| 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 | 41.8 | Very low | 43.5 | Very low | 244 Ų | 244 | 150.4 Ų | 150.4 | 100% | 1.202 | 86% | 0.861 | S | S | * | * | 0 | 110.1 | 0 | -157.1 | 157.2 | 151.7 | 0 | 0 | 105.9 | |||||
| 2 | E | 40.8 | Very low | 43 | Very low | 193 Ų | 193 | 156.1 Ų | 156.1 | 90% | 0.902 | 87% | 0.869 | S | S | * | * | trans | -69 | 145 | -168.3 | -60.7 | 166.4 | 157.3 | 0 | 0 | 111 | ||||
| 3 | V | 46.4 | Very low | 42.7 | Very low | 147 Ų | 147 | 149.9 Ų | 149.9 | 89% | 0.891 | 85% | 0.851 | S | S | * | * | trans | -123.8 | 103.8 | 157.9 | -177.1 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 4 | A | 44.1 | Very low | 42.5 | Very low | 90 Ų | 90 | 151 Ų | 151 | 74% | 0.744 | 85% | 0.85 | S | S | * | * | trans | -66.8 | 133.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 5 | G | 43.7 | Very low | 42.5 | Very low | 70 Ų | 70 | 151 Ų | 151 | 72% | 0.722 | 84% | 0.84 | S | S | * | * | trans | -151.7 | 87.6 | 165.2 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 6 | L | 42.4 | Very low | 42.5 | Very low | 163 Ų | 163 | 146 Ų | 146 | 85% | 0.853 | 83% | 0.833 | S | S | * | * | trans | -59.5 | 133.3 | 179 | -87.5 | 98 | 0 | 0 | 0 | 111.2 | ||||
| 7 | Y | 48.6 | Very low | 42.4 | Very low | 225 Ų | 225 | 150.1 Ų | 150.1 | 88% | 0.882 | 83% | 0.832 | S | S | * | * | trans | -63.2 | 140.1 | 151.7 | -78.3 | -105.2 | 0 | 0 | 0 | 109 | ||||
| 8 | E | 48.1 | Very low | 42.3 | Very low | 185 Ų | 185 | 151.3 Ų | 151.3 | 86% | 0.864 | 84% | 0.837 | S | S | * | * | trans | -149.3 | 112.4 | 145.3 | -124.8 | -166.4 | -174 | 0 | 0 | 112 | ||||
| 9 | E | 42.9 | Very low | 41.9 | Very low | 189 Ų | 189 | 146.7 Ų | 146.7 | 88% | 0.883 | 83% | 0.828 | S | S | * | * | trans | -65.8 | 141.9 | 149.5 | -85.3 | -172.4 | 132.6 | 0 | 0 | 109.9 | ||||
| 10 | G | 41.4 | Very low | 41.7 | Very low | 75 Ų | 75 | 148.1 Ų | 148.1 | 77% | 0.773 | 83% | 0.831 | S | S | * | * | trans | 95.8 | 141.5 | 138.6 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 11 | G | 38.5 | Very low | 41.6 | Very low | 73 Ų | 73 | 148.8 Ų | 148.8 | 75% | 0.753 | 83% | 0.832 | S | S | * | * | trans | 116.2 | 79.8 | 152.5 | 0 | 0 | 0 | 0 | 0 | 116 | A13 | G11-A13 PolarHBondContact O-N 3.49Š| ||
| 12 | F | 37.8 | Very low | 41.4 | Very low | 219 Ų | 219 | 141.2 Ų | 141.2 | 96% | 0.961 | 81% | 0.808 | S | S | * | * | trans | -65 | 96.8 | 154.4 | -79.5 | -90.8 | 0 | 0 | 0 | 109.1 | ||||
| 13 | A | 39.2 | Very low | 41.6 | Very low | 76 Ų | 76 | 137.8 Ų | 137.8 | 63% | 0.628 | 80% | 0.802 | S | S | * | * | trans | -110.3 | 94.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | G11 H15 | G11-A13 PolarHBondContact O-N 3.49Å; A13-H15 PolarHBondContact O-N 2.98Å; A13-H15 PolarHBondContact O-ND1 2.58Å | ||
| 14 | I | 40 | Very low | 41.2 | Very low | 165 Ų | 165 | 139 Ų | 139 | 85% | 0.846 | 80% | 0.802 | S | S | * | * | trans | -67.3 | 113.4 | 170.7 | -59.6 | -173.2 | 0 | 0 | 0 | 108.2 | G16 | I14-G16 PolarHBondContact O-N 3.47Š| ||
| 15 | H | 41.5 | Very low | 41 | Very low | 151 Ų | 151 | 138.3 Ų | 138.3 | 70% | 0.699 | 80% | 0.804 | S | S | * | * | trans | -76.4 | 102.1 | 170.4 | -79.4 | 44 | 0 | 0 | 0 | 109.5 | A13 | A13-H15 PolarHBondContact O-N 2.98Å; A13-H15 PolarHBondContact O-ND1 2.58Å | ||
| 16 | G | 43.6 | Very low | 40.6 | Very low | 71 Ų | 71 | 138.8 Ų | 138.8 | 73% | 0.732 | 81% | 0.808 | S | S | * | * | trans | -65.5 | 132 | 159.8 | 0 | 0 | 0 | 0 | 0 | 110 | I14 | I14-G16 PolarHBondContact O-N 3.47Š| ||
| 17 | R | 39.7 | Very low | 40.7 | Very low | 216 Ų | 216 | 134.8 Ų | 134.8 | 82% | 0.815 | 81% | 0.807 | S | S | * | * | trans | -129.8 | 111.7 | 165.2 | -55.4 | -174.9 | 171 | -137.1 | -5.9 | 107 | ||||
| 18 | D | 40.2 | Very low | 40.4 | Very low | 171 Ų | 171 | 128 Ų | 128 | 91% | 0.914 | 80% | 0.797 | S | S | * | * | trans | -46.2 | 145.4 | 163 | -50.8 | -62.5 | 0 | 0 | 0 | 109.6 | ||||
| 19 | G | 36.3 | Very low | 40.2 | Very low | 65 Ų | 65 | 126.7 Ų | 126.7 | 67% | 0.67 | 79% | 0.785 | S | S | * | * | cis | 154.7 | 123.5 | 11.2 | 0 | 0 | 0 | 0 | 0 | 105 | ||||
| 20 | I | 37.1 | Very low | 40.2 | Very low | 173 Ų | 173 | 128.3 Ų | 128.3 | 89% | 0.887 | 78% | 0.783 | S | S | * | * | trans | -159.2 | 99 | 151.1 | -80.1 | 133.3 | 0 | 0 | 0 | 104.1 | ||||
| 21 | I | 39.2 | Very low | 40.9 | Very low | 164 Ų | 164 | 132.8 Ų | 132.8 | 84% | 0.841 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -100.2 | 118.8 | 169.8 | -66 | 173.9 | 0 | 0 | 0 | 106.5 | ||
| 22 | A | 37.1 | Very low | 41.2 | Very low | 85 Ų | 85 | 138.3 Ų | 138.3 | 70% | 0.702 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -102.3 | 139.6 | 151.4 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||
| 23 | P | 44.9 | Very low | 42.1 | Very low | 121 Ų | 121 | 131.2 Ų | 131.2 | 79% | 0.786 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 123.5 | -166.6 | 33.8 | -30.6 | 0 | 0 | 0 | 110.5 | ||
| 24 | I | 39.1 | Very low | 42.5 | Very low | 172 Ų | 172 | 131.9 Ų | 131.9 | 88% | 0.882 | 77% | 0.77 | S | S | * | * | trans | -113.5 | 111.3 | 155.6 | -63.5 | 178.6 | 0 | 0 | 0 | 105.7 | ||||
| 25 | G | 38.9 | Very low | 43 | Very low | 76 Ų | 76 | 127.7 Ų | 127.7 | 78% | 0.784 | 76% | 0.755 | S | S | * | * | trans | -66.1 | 160.9 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 26 | G | 35.5 | Very low | 43.3 | Very low | 79 Ų | 79 | 128.6 Ų | 128.6 | 81% | 0.814 | 76% | 0.762 | S | S | * | * | trans | 135.1 | 76.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 27 | G | 44.5 | Very low | 43.9 | Very low | 80 Ų | 80 | 131 Ų | 131 | 83% | 0.825 | 76% | 0.763 | S | S | * | * | trans | -66.8 | 137.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 28 | A | 43.2 | Very low | 44.6 | Very low | 82 Ų | 82 | 127.8 Ų | 127.8 | 68% | 0.678 | 76% | 0.757 | S | S | * | * | trans | -168.1 | 84.6 | 147.5 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 29 | Y | 43.4 | Very low | 44.9 | Very low | 157 Ų | 157 | 126.1 Ų | 126.1 | 62% | 0.616 | 75% | 0.747 | S | S | * | * | trans | -77.7 | 119.5 | 160.4 | 59.4 | -88.7 | 0 | 0 | 0 | 105.7 | R31 | Y29-R31 HydrophobicContact CD2-CB 3.94Å; Y29-R31 HydrophobicContact CD2-CG 3.65Å; Y29-R31 HydrophobicContact CE2-CB 3.87Å; Y29-R31 HydrophobicContact CE2-CG 3.59Å; Y29-R31 PolarHBondContact O-N 3.45Å; Y29-R31 PolarHBondContact OH-NH2 3.34Å | ||
| 30 | W | 43.2 | Very low | 45.5 | Very low | 223 Ų | 223 | 126.3 Ų | 126.3 | 85% | 0.845 | 75% | 0.749 | S | S | * | * | trans | -69.4 | 105.2 | 166 | -64.3 | 107.1 | 0 | 0 | 0 | 106.8 | ||||
| 31 | R | 55 | Low | 46 | Very low | 169 Ų | 169 | 123 Ų | 123 | 64% | 0.638 | 74% | 0.737 | S | S | * | * | trans | -80.8 | 135.4 | 170.5 | -114.5 | -156.1 | -64 | -102.9 | 9.7 | 108 | Y29 G33 | Y29-R31 HydrophobicContact CD2-CB 3.94Å; Y29-R31 HydrophobicContact CD2-CG 3.65Å; Y29-R31 HydrophobicContact CE2-CB 3.87Å; Y29-R31 HydrophobicContact CE2-CG 3.59Å; Y29-R31 PolarHBondContact O-N 3.45Å; Y29-R31 PolarHBondContact OH-NH2 3.34Å; R31-G33 VanDerWaalsContact C-N 3.34Å; R31-G33 PolarHBondContact O-N 3.14Å | ||
| 32 | L | 45.7 | Very low | 46.6 | Very low | 189 Ų | 189 | 124.1 Ų | 124.1 | 99% | 0.99 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | 95.1 | 174.9 | -162.6 | 73 | 0 | 0 | 0 | 108.3 | ||
| 33 | G | 56.7 | Low | 47.6 | Very low | 70 Ų | 70 | 128.5 Ų | 128.5 | 72% | 0.722 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 157.3 | -6 | -174.9 | 0 | 0 | 0 | 0 | 0 | 117.2 | R31 S35 | R31-G33 VanDerWaalsContact C-N 3.34Å; R31-G33 PolarHBondContact O-N 3.14Å; G33-S35 PolarHBondContact O-N 3.03Å |
| 34 | D | 48.1 | Very low | 48.1 | Very low | 91 Ų | 91 | 133.4 Ų | 133.4 | 49% | 0.487 | 75% | 0.747 | S | S | . | * | trans | -64.5 | 109.8 | 178.6 | -78.4 | -5.1 | 0 | 0 | 0 | 111.3 | ||||
