | 63.8 | Low | 174 Ų | 174 | 117.8 Ų | 117.8 | 100% | 1.438 | 71% | 0.714 | S | S | * | * | trans | -150 | 0 | 164.7 | 0 | 0 | 0 | 0 | 0 | 109.5 |
Retrieved 442 of 442 residues in 51.8 ms
(Link to these results)