| 35 | S | 50 | Low | 49.1 | Very low | 77 Ų | 77 | 133.7 Ų | 133.7 | 54% | 0.538 | 75% | 0.745 | S | S | . | * | trans | -68.9 | 140.7 | 175.6 | 175.8 | 0 | 0 | 0 | 0 | 110.1 | G33 T37 E38 | G33-S35 PolarHBondContact O-N 3.03Å; S35-T37 WeakPolarHBondContact CB-OG1 3.15Å; S35-T37 PolarHBondContact O-N 3.22Å; S35-T37 PolarHBondContact OG-OG1 3.34Å; S35-E38 PolarHBondContact O-N 3.04Å | ||
| 36 | M | 47.6 | Very low | 50.3 | Low | 170 Ų | 170 | 141 Ų | 141 | 84% | 0.837 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -57 | -5.6 | -178.7 | -65.6 | -144 | -43.6 | 0 | 0 | 115.6 | ||
| 37 | T | 56.9 | Low | 52 | Low | 122 Ų | 122 | 141.7 Ų | 141.7 | 75% | 0.748 | 75% | 0.747 | S | S | * | * | G | 310 helix | trans | -76.5 | -18.5 | 174.6 | 35.5 | 0 | 0 | 0 | 0 | 113.9 | S35 L39 | S35-T37 WeakPolarHBondContact CB-OG1 3.15Å; S35-T37 PolarHBondContact O-N 3.22Å; S35-T37 PolarHBondContact OG-OG1 3.34Å; T37-L39 VanDerWaalsContact C-N 3.26Å; T37-L39 PolarHBondContact O-N 3.44Å |
| 38 | E | 53.4 | Low | 53.2 | Low | 148 Ų | 148 | 144.1 Ų | 144.1 | 69% | 0.692 | 74% | 0.74 | S | S | * | * | G | 310 helix | trans | -88.3 | 21.2 | -179 | -148.1 | -173.9 | 177 | 0 | 0 | 113.9 | S35 | S35-E38 PolarHBondContact O-N 3.04Š|
| 39 | L | 47.1 | Very low | 54.6 | Low | 135 Ų | 135 | 145.6 Ų | 145.6 | 71% | 0.707 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -101.5 | 14.2 | 176.9 | -69.9 | 178.3 | 0 | 0 | 0 | 114 | T37 V41 | T37-L39 VanDerWaalsContact C-N 3.26Å; T37-L39 PolarHBondContact O-N 3.44Å; L39-V41 HydrophobicContact CB-CG2 3.82Å; L39-V41 WeakPolarHBondContact O-CG2 3.25Å; L39-V41 PolarHBondContact O-N 3.42Å; L39-V41 VanDerWaalsContact O-N 3.1Å |
| 40 | G | 49.6 | Very low | 55.7 | Low | 69 Ų | 69 | 144.6 Ų | 144.6 | 71% | 0.711 | 74% | 0.735 | S | S | * | * | trans | 59.5 | 26.9 | 174 | 0 | 0 | 0 | 0 | 0 | 114 | E42 | G40-E42 PolarHBondContact O-N 3.35Š| ||
| 41 | V | 47 | Very low | 57 | Low | 104 Ų | 104 | 136.7 Ų | 136.7 | 63% | 0.63 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -82.1 | 3 | -178.1 | -164.7 | 0 | 0 | 0 | 0 | 111.8 | L39 E43 | L39-V41 HydrophobicContact CB-CG2 3.82Å; L39-V41 WeakPolarHBondContact O-CG2 3.25Å; L39-V41 PolarHBondContact O-N 3.42Å; L39-V41 VanDerWaalsContact O-N 3.1Å; V41-E43 VanDerWaalsContact C-N 3.34Å; V41-E43 PolarHBondContact O-N 3.49Å |
| 42 | E | 52.3 | Low | 57.6 | Low | 187 Ų | 187 | 131.9 Ų | 131.9 | 87% | 0.874 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -70.4 | -22.4 | -173.1 | -166.2 | 176.2 | 166.1 | 0 | 0 | 113.9 | G40 | G40-E42 PolarHBondContact O-N 3.35Š|
| 43 | E | 57.7 | Low | 58.4 | Low | 177 Ų | 177 | 132 Ų | 132 | 83% | 0.827 | 70% | 0.699 | S | S | * | * | G | 310 helix | trans | -96.5 | 0.4 | -168.9 | -144.2 | -172.1 | 168.4 | 0 | 0 | 116 | V41 | V41-E43 VanDerWaalsContact C-N 3.34Å; V41-E43 PolarHBondContact O-N 3.49Å |
| 44 | R | 56 | Low | 58.8 | Low | 225 Ų | 225 | 135 Ų | 135 | 85% | 0.849 | 70% | 0.698 | S | S | * | * | trans | -138.9 | 43.8 | 179.4 | -58.1 | -171.4 | -163.1 | -89.3 | -4.7 | 114 | R46 | R44-R46 PolarHBondContact O-N 3.27Š| ||
| 45 | E | 59.1 | Low | 59.1 | Low | 178 Ų | 178 | 135.9 Ų | 135.9 | 83% | 0.832 | 70% | 0.703 | S | S | * | * | trans | -77.1 | 74.7 | 160.5 | -74.2 | -166.2 | 157.7 | 0 | 0 | 110.5 | ||||
| 46 | R | 65.2 | Low | 59.2 | Low | 229 Ų | 229 | 137 Ų | 137 | 86% | 0.864 | 71% | 0.711 | S | S | * | * | trans | -100.9 | 101.6 | 147.2 | -65.5 | -163.4 | -155.8 | -82.1 | -0.8 | 105.9 | R44 I48 | R44-R46 PolarHBondContact O-N 3.27Å; R46-I48 PolarHBondContact O-N 2.95Å | ||
| 47 | A | 71.4 | Confident | 59.2 | Low | 94 Ų | 94 | 133 Ų | 133 | 78% | 0.777 | 71% | 0.705 | S | S | * | * | trans | -49.9 | 137.7 | 165.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | D49 | A47-D49 PolarHBondContact O-N 3.06Š| ||
| 48 | I | 68.7 | Low | 58.8 | Low | 131 Ų | 131 | 134.2 Ų | 134.2 | 67% | 0.672 | 71% | 0.705 | S | S | * | * | trans | -60.7 | 112.8 | 176.2 | -62.5 | 170.1 | 0 | 0 | 0 | 106.8 | R46 F50 | R46-I48 PolarHBondContact O-N 2.95Å; I48-F50 HydrophobicContact CB-CD2 4.43Å; I48-F50 HydrophobicContact CB-CE2 3.83Å; I48-F50 HydrophobicContact CB-CZ 4.04Å; I48-F50 HydrophobicContact CG2-CD1 4.34Å; I48-F50 HydrophobicContact CG2-CD2 4.18Å; I48-F50 HydrophobicContact CG2-CE1 3.94Å; I48-F50 HydrophobicContact CG2-CE2 3.76Å; I48-F50 HydrophobicContact CG2-CG 4.47Å; I48-F50 HydrophobicContact CG2-CZ 3.62Å; I48-F50 WeakPolarHBondContact O-CD2 3.42Å; I48-F50 WeakPolarHBondContact O-CE2 3.33Å; I48-F50 PolarHBondContact O-N 3.05Å | ||
| 49 | D | 73.6 | Confident | 58.4 | Low | 113 Ų | 113 | 135.4 Ų | 135.4 | 60% | 0.604 | 71% | 0.71 | S | S | * | * | trans | -78 | 100.7 | 178.8 | -174.6 | 5.1 | 0 | 0 | 0 | 109.5 | A47 S51 | A47-D49 PolarHBondContact O-N 3.06Å; D49-S51 PolarHBondContact O-N 3.3Å; D49-S51 WeakPolarHBondContact OD1-CB 3.36Å; D49-S51 PolarHBondContact OD1-N 3.45Å; D49-S51 PolarHBondContact OD1-OG 2.97Å; D49-S51 PolarHBondContact OD2-OG 2.93Å | ||
| 50 | F | 65.5 | Low | 58 | Low | 135 Ų | 135 | 134.6 Ų | 134.6 | 59% | 0.592 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | -4.7 | 177.9 | -67.6 | -82.3 | 0 | 0 | 0 | 113 | I48 A52 Y53 L54 | I48-F50 HydrophobicContact CB-CD2 4.43Å; I48-F50 HydrophobicContact CB-CE2 3.83Å; I48-F50 HydrophobicContact CB-CZ 4.04Å; I48-F50 HydrophobicContact CG2-CD1 4.34Å; I48-F50 HydrophobicContact CG2-CD2 4.18Å; I48-F50 HydrophobicContact CG2-CE1 3.94Å; I48-F50 HydrophobicContact CG2-CE2 3.76Å; I48-F50 HydrophobicContact CG2-CG 4.47Å; I48-F50 HydrophobicContact CG2-CZ 3.62Å; I48-F50 WeakPolarHBondContact O-CD2 3.42Å; I48-F50 WeakPolarHBondContact O-CE2 3.33Å; I48-F50 PolarHBondContact O-N 3.05Å; F50-A52 VanDerWaalsContact C-N 3.25Å; F50-A52 PolarHBondContact O-N 3.4Å; F50-Y53 PolarHBondContact O-N 3.2Å; F50-L54 PolarHBondContact O-N 3.41Å |
| 51 | S | 70.2 | Confident | 57.5 | Low | 58 Ų | 58 | 136.6 Ų | 136.6 | 41% | 0.406 | 72% | 0.716 | S | S | . | * | H | α-helix | trans | -60.9 | -33.9 | -179.5 | 66 | 0 | 0 | 0 | 0 | 112.6 | D49 Y53 L54 D55 | D49-S51 PolarHBondContact O-N 3.3Å; D49-S51 WeakPolarHBondContact OD1-CB 3.36Å; D49-S51 PolarHBondContact OD1-N 3.45Å; D49-S51 PolarHBondContact OD1-OG 2.97Å; D49-S51 PolarHBondContact OD2-OG 2.93Å; S51-Y53 PolarHBondContact O-N 2.93Å; S51-L54 PolarHBondContact O-N 3.48Å; S51-D55 PolarHBondContact O-N 2.9Å |
| 52 | A | 67.1 | Low | 57.2 | Low | 67 Ų | 67 | 137.8 Ų | 137.8 | 55% | 0.554 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -57.6 | -23.9 | 175 | 0 | 0 | 0 | 0 | 0 | 114 | F50 | F50-A52 VanDerWaalsContact C-N 3.25Å; F50-A52 PolarHBondContact O-N 3.4Å |
| 53 | Y | 63.3 | Low | 56.4 | Low | 191 Ų | 191 | 137.9 Ų | 137.9 | 75% | 0.749 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -99.8 | -13.2 | 179.3 | -68.1 | -81.3 | 0 | 0 | 0 | 113.6 | F50 S51 | F50-Y53 PolarHBondContact O-N 3.2Å; S51-Y53 PolarHBondContact O-N 2.93Å |
| 54 | L | 65.7 | Low | 55.5 | Low | 135 Ų | 135 | 135.3 Ų | 135.3 | 71% | 0.707 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -84.6 | -28.6 | 176.3 | -65.5 | 177.2 | 0 | 0 | 0 | 112.2 | F50 S51 S56 | F50-L54 PolarHBondContact O-N 3.41Å; S51-L54 PolarHBondContact O-N 3.48Å; L54-S56 VanDerWaalsContact C-N 3.35Å; L54-S56 PolarHBondContact O-N 3.29Å |
| 55 | D | 53.9 | Low | 54.8 | Low | 109 Ų | 109 | 133.3 Ų | 133.3 | 58% | 0.583 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -80.9 | -7.8 | -177.2 | -100.2 | -9.6 | 0 | 0 | 0 | 115.3 | S51 A57 | S51-D55 PolarHBondContact O-N 2.9Å; D55-A57 PolarHBondContact O-N 2.96Å |
| 56 | S | 52.9 | Low | 53.6 | Low | 101 Ų | 101 | 133.5 Ų | 133.5 | 71% | 0.706 | 73% | 0.725 | S | S | * | * | G | 310 helix | trans | -72.7 | -6.2 | 177.3 | -67.3 | 0 | 0 | 0 | 0 | 113.6 | L54 | L54-S56 VanDerWaalsContact C-N 3.35Å; L54-S56 PolarHBondContact O-N 3.29Å |
| 57 | A | 46.7 | Very low | 52.6 | Low | 86 Ų | 86 | 127.7 Ų | 127.7 | 71% | 0.711 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -86.1 | -6.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | D55 | D55-A57 PolarHBondContact O-N 2.96Š|
| 58 | L | 48.3 | Very low | 51 | Low | 146 Ų | 146 | 131.8 Ų | 131.8 | 76% | 0.764 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -121 | 5.5 | -170.9 | -65.9 | -178.7 | 0 | 0 | 0 | 116.9 | C60 | L58-C60 PolarHBondContact O-N 3.14Š|
| 59 | H | 45.1 | Very low | 50 | Low | 173 Ų | 173 | 131.2 Ų | 131.2 | 80% | 0.801 | 73% | 0.725 | S | S | * | * | trans | -102.2 | 86.7 | -179.1 | -76.3 | 86.3 | 0 | 0 | 0 | 112.8 | ||||
| 60 | C | 38.7 | Very low | 48.7 | Very low | 118 Ų | 118 | 129.2 Ų | 129.2 | 80% | 0.797 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -103.9 | 134.1 | 163.3 | -161.7 | 0 | 0 | 0 | 0 | 108.6 | L58 | L58-C60 PolarHBondContact O-N 3.14Š|
| 61 | P | 38.5 | Very low | 47.9 | Very low | 112 Ų | 112 | 129 Ų | 129 | 73% | 0.727 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 154.2 | 178.2 | 31.9 | -32.9 | 0 | 0 | 0 | 110.9 | ||
| 62 | P | 40.8 | Very low | 47.2 | Very low | 128 Ų | 128 | 130.2 Ų | 130.2 | 83% | 0.831 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 134.3 | -172 | 31.9 | -32.3 | 0 | 0 | 0 | 111.9 | ||
| 63 | Q | 36.4 | Very low | 46.4 | Very low | 190 Ų | 190 | 135.9 Ų | 135.9 | 89% | 0.888 | 76% | 0.763 | S | S | * | * | trans | -122.3 | 152.8 | 157.1 | -86.7 | -152.9 | -12.2 | 0 | 0 | 109.9 | ||||
| 64 | P | 39.3 | Very low | 45.8 | Very low | 123 Ų | 123 | 130.4 Ų | 130.4 | 80% | 0.799 | 75% | 0.752 | S | S | * | * | trans | -84 | 133.3 | -154.7 | 32 | -33.5 | 0 | 0 | 0 | 115.1 | ||||
| 65 | Q | 39.7 | Very low | 45.2 | Very low | 182 Ų | 182 | 129.7 Ų | 129.7 | 85% | 0.85 | 75% | 0.749 | S | S | * | * | trans | 23.7 | 117.3 | 146.3 | -58.3 | -173.1 | -15.7 | 0 | 0 | 122.6 | ||||
| 66 | Q | 35.5 | Very low | 45.1 | Very low | 182 Ų | 182 | 131.2 Ų | 131.2 | 85% | 0.85 | 75% | 0.751 | S | S | * | * | 136.8 | 153.7 | 125.5 | -80.2 | -162.4 | -19.1 | 0 | 0 | 113.8 | |||||
| 67 | P | 44 | Very low | 45.3 | Very low | 107 Ų | 107 | 131.8 Ų | 131.8 | 70% | 0.695 | 75% | 0.745 | S | S | * | * | cis | -132.6 | 157.2 | -36.7 | 37.9 | -21 | 0 | 0 | 0 | 115.1 | ||||
| 68 | Q | 36.7 | Very low | 45.7 | Very low | 180 Ų | 180 | 129.2 Ų | 129.2 | 84% | 0.841 | 73% | 0.727 | S | S | * | * | trans | 69 | 134.3 | 156.8 | -59.8 | -63.7 | 6.8 | 0 | 0 | 123.5 | ||||
| 69 | P | 48.4 | Very low | 45.9 | Very low | 120 Ų | 120 | 126.9 Ų | 126.9 | 78% | 0.779 | 71% | 0.712 | S | S | * | * | trans | -99 | 127.5 | -177.5 | 37.7 | -27.6 | 0 | 0 | 0 | 112.3 | ||||
| 70 | G | 45.9 | Very low | 46.5 | Very low | 71 Ų | 71 | 120.8 Ų | 120.8 | 73% | 0.732 | 69% | 0.689 | S | S | * | * | trans | -156.6 | 130.4 | 165.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 71 | D | 49.5 | Very low | 47.5 | Very low | 131 Ų | 131 | 121.4 Ų | 121.4 | 70% | 0.701 | 68% | 0.678 | S | S | * | * | S | Bend | trans | 80.4 | 5 | 169.9 | -82.7 | -15.2 | 0 | 0 | 0 | 122.4 | F73 S74 | D71-F73 PolarHBondContact O-N 2.95Å; D71-S74 PolarHBondContact O-N 3.39Å; D71-S74 VanDerWaalsContact O-N 3.14Å |
| 72 | A | 54.5 | Low | 48.8 | Very low | 83 Ų | 83 | 121.2 Ų | 121.2 | 69% | 0.686 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -61.7 | -19.8 | 177 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 73 | F | 49.8 | Very low | 49.9 | Very low | 186 Ų | 186 | 120.9 Ų | 120.9 | 82% | 0.816 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -84.3 | -23.1 | 178.5 | -79.7 | -83.1 | 0 | 0 | 0 | 113.8 | D71 | D71-F73 PolarHBondContact O-N 2.95Å |
| 74 | S | 51.6 | Low | 51 | Low | 76 Ų | 76 | 120 Ų | 120 | 53% | 0.531 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -74.6 | -39.9 | -179.1 | -160.6 | 0 | 0 | 0 | 0 | 111.2 | D71 F76 L77 G78 | D71-S74 PolarHBondContact O-N 3.39Å; D71-S74 VanDerWaalsContact O-N 3.14Å; S74-F76 PolarHBondContact O-N 3.34Å; S74-L77 PolarHBondContact O-N 3.09Å; S74-G78 PolarHBondContact O-N 3.38Å; S74-G78 VanDerWaalsContact O-N 3.14Å |
| 75 | D | 53.3 | Low | 52.2 | Low | 120 Ų | 120 | 118.1 Ų | 118.1 | 64% | 0.642 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -67 | -36.9 | -178.2 | -70.8 | -21.2 | 0 | 0 | 0 | 112.8 | L77 G78 E79 | D75-L77 PolarHBondContact O-N 3.17Å; D75-G78 PolarHBondContact O-N 3.17Å; D75-E79 WeakPolarHBondContact O-CB 3.41Å; D75-E79 PolarHBondContact O-N 3Å |
| 76 | F | 51.8 | Low | 53.4 | Low | 140 Ų | 140 | 112.1 Ų | 112.1 | 61% | 0.614 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -66.8 | -37.2 | -179.3 | -167.4 | -100 | 0 | 0 | 0 | 113.2 | S74 S80 | S74-F76 PolarHBondContact O-N 3.34Å; F76-S80 WeakPolarHBondContact O-CB 3.46Å; F76-S80 PolarHBondContact O-N 3.1Å; F76-S80 VanDerWaalsContact O-N 3.12Å; F76-S80 PolarHBondContact O-OG 2.88Å |
| 77 | L | 56.5 | Low | 54.6 | Low | 114 Ų | 114 | 106.1 Ų | 106.1 | 60% | 0.597 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -74.6 | -35.2 | 175.7 | -75.4 | 171.8 | 0 | 0 | 0 | 111.9 | S74 D75 S80 K81 | S74-L77 PolarHBondContact O-N 3.09Å; D75-L77 PolarHBondContact O-N 3.17Å; L77-S80 PolarHBondContact O-N 3.07Å; L77-K81 WeakPolarHBondContact O-CG 3.5Å; L77-K81 PolarHBondContact O-N 3.16Å |
| 78 | G | 55 | Low | 55.5 | Low | 31 Ų | 31 | 106.5 Ų | 106.5 | 32% | 0.32 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -61 | -49.7 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | S74 D75 S80 K81 I82 | S74-G78 PolarHBondContact O-N 3.38Å; S74-G78 VanDerWaalsContact O-N 3.14Å; D75-G78 PolarHBondContact O-N 3.17Å; G78-S80 VanDerWaalsContact C-N 3.29Å; G78-S80 PolarHBondContact O-N 3Å; G78-K81 PolarHBondContact O-N 3.13Å; G78-K81 VanDerWaalsContact O-N 3.16Å; G78-I82 WeakPolarHBondContact O-CD1 3.45Å; G78-I82 VanDerWaalsContact O-CG1 3.26Å; G78-I82 WeakPolarHBondContact O-CG1 3.44Å; G78-I82 PolarHBondContact O-N 3.4Å |
| 79 | E | 53.6 | Low | 56.6 | Low | 98 Ų | 98 | 103.3 Ų | 103.3 | 46% | 0.458 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -58.9 | -39.3 | 177.2 | -120.7 | -171.8 | -163.6 | 0 | 0 | 112.4 | D75 K81 I82 K83 | D75-E79 WeakPolarHBondContact O-CB 3.41Å; D75-E79 PolarHBondContact O-N 3Å; E79-K81 PolarHBondContact O-N 3.3Å; E79-I82 PolarHBondContact O-N 2.87Å; E79-K83 VanDerWaalsContact O-CB 3.31Å; E79-K83 WeakPolarHBondContact O-CB 3.46Å; E79-K83 WeakPolarHBondContact O-CD 3.43Å; E79-K83 WeakPolarHBondContact O-CG 3.49Å; E79-K83 PolarHBondContact O-N 3.14Å; E79-K83 IonicContact OE2-NZ 2.89Å; E79-K83 PolarHBondContact OE2-NZ 3.36Å |
| 80 | S | 56.7 | Low | 57.4 | Low | 45 Ų | 45 | 101.3 Ų | 101.3 | 32% | 0.315 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -66 | -37.2 | 178.5 | -63.3 | 0 | 0 | 0 | 0 | 112.5 | F76 L77 G78 R84 | F76-S80 WeakPolarHBondContact O-CB 3.46Å; F76-S80 PolarHBondContact O-N 3.1Å; F76-S80 VanDerWaalsContact O-N 3.12Å; F76-S80 PolarHBondContact O-OG 2.88Å; L77-S80 PolarHBondContact O-N 3.07Å; G78-S80 VanDerWaalsContact C-N 3.29Å; G78-S80 PolarHBondContact O-N 3Å; S80-R84 WeakPolarHBondContact O-CG 3.11Å; S80-R84 PolarHBondContact O-N 3.47Å |
| 81 | K | 60.6 | Low | 58 | Low | 131 Ų | 131 | 105.9 Ų | 105.9 | 57% | 0.57 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -72.2 | -41.9 | 175.2 | -69.6 | 175.3 | -176.1 | 176.6 | 0 | 111.5 | L77 G78 E79 R84 V85 | L77-K81 WeakPolarHBondContact O-CG 3.5Å; L77-K81 PolarHBondContact O-N 3.16Å; G78-K81 PolarHBondContact O-N 3.13Å; G78-K81 VanDerWaalsContact O-N 3.16Å; E79-K81 PolarHBondContact O-N 3.3Å; K81-R84 PolarHBondContact O-N 3.46Å; K81-V85 WeakPolarHBondContact O-CG2 3.48Å; K81-V85 PolarHBondContact O-N 2.79Å |
| 82 | I | 66.1 | Low | 58.8 | Low | 108 Ų | 108 | 106.8 Ų | 106.8 | 55% | 0.554 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -61.1 | -48 | 176.3 | -65.9 | 160.3 | 0 | 0 | 0 | 109.9 | G78 E79 R84 V85 T86 | G78-I82 WeakPolarHBondContact O-CD1 3.45Å; G78-I82 VanDerWaalsContact O-CG1 3.26Å; G78-I82 WeakPolarHBondContact O-CG1 3.44Å; G78-I82 PolarHBondContact O-N 3.4Å; E79-I82 PolarHBondContact O-N 2.87Å; I82-R84 VanDerWaalsContact C-N 3.28Å; I82-R84 PolarHBondContact O-N 3.45Å; I82-V85 PolarHBondContact O-N 2.93Å; I82-V85 VanDerWaalsContact O-N 3.11Å; I82-T86 WeakPolarHBondContact O-CB 3.41Å; I82-T86 PolarHBondContact O-N 3.35Å; I82-T86 PolarHBondContact O-OG1 3.22Å |
| 83 | K | 63 | Low | 59.4 | Low | 121 Ų | 121 | 107.6 Ų | 107.6 | 53% | 0.526 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -56.3 | -38.9 | 175.6 | -75 | 163.8 | -179.7 | 163.6 | 0 | 112.4 | E79 A87 | E79-K83 VanDerWaalsContact O-CB 3.31Å; E79-K83 WeakPolarHBondContact O-CB 3.46Å; E79-K83 WeakPolarHBondContact O-CD 3.43Å; E79-K83 WeakPolarHBondContact O-CG 3.49Å; E79-K83 PolarHBondContact O-N 3.14Å; E79-K83 IonicContact OE2-NZ 2.89Å; E79-K83 PolarHBondContact OE2-NZ 3.36Å; K83-A87 WeakPolarHBondContact O-CB 3.39Å; K83-A87 PolarHBondContact O-N 3.42Å |
| 84 | R | 59.8 | Low | 59.8 | Low | 172 Ų | 172 | 107.3 Ų | 107.3 | 65% | 0.649 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -69.7 | -40.1 | 175.5 | -72.5 | -162.8 | -58.2 | -153.6 | 4.7 | 113.3 | S80 K81 I82 A87 L88 | S80-R84 WeakPolarHBondContact O-CG 3.11Å; S80-R84 PolarHBondContact O-N 3.47Å; K81-R84 PolarHBondContact O-N 3.46Å; I82-R84 VanDerWaalsContact C-N 3.28Å; I82-R84 PolarHBondContact O-N 3.45Å; R84-A87 PolarHBondContact O-N 2.93Å; R84-L88 WeakPolarHBondContact O-CG 3.44Å; R84-L88 PolarHBondContact O-N 3.43Å |
| 85 | V | 63.8 | Low | 60.6 | Low | 82 Ų | 82 | 106.5 Ų | 106.5 | 50% | 0.497 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -67.6 | -43.5 | 176.4 | 173.7 | 0 | 0 | 0 | 0 | 110.7 | K81 I82 L88 Q89 | K81-V85 WeakPolarHBondContact O-CG2 3.48Å; K81-V85 PolarHBondContact O-N 2.79Å; I82-V85 PolarHBondContact O-N 2.93Å; I82-V85 VanDerWaalsContact O-N 3.11Å; V85-L88 PolarHBondContact O-N 3.46Å; V85-Q89 WeakPolarHBondContact O-CG 3.26Å; V85-Q89 PolarHBondContact O-N 2.87Å |
| 86 | T | 64.5 | Low | 61.2 | Low | 57 Ų | 57 | 105.8 Ų | 105.8 | 35% | 0.35 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.3 | -38.1 | 174.9 | -52.2 | 0 | 0 | 0 | 0 | 111.4 | I82 Q89 N90 | I82-T86 WeakPolarHBondContact O-CB 3.41Å; I82-T86 PolarHBondContact O-N 3.35Å; I82-T86 PolarHBondContact O-OG1 3.22Å; T86-Q89 PolarHBondContact O-N 2.95Å; T86-N90 VanDerWaalsContact O-CB 3.3Å; T86-N90 WeakPolarHBondContact O-CB 3.31Å; T86-N90 PolarHBondContact O-N 2.65Å; T86-N90 PolarHBondContact O-ND2 2.93Å; T86-N90 PolarHBondContact O-OD1 3.42Å |
| 87 | A | 61.3 | Low | 61.9 | Low | 56 Ų | 56 | 104.3 Ų | 104.3 | 46% | 0.463 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.9 | -39.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | K83 R84 N90 Y91 | K83-A87 WeakPolarHBondContact O-CB 3.39Å; K83-A87 PolarHBondContact O-N 3.42Å; R84-A87 PolarHBondContact O-N 2.93Å; A87-N90 PolarHBondContact O-N 3.21Å; A87-Y91 WeakPolarHBondContact O-CB 3.42Å; A87-Y91 PolarHBondContact O-N 2.96Å |
| 88 | L | 62.3 | Low | 62.1 | Low | 115 Ų | 115 | 104 Ų | 104 | 60% | 0.602 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -67.8 | -39.1 | 173.8 | -75.4 | 172.9 | 0 | 0 | 0 | 112.2 | R84 V85 N90 Y91 K92 | R84-L88 WeakPolarHBondContact O-CG 3.44Å; R84-L88 PolarHBondContact O-N 3.43Å; V85-L88 PolarHBondContact O-N 3.46Å; L88-N90 VanDerWaalsContact C-N 3.34Å; L88-Y91 PolarHBondContact O-N 3.5Å; L88-K92 WeakPolarHBondContact O-CG 3.42Å; L88-K92 PolarHBondContact O-N 3.16Å |
| 89 | Q | 60.9 | Low | 62.6 | Low | 112 Ų | 112 | 108.8 Ų | 108.8 | 52% | 0.523 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.7 | -37.3 | 172.7 | -76.7 | -177 | -17.8 | 0 | 0 | 111.9 | V85 T86 K92 N93 | V85-Q89 WeakPolarHBondContact O-CG 3.26Å; V85-Q89 PolarHBondContact O-N 2.87Å; T86-Q89 PolarHBondContact O-N 2.95Å; Q89-K92 PolarHBondContact O-N 3.38Å; Q89-N93 PolarHBondContact O-N 2.96Å; Q89-N93 PolarHBondContact O-ND2 2.72Å |
| 90 | N | 64.1 | Low | 63 | Low | 78 Ų | 78 | 109.1 Ų | 109.1 | 42% | 0.417 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -68.2 | -41.2 | 175.6 | -73.3 | -12.3 | 0 | 0 | 0 | 111.3 | T86 A87 L88 K92 N93 Y94 | T86-N90 VanDerWaalsContact O-CB 3.3Å; T86-N90 WeakPolarHBondContact O-CB 3.31Å; T86-N90 PolarHBondContact O-N 2.65Å; T86-N90 PolarHBondContact O-ND2 2.93Å; T86-N90 PolarHBondContact O-OD1 3.42Å; A87-N90 PolarHBondContact O-N 3.21Å; L88-N90 VanDerWaalsContact C-N 3.34Å; N90-K92 VanDerWaalsContact C-N 3.33Å; N90-K92 PolarHBondContact O-N 3.01Å; N90-N93 PolarHBondContact O-N 3.16Å; N90-Y94 WeakPolarHBondContact O-CD2 3.37Å; N90-Y94 PolarHBondContact O-N 2.86Å |
| 91 | Y | 58.6 | Low | 63.1 | Low | 168 Ų | 168 | 112.4 Ų | 112.4 | 66% | 0.659 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -59.1 | -43.9 | 173.1 | 179 | -100.1 | 0 | 0 | 0 | 111.8 | A87 L88 N93 Y94 S95 | A87-Y91 WeakPolarHBondContact O-CB 3.42Å; A87-Y91 PolarHBondContact O-N 2.96Å; L88-Y91 PolarHBondContact O-N 3.5Å; Y91-N93 VanDerWaalsContact C-N 3.35Å; Y91-N93 PolarHBondContact O-N 3.32Å; Y91-Y94 PolarHBondContact O-N 3.47Å; Y91-S95 WeakPolarHBondContact O-CB 3.42Å; Y91-S95 PolarHBondContact O-N 2.9Å |
| 92 | K | 66.1 | Low | 62.9 | Low | 150 Ų | 150 | 109 Ų | 109 | 65% | 0.652 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.7 | -39.9 | 174.2 | -71.2 | 179.2 | 179.5 | -172.4 | 0 | 112.2 | L88 Q89 N90 S95 L96 | L88-K92 WeakPolarHBondContact O-CG 3.42Å; L88-K92 PolarHBondContact O-N 3.16Å; Q89-K92 PolarHBondContact O-N 3.38Å; N90-K92 VanDerWaalsContact C-N 3.33Å; N90-K92 PolarHBondContact O-N 3.01Å; K92-S95 PolarHBondContact O-N 2.86Å; K92-L96 WeakPolarHBondContact O-CB 3.46Å; K92-L96 PolarHBondContact O-N 2.99Å |
| 93 | N | 67.6 | Low | 62.4 | Low | 100 Ų | 100 | 106.2 Ų | 106.2 | 54% | 0.535 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.5 | -42.9 | 175.8 | -85.6 | -69.4 | 0 | 0 | 0 | 112.6 | Q89 N90 Y91 S95 L96 L97 | Q89-N93 PolarHBondContact O-N 2.96Å; Q89-N93 PolarHBondContact O-ND2 2.72Å; N90-N93 PolarHBondContact O-N 3.16Å; Y91-N93 VanDerWaalsContact C-N 3.35Å; Y91-N93 PolarHBondContact O-N 3.32Å; N93-S95 VanDerWaalsContact C-N 3.35Å; N93-L96 PolarHBondContact O-N 3.31Å; N93-L97 VanDerWaalsContact O-CB 3.25Å; N93-L97 WeakPolarHBondContact O-CB 3.42Å; N93-L97 PolarHBondContact O-N 3.49Å |
| 94 | Y | 57.9 | Low | 61.8 | Low | 180 Ų | 180 | 107.3 Ų | 107.3 | 71% | 0.706 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -65.8 | -37.1 | 175.6 | -80.2 | -70 | 0 | 0 | 0 | 112.4 | N90 Y91 N98 | N90-Y94 WeakPolarHBondContact O-CD2 3.37Å; N90-Y94 PolarHBondContact O-N 2.86Å; Y91-Y94 PolarHBondContact O-N 3.47Å; Y94-N98 VanDerWaalsContact O-CB 3.24Å; Y94-N98 WeakPolarHBondContact O-CB 3.48Å; Y94-N98 PolarHBondContact O-N 3.12Å |
| 95 | S | 69.3 | Low | 60.8 | Low | 58 Ų | 58 | 103.4 Ų | 103.4 | 41% | 0.406 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.2 | -45.8 | 174.5 | -166.5 | 0 | 0 | 0 | 0 | 111.7 | Y91 K92 N93 N98 E99 | Y91-S95 WeakPolarHBondContact O-CB 3.42Å; Y91-S95 PolarHBondContact O-N 2.9Å; K92-S95 PolarHBondContact O-N 2.86Å; N93-S95 VanDerWaalsContact C-N 3.35Å; S95-N98 PolarHBondContact O-N 3.19Å; S95-E99 PolarHBondContact O-N 2.83Å |
| 96 | L | 66.8 | Low | 59.8 | Low | 105 Ų | 105 | 104.7 Ų | 104.7 | 55% | 0.55 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -68.8 | -37.5 | 179.9 | -148.4 | 169.4 | 0 | 0 | 0 | 111.3 | K92 N93 E99 L100 | K92-L96 WeakPolarHBondContact O-CB 3.46Å; K92-L96 PolarHBondContact O-N 2.99Å; N93-L96 PolarHBondContact O-N 3.31Å; L96-E99 PolarHBondContact O-N 3.07Å; L96-L100 WeakPolarHBondContact O-CB 3.36Å; L96-L100 PolarHBondContact O-N 2.77Å |
| 97 | L | 64.8 | Low | 58.7 | Low | 109 Ų | 109 | 108.4 Ų | 108.4 | 57% | 0.571 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -69.6 | -34.1 | 176.7 | -154 | 137.6 | 0 | 0 | 0 | 111.7 | N93 L100 E101 | N93-L97 VanDerWaalsContact O-CB 3.25Å; N93-L97 WeakPolarHBondContact O-CB 3.42Å; N93-L97 PolarHBondContact O-N 3.49Å; L97-L100 PolarHBondContact O-N 3.31Å; L97-E101 VanDerWaalsContact O-CB 3.28Å; L97-E101 WeakPolarHBondContact O-CB 3.41Å; L97-E101 PolarHBondContact O-N 3.12Å |
| 98 | N | 62.2 | Low | 57.7 | Low | 108 Ų | 108 | 113.8 Ų | 113.8 | 58% | 0.578 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -69.9 | -36.2 | 173.3 | -172.2 | 80.5 | 0 | 0 | 0 | 112.3 | Y94 S95 A102 | Y94-N98 VanDerWaalsContact O-CB 3.24Å; Y94-N98 WeakPolarHBondContact O-CB 3.48Å; Y94-N98 PolarHBondContact O-N 3.12Å; S95-N98 PolarHBondContact O-N 3.19Å; N98-A102 VanDerWaalsContact O-CB 3.28Å; N98-A102 WeakPolarHBondContact O-CB 3.32Å; N98-A102 PolarHBondContact O-N 2.8Å |
| 99 | E | 65.7 | Low | 56.9 | Low | 132 Ų | 132 | 118.6 Ų | 118.6 | 62% | 0.617 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -68.1 | -36.9 | 170.3 | -78.1 | -175.2 | 157.7 | 0 | 0 | 112.4 | S95 L96 S103 | S95-E99 PolarHBondContact O-N 2.83Å; L96-E99 PolarHBondContact O-N 3.07Å; E99-S103 PolarHBondContact O-N 3.18Å; E99-S103 PolarHBondContact O-OG 2.83Å |
| 100 | L | 61.8 | Low | 55.6 | Low | 105 Ų | 105 | 119.5 Ų | 119.5 | 55% | 0.55 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -71 | -37.9 | 176.9 | -161.9 | 68.9 | 0 | 0 | 0 | 112 | L96 L97 S103 Q104 | L96-L100 WeakPolarHBondContact O-CB 3.36Å; L96-L100 PolarHBondContact O-N 2.77Å; L97-L100 PolarHBondContact O-N 3.31Å; L100-S103 VanDerWaalsContact CA-OG 3.25Å; L100-S103 WeakPolarHBondContact CA-OG 3.42Å; L100-S103 PolarHBondContact O-N 3.1Å; L100-S103 PolarHBondContact O-OG 2.82Å; L100-Q104 VanDerWaalsContact O-CB 3.28Å; L100-Q104 WeakPolarHBondContact O-CB 3.35Å; L100-Q104 PolarHBondContact O-N 3.41Å |
| 101 | E | 58.5 | Low | 54.5 | Low | 114 Ų | 114 | 121 Ų | 121 | 53% | 0.533 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -70 | -36.6 | 175.2 | -165.4 | 173.6 | -178.9 | 0 | 0 | 111.4 | L97 Q104 C105 | L97-E101 VanDerWaalsContact O-CB 3.28Å; L97-E101 WeakPolarHBondContact O-CB 3.41Å; L97-E101 PolarHBondContact O-N 3.12Å; E101-Q104 PolarHBondContact O-N 3.2Å; E101-C105 PolarHBondContact O-N 2.97Å; E101-C105 PolarHBondContact O-SG 3.44Å |
| 102 | A | 55.4 | Low | 53.7 | Low | 60 Ų | 60 | 124 Ų | 124 | 50% | 0.496 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -64 | -41 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | N98 E106 | N98-A102 VanDerWaalsContact O-CB 3.28Å; N98-A102 WeakPolarHBondContact O-CB 3.32Å; N98-A102 PolarHBondContact O-N 2.8Å; A102-E106 PolarHBondContact O-N 2.89Å |
| 103 | S | 55.2 | Low | 52.3 | Low | 49 Ų | 49 | 119.9 Ų | 119.9 | 34% | 0.343 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -74.5 | -28.9 | 176.4 | 45.2 | 0 | 0 | 0 | 0 | 113.2 | E99 L100 C105 E106 N107 | E99-S103 PolarHBondContact O-N 3.18Å; E99-S103 PolarHBondContact O-OG 2.83Å; L100-S103 VanDerWaalsContact CA-OG 3.25Å; L100-S103 WeakPolarHBondContact CA-OG 3.42Å; L100-S103 PolarHBondContact O-N 3.1Å; L100-S103 PolarHBondContact O-OG 2.82Å; S103-C105 VanDerWaalsContact C-N 3.33Å; S103-E106 PolarHBondContact O-N 3.05Å; S103-N107 PolarHBondContact O-N 3.32Å; S103-N107 PolarHBondContact O-ND2 3.42Å |
| 104 | Q | 50.9 | Low | 51 | Low | 143 Ų | 143 | 123.1 Ų | 123.1 | 67% | 0.668 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -72.3 | -26.5 | 175.6 | -162.6 | 168.6 | 74.5 | 0 | 0 | 112.6 | L100 E101 | L100-Q104 VanDerWaalsContact O-CB 3.28Å; L100-Q104 WeakPolarHBondContact O-CB 3.35Å; L100-Q104 PolarHBondContact O-N 3.41Å; E101-Q104 PolarHBondContact O-N 3.2Å |
| 105 | C | 38.4 | Very low | 50.1 | Low | 91 Ų | 91 | 119.3 Ų | 119.3 | 62% | 0.615 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -76.5 | -26.8 | 173 | -67.2 | 0 | 0 | 0 | 0 | 113.6 | E101 S103 | E101-C105 PolarHBondContact O-N 2.97Å; E101-C105 PolarHBondContact O-SG 3.44Å; S103-C105 VanDerWaalsContact C-N 3.33Å |
| 106 | E | 44.3 | Very low | 48.3 | Very low | 109 Ų | 109 | 126.5 Ų | 126.5 | 51% | 0.509 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -75.2 | -35 | 174 | -74.6 | -64.2 | 139.1 | 0 | 0 | 112 | A102 S103 L108 R109 | A102-E106 PolarHBondContact O-N 2.89Å; S103-E106 PolarHBondContact O-N 3.05Å; E106-L108 PolarHBondContact O-N 3.01Å; E106-L108 VanDerWaalsContact O-N 3.16Å; E106-R109 PolarHBondContact O-N 2.87Å; E106-R109 VanDerWaalsContact O-N 3.09Å |
| 107 | N | 41.3 | Very low | 47.3 | Very low | 134 Ų | 134 | 126.7 Ų | 126.7 | 72% | 0.717 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | -13.7 | -176.8 | -85.7 | -85.6 | 0 | 0 | 0 | 115.2 | S103 | S103-N107 PolarHBondContact O-N 3.32Å; S103-N107 PolarHBondContact O-ND2 3.42Å |
| 108 | L | 40.4 | Very low | 46.2 | Very low | 169 Ų | 169 | 129 Ų | 129 | 89% | 0.885 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.9 | -8 | 174.8 | -152.1 | 78.5 | 0 | 0 | 0 | 112.9 | E106 | E106-L108 PolarHBondContact O-N 3.01Å; E106-L108 VanDerWaalsContact O-N 3.16Å |
| 109 | R | 44.8 | Very low | 45.2 | Very low | 216 Ų | 216 | 131.9 Ų | 131.9 | 82% | 0.815 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.7 | -14.4 | -175.4 | -156.5 | 176.4 | -177.3 | -167 | -2.1 | 114.4 | E106 | E106-R109 PolarHBondContact O-N 2.87Å; E106-R109 VanDerWaalsContact O-N 3.09Å |
| 110 | E | 34.4 | Very low | 43.8 | Very low | 132 Ų | 132 | 134 Ų | 134 | 62% | 0.617 | 71% | 0.705 | S | S | * | * | trans | -124 | 69.1 | -172.8 | -66.5 | -169 | 156.3 | 0 | 0 | 112.6 | ||||
| 111 | S | 41.2 | Very low | 42.5 | Very low | 110 Ų | 110 | 136.6 Ų | 136.6 | 77% | 0.769 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -87 | 19.8 | 159.6 | -176.3 | 0 | 0 | 0 | 0 | 112.4 | ||
| 112 | Y | 41.6 | Very low | 41.5 | Very low | 231 Ų | 231 | 136.8 Ų | 136.8 | 91% | 0.906 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -162 | 104.4 | 167.1 | -87 | -77.5 | 0 | 0 | 0 | 109 | ||
| 113 | G | 36.9 | Very low | 40.9 | Very low | 62 Ų | 62 | 145.1 Ų | 145.1 | 64% | 0.639 | 74% | 0.742 | S | S | * | * | trans | 165.7 | 87.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 114 | L | 39.6 | Very low | 40 | Very low | 168 Ų | 168 | 149.4 Ų | 149.4 | 88% | 0.88 | 77% | 0.766 | S | S | * | * | trans | -71.9 | 136.5 | -179.1 | -72.3 | 161.9 | 0 | 0 | 0 | 112.9 | ||||
| 115 | S | 38 | Very low | 39.6 | Very low | 100 Ų | 100 | 149.8 Ų | 149.8 | 70% | 0.699 | 77% | 0.772 | S | S | * | * | trans | 40.3 | 117 | 139.9 | 67.4 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 116 | Y | 33.4 | Very low | 39.7 | Very low | 209 Ų | 209 | 151.2 Ų | 151.2 | 82% | 0.82 | 78% | 0.783 | S | S | * | * | -166.1 | 102.1 | 125.8 | -127.7 | -94.1 | 0 | 0 | 0 | 110.3 | E118 | Y116-E118 WeakPolarHBondContact CE1-O 3.45Š| |||
| 117 | A | 44.8 | Very low | 39.8 | Very low | 109 Ų | 109 | 152 Ų | 152 | 90% | 0.901 | 80% | 0.795 | S | S | * | * | trans | -126.4 | 64.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 118 | E | 41.7 | Very low | 39.4 | Very low | 159 Ų | 159 | 153.4 Ų | 153.4 | 74% | 0.743 | 80% | 0.802 | S | S | * | * | trans | -161.4 | 105.1 | 170.6 | -163 | 162.8 | -170.2 | 0 | 0 | 109.1 | Y116 | Y116-E118 WeakPolarHBondContact CE1-O 3.45Š| ||
| 119 | L | 40.5 | Very low | 39.3 | Very low | 168 Ų | 168 | 150.1 Ų | 150.1 | 88% | 0.88 | 79% | 0.793 | S | S | * | * | trans | -169 | 109.9 | 140.8 | -93.3 | -174.5 | 0 | 0 | 0 | 107.5 | ||||
| 120 | Q | 37.2 | Very low | 39.4 | Very low | 176 Ų | 176 | 145.7 Ų | 145.7 | 82% | 0.822 | 79% | 0.792 | S | S | * | * | trans | -78.3 | 153.6 | 170.7 | -83 | -171.2 | -16.7 | 0 | 0 | 111.3 | ||||
| 121 | E | 34.2 | Very low | 39.4 | Very low | 160 Ų | 160 | 147.7 Ų | 147.7 | 75% | 0.748 | 80% | 0.802 | S | S | * | * | trans | 92.1 | 118.6 | 146.1 | -80.4 | 179.4 | 174.6 | 0 | 0 | 122.6 | ||||
| 122 | T | 37.2 | Very low | 39.2 | Very low | 118 Ų | 118 | 150.2 Ų | 150.2 | 72% | 0.724 | 81% | 0.806 | S | S | * | * | trans | 82.4 | 112.7 | 136.3 | 51.4 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 123 | R | 42.1 | Very low | 39 | Very low | 235 Ų | 235 | 145.3 Ų | 145.3 | 89% | 0.887 | 81% | 0.805 | S | S | * | * | trans | 50.9 | 128.1 | 144.6 | -57.4 | -177 | 178 | 158.3 | 0.5 | 117.7 | ||||
| 124 | V | 37.4 | Very low | 39 | Very low | 138 Ų | 138 | 152.2 Ų | 152.2 | 84% | 0.836 | 81% | 0.812 | S | S | * | * | -173.3 | 159.7 | 68.3 | -78.2 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 125 | D | 42.6 | Very low | 38.6 | Very low | 151 Ų | 151 | 154.7 Ų | 154.7 | 81% | 0.807 | 81% | 0.811 | S | S | * | * | trans | -43.5 | 138.7 | 170.3 | -106.4 | -42 | 0 | 0 | 0 | 115.1 | ||||
| 126 | S | 40.3 | Very low | 38.2 | Very low | 121 Ų | 121 | 162 Ų | 162 | 85% | 0.846 | 82% | 0.823 | S | S | * | * | trans | -162 | 112.3 | 149.4 | -84.1 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 127 | V | 45.6 | Very low | 38.2 | Very low | 125 Ų | 125 | 156.5 Ų | 156.5 | 76% | 0.758 | 82% | 0.821 | S | S | * | * | trans | -62.4 | 135.5 | 163.4 | -174.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 128 | L | 33.4 | Very low | 37.6 | Very low | 165 Ų | 165 | 156.2 Ų | 156.2 | 86% | 0.864 | 82% | 0.819 | S | S | * | * | trans | 154.7 | 122.7 | 140.5 | -80.2 | 159.5 | 0 | 0 | 0 | 112.6 | ||||
| 129 | S | 38.8 | Very low | 37 | Very low | 99 Ų | 99 | 153.5 Ų | 153.5 | 69% | 0.692 | 82% | 0.824 | S | S | * | * | trans | -73.8 | 153.1 | 158.1 | -174.6 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 130 | P | 45.5 | Very low | 36.6 | Very low | 123 Ų | 123 | 150.5 Ų | 150.5 | 80% | 0.799 | 82% | 0.823 | S | S | * | * | -152.9 | 155.1 | 108.2 | 27.7 | -5.4 | 0 | 0 | 0 | 118.1 | |||||
| 131 | E | 35.3 | Very low | 36.4 | Very low | 174 Ų | 174 | 146.6 Ų | 146.6 | 81% | 0.813 | 82% | 0.821 | S | S | * | * | trans | -57 | 133.7 | 167.3 | -71.8 | 151.9 | 112.9 | 0 | 0 | 114.7 | ||||
| 132 | L | 37.7 | Very low | 36.7 | Very low | 163 Ų | 163 | 144.9 Ų | 144.9 | 85% | 0.853 | 82% | 0.824 | S | S | * | * | trans | -174.6 | 105.5 | 149 | -118.3 | 140.9 | 0 | 0 | 0 | 111.8 | ||||
| 133 | S | 36.5 | Very low | 36.6 | Very low | 129 Ų | 129 | 143.3 Ų | 143.3 | 90% | 0.902 | 82% | 0.822 | S | S | * | * | trans | -166.8 | 44.3 | 154.1 | -85.2 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 134 | R | 36.3 | Very low | 36.1 | Very low | 207 Ų | 207 | 139.2 Ų | 139.2 | 78% | 0.781 | 82% | 0.818 | S | S | * | * | trans | -79.6 | 147.3 | 152.3 | -85.2 | -167.5 | -81.2 | -144.3 | -3.9 | 108.4 | ||||
| 135 | Y | 32.4 | Very low | 36.1 | Very low | 220 Ų | 220 | 144.7 Ų | 144.7 | 86% | 0.863 | 82% | 0.824 | S | S | * | * | trans | 91.1 | 85.6 | 174.8 | -47.9 | -70.6 | 0 | 0 | 0 | 117 | ||||
| 136 | R | 30 | Very low | 35.5 | Very low | 253 Ų | 253 | 146 Ų | 146 | 96% | 0.955 | 83% | 0.825 | S | S | * | * | trans | -137.9 | 131 | 130.4 | -168.1 | 172.9 | -83.3 | -176.1 | -4.8 | 110.3 | ||||
| 137 | A | 32.2 | Very low | 35 | Very low | 94 Ų | 94 | 146.7 Ų | 146.7 | 78% | 0.777 | 82% | 0.82 | S | S | * | * | trans | -88.3 | 165 | -157 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 138 | A | 32.1 | Very low | 34.3 | Very low | 102 Ų | 102 | 145.5 Ų | 145.5 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | trans | -34.6 | 147.5 | 160 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 139 | A | 29.7 | Very low | 34.3 | Very low | 103 Ų | 103 | 145.9 Ų | 145.9 | 85% | 0.851 | 81% | 0.814 | S | S | * | * | trans | -166.1 | 149.2 | 140.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 140 | A | 32.3 | Very low | 34 | Very low | 104 Ų | 104 | 150.2 Ų | 150.2 | 86% | 0.86 | 82% | 0.823 | S | S | * | * | trans | 103.9 | 95.3 | 157.3 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 141 | A | 32.9 | Very low | 33.6 | Very low | 95 Ų | 95 | 151.9 Ų | 151.9 | 79% | 0.785 | 83% | 0.826 | S | S | * | * | trans | -81.7 | 167.3 | 145 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 142 | P | 40 | Very low | 34.1 | Very low | 124 Ų | 124 | 148.6 Ų | 148.6 | 81% | 0.805 | 83% | 0.828 | S | S | * | * | -157.9 | 174.5 | 80.1 | 40.4 | -19 | 0 | 0 | 0 | 118.6 | |||||
| 143 | A | 34.4 | Very low | 34.2 | Very low | 84 Ų | 84 | 149.4 Ų | 149.4 | 69% | 0.694 | 83% | 0.825 | S | S | * | * | trans | 84.8 | 117.7 | 139 | 0 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 144 | D | 32 | Very low | 34.6 | Very low | 150 Ų | 150 | 151.6 Ų | 151.6 | 80% | 0.802 | 82% | 0.823 | S | S | * | * | trans | 48.3 | 121.4 | 132.6 | -56.6 | -26.6 | 0 | 0 | 0 | 123.1 | ||||
| 145 | R | 37.9 | Very low | 34.6 | Very low | 252 Ų | 252 | 149.6 Ų | 149.6 | 95% | 0.951 | 82% | 0.822 | S | S | * | * | -175.5 | 152.5 | 114.3 | -104.5 | -177.4 | 158.6 | 89.4 | 1.9 | 114.2 | |||||
| 146 | E | 30.8 | Very low | 34.7 | Very low | 178 Ų | 178 | 146.4 Ų | 146.4 | 83% | 0.832 | 82% | 0.82 | S | S | * | * | trans | -89.6 | 159.2 | -165 | -145.8 | -164.2 | -177.2 | 0 | 0 | 114.5 | ||||
| 147 | D | 28.8 | Very low | 35 | Very low | 137 Ų | 137 | 137.4 Ų | 137.4 | 73% | 0.733 | 81% | 0.806 | S | S | * | * | trans | 89 | 147.5 | 137.7 | -145.3 | 19.6 | 0 | 0 | 0 | 123.3 | ||||
| 148 | S | 31.5 | Very low | 35.7 | Very low | 99 Ų | 99 | 139 Ų | 139 | 69% | 0.692 | 81% | 0.811 | S | S | * | * | trans | 95.1 | 81.8 | 162.6 | -57.6 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 149 | Q | 32.8 | Very low | 36 | Very low | 173 Ų | 173 | 139.6 Ų | 139.6 | 81% | 0.808 | 81% | 0.81 | S | S | * | * | -4.5 | 130.6 | 126.1 | -176.3 | 170.1 | 24.2 | 0 | 0 | 118.7 | |||||
| 150 | E | 33.5 | Very low | 36.6 | Very low | 190 Ų | 190 | 137.9 Ų | 137.9 | 89% | 0.888 | 80% | 0.802 | S | S | * | * | -177.1 | 135.5 | 121.6 | 52.2 | -165.5 | 150.9 | 0 | 0 | 113.9 | |||||
| 151 | D | 36.3 | Very low | 36.8 | Very low | 159 Ų | 159 | 143 Ų | 143 | 85% | 0.85 | 81% | 0.805 | S | S | * | * | trans | -71.6 | 139.7 | 178.5 | -77.5 | -63.1 | 0 | 0 | 0 | 112.7 | ||||
| 152 | A | 45.6 | Very low | 37.5 | Very low | 104 Ų | 104 | 145.5 Ų | 145.5 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -142.7 | 83.4 | 154.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 153 | K | 40.5 | Very low | 37.5 | Very low | 181 Ų | 181 | 148.3 Ų | 148.3 | 79% | 0.787 | 81% | 0.81 | S | S | * | * | trans | -54.7 | 124.3 | 155 | 177 | -179 | -178 | 179.2 | 0 | 109.2 | ||||
| 154 | M | 43.8 | Very low | 38.1 | Very low | 175 Ų | 175 | 155.2 Ų | 155.2 | 86% | 0.862 | 82% | 0.818 | S | S | * | * | trans | -157.8 | 112.1 | 133.4 | -82.4 | -38.8 | -132.9 | 0 | 0 | 111.4 | ||||
| 155 | E | 36.2 | Very low | 38.4 | Very low | 165 Ų | 165 | 153.2 Ų | 153.2 | 77% | 0.771 | 82% | 0.816 | S | S | * | * | trans | -43.3 | 147.6 | 151.7 | -176.7 | -157.8 | -177 | 0 | 0 | 112.8 | ||||
| 156 | N | 35.3 | Very low | 38.5 | Very low | 152 Ų | 152 | 150.6 Ų | 150.6 | 81% | 0.813 | 81% | 0.807 | S | S | * | * | 142.5 | 137.2 | 124.3 | -164.5 | 38 | 0 | 0 | 0 | 113.6 | |||||
| 157 | G | 35.3 | Very low | 38.9 | Very low | 64 Ų | 64 | 148.5 Ų | 148.5 | 66% | 0.66 | 80% | 0.801 | S | S | * | * | trans | 115.4 | 73.2 | 148.6 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 158 | S | 47.9 | Very low | 39 | Very low | 127 Ų | 127 | 150.1 Ų | 150.1 | 89% | 0.888 | 80% | 0.804 | S | S | * | * | trans | -81.8 | 128.8 | 154 | -176.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 159 | S | 38.6 | Very low | 38.9 | Very low | 116 Ų | 116 | 154.8 Ų | 154.8 | 81% | 0.811 | 81% | 0.808 | S | S | * | * | trans | -164.7 | 129.9 | 149.7 | 63.6 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 160 | G | 41.3 | Very low | 39 | Very low | 67 Ų | 67 | 154.7 Ų | 154.7 | 69% | 0.691 | 81% | 0.807 | S | S | * | * | cis | 99.1 | 84.2 | 27.6 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 161 | F | 36.7 | Very low | 39.1 | Very low | 212 Ų | 212 | 149.6 Ų | 149.6 | 93% | 0.93 | 79% | 0.793 | S | S | * | * | trans | -175.4 | 135.6 | 138 | -125.7 | -100 | 0 | 0 | 0 | 113.3 | ||||
| 162 | D | 49.2 | Very low | 39.2 | Very low | 147 Ų | 147 | 148.4 Ų | 148.4 | 79% | 0.786 | 79% | 0.791 | S | S | * | * | trans | -64.5 | 149.6 | 167 | -76.6 | -62.1 | 0 | 0 | 0 | 112.6 | ||||
| 163 | M | 38.4 | Very low | 38.8 | Very low | 182 Ų | 182 | 149.4 Ų | 149.4 | 90% | 0.897 | 79% | 0.792 | S | S | * | * | trans | -148.1 | 96.1 | 158.6 | -157.9 | 92.8 | 147.9 | 0 | 0 | 110.2 | ||||
| 164 | R | 47.9 | Very low | 39.2 | Very low | 229 Ų | 229 | 144.8 Ų | 144.8 | 86% | 0.864 | 80% | 0.796 | S | S | * | * | trans | -97.3 | 115.3 | 170.9 | -167.1 | -177.8 | -178.1 | -149.5 | 0.9 | 107.5 | ||||
| 165 | S | 38.6 | Very low | 39.2 | Very low | 109 Ų | 109 | 142.2 Ų | 142.2 | 76% | 0.762 | 80% | 0.796 | S | S | * | * | trans | -113 | 141.3 | 174.5 | -79.5 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 166 | Y | 39.2 | Very low | 39.7 | Very low | 196 Ų | 196 | 142.4 Ų | 142.4 | 77% | 0.769 | 80% | 0.801 | S | S | * | * | trans | -82.7 | 153.8 | -163.6 | -101.2 | -117 | 0 | 0 | 0 | 115 | ||||
| 167 | L | 39.2 | Very low | 39.9 | Very low | 135 Ų | 135 | 138.4 Ų | 138.4 | 71% | 0.707 | 80% | 0.796 | S | S | * | * | trans | 68.6 | 115 | 149.1 | -67.6 | 168 | 0 | 0 | 0 | 121.8 | ||||
| 168 | H | 31.9 | Very low | 40.3 | Very low | 170 Ų | 170 | 143 Ų | 143 | 79% | 0.787 | 81% | 0.805 | S | S | * | * | trans | -138.7 | 106.2 | 131.5 | -150 | 75.6 | 0 | 0 | 0 | 109.3 | ||||
| 169 | Y | 29.2 | Very low | 40.1 | Very low | 197 Ų | 197 | 144.5 Ų | 144.5 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | trans | -98.6 | 119.8 | 172.5 | -136.7 | -92.2 | 0 | 0 | 0 | 107.2 | ||||
| 170 | Q | 35.4 | Very low | 40.5 | Very low | 171 Ų | 171 | 144 Ų | 144 | 80% | 0.799 | 80% | 0.798 | S | S | * | * | trans | -143.2 | 107.2 | 162.7 | -145.3 | 177.4 | 99 | 0 | 0 | 107 | ||||
| 171 | S | 35 | Very low | 40.8 | Very low | 83 Ų | 83 | 147.3 Ų | 147.3 | 58% | 0.58 | 81% | 0.805 | S | S | * | * | trans | -91.2 | 132.4 | 175.8 | -66.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 172 | T | 38.3 | Very low | 41 | Very low | 134 Ų | 134 | 141.5 Ų | 141.5 | 82% | 0.822 | 80% | 0.796 | S | S | * | * | trans | 178.3 | 147.7 | 133.9 | 41.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 173 | S | 38 | Very low | 40.7 | Very low | 125 Ų | 125 | 139.9 Ų | 139.9 | 87% | 0.874 | 80% | 0.796 | S | S | * | * | S | Bend | trans | 84.6 | 124.6 | 171 | 80.7 | 0 | 0 | 0 | 0 | 117.1 | ||
| 174 | G | 47.4 | Very low | 40.8 | Very low | 85 Ų | 85 | 136.1 Ų | 136.1 | 88% | 0.876 | 79% | 0.788 | S | S | * | * | trans | -70.5 | 143.6 | -163.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 175 | S | 43.4 | Very low | 40.8 | Very low | 121 Ų | 121 | 132.9 Ų | 132.9 | 85% | 0.846 | 79% | 0.788 | S | S | * | * | trans | -140.1 | 121.2 | 160.2 | -173.5 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 176 | L | 46.8 | Very low | 41 | Very low | 169 Ų | 169 | 132.4 Ų | 132.4 | 89% | 0.885 | 78% | 0.783 | S | S | * | * | trans | -52.5 | 136.2 | -176.9 | -64.3 | 160.6 | 0 | 0 | 0 | 110.9 | ||||
| 177 | G | 40.5 | Very low | 41.1 | Very low | 68 Ų | 68 | 128.7 Ų | 128.7 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | -58.8 | 136.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | I179 | G177-I179 PolarHBondContact O-N 3.06Š| ||
| 178 | N | 43.5 | Very low | 41.3 | Very low | 160 Ų | 160 | 127 Ų | 127 | 86% | 0.856 | 79% | 0.786 | S | S | * | * | trans | -62.4 | 100 | 164.2 | -93.5 | -9.1 | 0 | 0 | 0 | 109.4 | S180 | N178-S180 VanDerWaalsContact C-N 3.32Å; N178-S180 PolarHBondContact O-N 3.23Å | ||
| 179 | I | 43.3 | Very low | 42.5 | Very low | 159 Ų | 159 | 124.5 Ų | 124.5 | 82% | 0.815 | 78% | 0.784 | S | S | * | * | trans | -84.8 | 78.5 | 158 | 47.9 | 158.4 | 0 | 0 | 0 | 109 | G177 | G177-I179 PolarHBondContact O-N 3.06Š| ||
| 180 | S | 46.8 | Very low | 43.7 | Very low | 106 Ų | 106 | 120.8 Ų | 120.8 | 74% | 0.741 | 78% | 0.784 | S | S | * | * | trans | -100.7 | 71.8 | 162 | -68.7 | 0 | 0 | 0 | 0 | 108.9 | N178 | N178-S180 VanDerWaalsContact C-N 3.32Å; N178-S180 PolarHBondContact O-N 3.23Å | ||
| 181 | T | 48.4 | Very low | 44.3 | Very low | 135 Ų | 135 | 116.6 Ų | 116.6 | 83% | 0.828 | 79% | 0.787 | S | S | * | * | trans | -105.9 | 74 | 156.8 | 48.5 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 182 | A | 40.2 | Very low | 44.9 | Very low | 90 Ų | 90 | 118.6 Ų | 118.6 | 74% | 0.744 | 80% | 0.796 | S | S | * | * | trans | -103.9 | 107.8 | 161.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | S184 | A182-S184 PolarHBondContact O-N 3.24Å; A182-S184 VanDerWaalsContact O-N 3.15Å | ||
| 183 | S | 42.4 | Very low | 45.3 | Very low | 114 Ų | 114 | 118.5 Ų | 118.5 | 80% | 0.797 | 80% | 0.798 | S | S | * | * | trans | -47.4 | 108.5 | 174.2 | -24.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 184 | S | 41.9 | Very low | 45.6 | Very low | 103 Ų | 103 | 117 Ų | 117 | 72% | 0.72 | 79% | 0.792 | S | S | * | * | trans | -101.6 | 107.7 | 156.8 | -64.4 | 0 | 0 | 0 | 0 | 106.4 | A182 C186 | A182-S184 PolarHBondContact O-N 3.24Å; A182-S184 VanDerWaalsContact O-N 3.15Å; S184-C186 PolarHBondContact O-N 3.26Å | ||
| 185 | N | 46.9 | Very low | 45.6 | Very low | 161 Ų | 161 | 118.8 Ų | 118.8 | 86% | 0.861 | 79% | 0.789 | S | S | * | * | trans | -65.8 | 81.5 | 162.8 | -85 | 42.6 | 0 | 0 | 0 | 108.1 | ||||
| 186 | C | 43.3 | Very low | 46.1 | Very low | 98 Ų | 98 | 119.2 Ų | 119.2 | 66% | 0.662 | 79% | 0.792 | S | S | * | * | trans | -105.4 | 97.2 | 154.7 | 70.3 | 0 | 0 | 0 | 0 | 107.4 | S184 S188 | S184-C186 PolarHBondContact O-N 3.26Å; C186-S188 VanDerWaalsContact C-N 3.26Å; C186-S188 PolarHBondContact O-N 2.85Å | ||
| 187 | S | 41.5 | Very low | 45.8 | Very low | 119 Ų | 119 | 114.5 Ų | 114.5 | 83% | 0.832 | 78% | 0.784 | S | S | * | * | trans | -69.5 | 89.3 | 168.7 | -57.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 188 | S | 43.7 | Very low | 46.3 | Very low | 100 Ų | 100 | 119.5 Ų | 119.5 | 70% | 0.699 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -91.5 | 126.5 | 155.5 | -65.7 | 0 | 0 | 0 | 0 | 107.2 | C186 | C186-S188 VanDerWaalsContact C-N 3.26Å; C186-S188 PolarHBondContact O-N 2.85Å |
| 189 | P | 57 | Low | 46 | Very low | 116 Ų | 116 | 115.2 Ų | 115.2 | 75% | 0.753 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 146.4 | 177.4 | 28.4 | -31.8 | 0 | 0 | 0 | 110.1 | ||
| 190 | P | 52.8 | Low | 46.2 | Very low | 119 Ų | 119 | 119.7 Ų | 119.7 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 151.2 | 175.5 | 30.3 | -32.8 | 0 | 0 | 0 | 110.1 | T192 | P190-T192 PolarHBondContact O-N 3.4Š|
| 191 | G | 49.2 | Very low | 45.9 | Very low | 84 Ų | 84 | 120 Ų | 120 | 87% | 0.866 | 80% | 0.797 | S | S | * | * | trans | -45.9 | 131.4 | -165.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 192 | T | 47.2 | Very low | 45.7 | Very low | 125 Ų | 125 | 119 Ų | 119 | 77% | 0.767 | 79% | 0.793 | S | S | * | * | trans | -117.2 | 141 | 155.9 | 50.5 | 0 | 0 | 0 | 0 | 107.9 | P190 A194 | P190-T192 PolarHBondContact O-N 3.4Å; T192-A194 PolarHBondContact O-N 3.01Å | ||
| 193 | P | 47.6 | Very low | 45.8 | Very low | 132 Ų | 132 | 120.2 Ų | 120.2 | 86% | 0.857 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 117.9 | 178.5 | 28.1 | -31.7 | 0 | 0 | 0 | 109 | ||
| 194 | A | 43.2 | Very low | 46.2 | Very low | 92 Ų | 92 | 123.5 Ų | 123.5 | 76% | 0.76 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 137.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | T192 | T192-A194 PolarHBondContact O-N 3.01Š|
| 195 | P | 48.6 | Very low | 46.2 | Very low | 123 Ų | 123 | 122 Ų | 122 | 80% | 0.799 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 142.9 | 173.1 | 31.3 | -32 | 0 | 0 | 0 | 110.9 | G197 | P195-G197 PolarHBondContact O-N 3.5Š|
| 196 | S | 53.3 | Low | 45.8 | Very low | 131 Ų | 131 | 117.7 Ų | 117.7 | 92% | 0.916 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 116.7 | 174.7 | -64.9 | 0 | 0 | 0 | 0 | 111.8 | ||
| 197 | G | 40.1 | Very low | 46.3 | Very low | 69 Ų | 69 | 123.3 Ų | 123.3 | 71% | 0.711 | 81% | 0.806 | S | S | * | * | trans | -133.8 | 108.4 | 174 | 0 | 0 | 0 | 0 | 0 | 110.8 | P195 G199 | P195-G197 PolarHBondContact O-N 3.5Å; G197-G199 PolarHBondContact O-N 3.02Å | ||
| 198 | N | 51.6 | Low | 46.6 | Very low | 173 Ų | 173 | 123 Ų | 123 | 93% | 0.925 | 80% | 0.804 | S | S | * | * | trans | -63.2 | 99.3 | 174.5 | -75.5 | 9 | 0 | 0 | 0 | 111.1 | ||||
| 199 | G | 36 | Very low | 47 | Very low | 71 Ų | 71 | 124.2 Ų | 124.2 | 73% | 0.732 | 81% | 0.813 | S | S | * | * | trans | -107.3 | 89.3 | 171 | 0 | 0 | 0 | 0 | 0 | 111.7 | G197 S201 | G197-G199 PolarHBondContact O-N 3.02Å; G199-S201 PolarHBondContact O-N 3.44Å | ||
| 200 | R | 48.8 | Very low | 46.7 | Very low | 253 Ų | 253 | 122 Ų | 122 | 96% | 0.955 | 80% | 0.8 | S | S | * | * | trans | -70.5 | 115 | 166.8 | -81.6 | 176.7 | 157.7 | -152.1 | -3 | 109.2 | ||||
| 201 | S | 40.6 | Very low | 46.4 | Very low | 111 Ų | 111 | 119.2 Ų | 119.2 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | trans | -93.7 | 145.6 | 160.1 | -68.6 | 0 | 0 | 0 | 0 | 109.9 | G199 S203 | G199-S201 PolarHBondContact O-N 3.44Å; S201-S203 PolarHBondContact O-N 3.44Å | ||
| 202 | P | 44.8 | Very low | 46.7 | Very low | 116 Ų | 116 | 126 Ų | 126 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | trans | -75.1 | 113.8 | -173.2 | 30.6 | -31.7 | 0 | 0 | 0 | 110.2 | H204 | P202-H204 PolarHBondContact O-N 3.39Å; P202-H204 VanDerWaalsContact O-N 3.1Å | ||
| 203 | S | 42.2 | Very low | 46.8 | Very low | 115 Ų | 115 | 123.6 Ų | 123.6 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | trans | -72.3 | 95.1 | 169.3 | 160.9 | 0 | 0 | 0 | 0 | 109.2 | S201 G205 | S201-S203 PolarHBondContact O-N 3.44Å; S203-G205 PolarHBondContact O-N 3.1Å | ||
| 204 | H | 48.9 | Very low | 47.4 | Very low | 183 Ų | 183 | 127.6 Ų | 127.6 | 85% | 0.847 | 79% | 0.79 | S | S | * | * | trans | -66.6 | 110 | 155.8 | -88.2 | -58.4 | 0 | 0 | 0 | 108.5 | P202 G206 | P202-H204 PolarHBondContact O-N 3.39Å; P202-H204 VanDerWaalsContact O-N 3.1Å; H204-G206 PolarHBondContact O-N 3.06Å; H204-G206 VanDerWaalsContact O-N 3.14Å | ||
| 205 | G | 41.9 | Very low | 48.3 | Very low | 72 Ų | 72 | 129.7 Ų | 129.7 | 74% | 0.742 | 78% | 0.782 | S | S | * | * | trans | -61.8 | 109.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | S203 | S203-G205 PolarHBondContact O-N 3.1Š| ||
| 206 | G | 40.1 | Very low | 49 | Very low | 70 Ų | 70 | 135.6 Ų | 135.6 | 72% | 0.722 | 79% | 0.789 | S | S | * | * | trans | -111.7 | 95.4 | 154.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | H204 S208 | H204-G206 PolarHBondContact O-N 3.06Å; H204-G206 VanDerWaalsContact O-N 3.14Å; G206-S208 PolarHBondContact O-N 3.33Å | ||
| 207 | K | 53.7 | Low | 49.6 | Very low | 216 Ų | 216 | 133 Ų | 133 | 94% | 0.939 | 76% | 0.764 | S | S | * | * | trans | -62.5 | 102.8 | 173.4 | -60.5 | 172.7 | 179.7 | 178.1 | 0 | 108.3 | ||||
| 208 | S | 47.1 | Very low | 51.5 | Low | 113 Ų | 113 | 135.1 Ų | 135.1 | 79% | 0.79 | 76% | 0.759 | S | S | * | * | trans | -145.1 | 108.6 | 149.9 | 60.5 | 0 | 0 | 0 | 0 | 108.8 | G206 S210 | G206-S208 PolarHBondContact O-N 3.33Å; S208-S210 PolarHBondContact O-N 3.29Å | ||
| 209 | S | 53.4 | Low | 53.1 | Low | 125 Ų | 125 | 134 Ų | 134 | 87% | 0.874 | 75% | 0.746 | S | S | * | * | trans | -59.5 | 113.6 | 172.6 | 50.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 210 | S | 49.5 | Very low | 55.5 | Low | 69 Ų | 69 | 137.4 Ų | 137.4 | 48% | 0.483 | 75% | 0.747 | S | S | . | * | trans | -165.3 | 102.9 | 141.4 | -176.4 | 0 | 0 | 0 | 0 | 108.6 | S208 K215 | S208-S210 PolarHBondContact O-N 3.29Å; S210-K215 WeakPolarHBondContact OG-CE 3.33Å; S210-K215 PolarHBondContact OG-NZ 3.49Å | ||
| 211 | G | 46.8 | Very low | 57.7 | Low | 61 Ų | 61 | 126.9 Ų | 126.9 | 63% | 0.629 | 71% | 0.713 | S | S | * | * | trans | -48.4 | 147.4 | 170.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | S213 | G211-S213 PolarHBondContact O-N 3.46Å; G211-S213 PolarHBondContact O-OG 3Å | ||
| 212 | K | 54.9 | Low | 60.1 | Low | 226 Ų | 226 | 128.2 Ų | 128.2 | 98% | 0.983 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -48 | 84.8 | 170.2 | -73.1 | 162.8 | 176.7 | 166.6 | 0 | 110.7 | ||
| 213 | S | 50.7 | Low | 62.5 | Low | 74 Ų | 74 | 127 Ų | 127 | 52% | 0.517 | 69% | 0.691 | S | S | . | * | trans | -122.3 | 135.1 | 156.7 | 40.6 | 0 | 0 | 0 | 0 | 103.9 | G211 K215 | G211-S213 PolarHBondContact O-N 3.46Å; G211-S213 PolarHBondContact O-OG 3Å; S213-K215 PolarHBondContact O-N 3.24Å | ||
| 214 | K | 59.7 | Low | 65 | Low | 216 Ų | 216 | 125.1 Ų | 125.1 | 94% | 0.939 | 67% | 0.667 | S | S | * | * | trans | -66.8 | 68.1 | -179.9 | -165 | 172.1 | -176.5 | 169.3 | 0 | 108.3 | R216 | K214-R216 PolarHBondContact O-N 2.94Š| ||
| 215 | K | 61.5 | Low | 67.2 | Low | 137 Ų | 137 | 125 Ų | 125 | 60% | 0.596 | 66% | 0.659 | S | S | * | * | trans | -62 | 112.3 | 174.9 | -75.8 | -177 | 176.1 | 173.3 | 0 | 105 | S210 S213 L217 | S210-K215 WeakPolarHBondContact OG-CE 3.33Å; S210-K215 PolarHBondContact OG-NZ 3.49Å; S213-K215 PolarHBondContact O-N 3.24Å; K215-L217 PolarHBondContact O-N 2.83Å | ||
| 216 | R | 63.8 | Low | 69.8 | Low | 247 Ų | 247 | 124.3 Ų | 124.3 | 93% | 0.932 | 64% | 0.638 | S | S | * | * | trans | -56.5 | 100.8 | 165.2 | -74.1 | -166.2 | 166.3 | -128.4 | 0.5 | 105.5 | K214 D218 | K214-R216 PolarHBondContact O-N 2.94Å; R216-D218 PolarHBondContact O-N 3.12Å | ||
| 217 | L | 66.4 | Low | 72.5 | Confident | 77 Ų | 77 | 126.7 Ų | 126.7 | 40% | 0.403 | 63% | 0.625 | S | S | . | * | trans | -60 | 127.3 | 173 | -70.4 | 168.7 | 0 | 0 | 0 | 106.3 | K215 K219 R227 | K215-L217 PolarHBondContact O-N 2.83Å; L217-K219 PolarHBondContact O-N 3.03Å; L217-R227 VanDerWaalsContact CD1-NH1 3.33Å | ||
| 218 | D | 79.8 | Confident | 74.6 | Confident | 112 Ų | 112 | 121.4 Ų | 121.4 | 60% | 0.599 | 60% | 0.599 | S | S | * | * | trans | -60.5 | 129.4 | 174.8 | -170.2 | 2.8 | 0 | 0 | 0 | 108.9 | R216 D220 S221 | R216-D218 PolarHBondContact O-N 3.12Å; D218-D220 PolarHBondContact O-N 2.97Å; D218-S221 WeakPolarHBondContact O-CB 3.43Å; D218-S221 PolarHBondContact O-N 2.85Å; D218-S221 PolarHBondContact O-OG 2.92Å | ||
| 219 | K | 85.4 | Confident | 77 | Confident | 149 Ų | 149 | 121.2 Ų | 121.2 | 65% | 0.648 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | -25.4 | -171.1 | -76 | 176.2 | 169.4 | -127.9 | 0 | 112.1 | L217 Y224 | L217-K219 PolarHBondContact O-N 3.03Å; K219-Y224 WeakPolarHBondContact O-CD1 3.19Å |
| 220 | D | 86.3 | Confident | 79.1 | Confident | 143 Ų | 143 | 122.4 Ų | 122.4 | 77% | 0.765 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.5 | 1.9 | -178.5 | -59.6 | -37.4 | 0 | 0 | 0 | 112.7 | D218 | D218-D220 PolarHBondContact O-N 2.97Š|
| 221 | S | 93.4 | Very high | 81.5 | Confident | 32 Ų | 32 | 122.7 Ų | 122.7 | 22% | 0.224 | 57% | 0.567 | C | S | . | * | trans | -65.3 | 139 | 173.8 | 64.7 | 0 | 0 | 0 | 0 | 111.8 | D218 E223 Y224 R225 | D218-S221 WeakPolarHBondContact O-CB 3.43Å; D218-S221 PolarHBondContact O-N 2.85Å; D218-S221 PolarHBondContact O-OG 2.92Å; S221-E223 VanDerWaalsContact C-N 3.26Å; S221-E223 PolarHBondContact O-N 3.3Å; S221-Y224 WeakPolarHBondContact O-CB 3.31Å; S221-Y224 PolarHBondContact O-N 3.11Å; S221-Y224 VanDerWaalsContact O-N 3.08Å; S221-Y224 WeakPolarHBondContact OG-CB 3.41Å; S221-Y224 PolarHBondContact OG-N 3.03Å; S221-R225 PolarHBondContact O-N 2.89Å; S221-R225 VanDerWaalsContact O-N 3.09Å | ||
| 222 | E | 92.5 | Very high | 83.9 | Confident | 140 Ų | 140 | 123.2 Ų | 123.2 | 65% | 0.654 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -59.6 | -38.1 | 177.6 | -177.4 | -100.4 | -170.2 | 0 | 0 | 111.7 | Y224 R225 L226 | E222-Y224 PolarHBondContact O-N 3.45Å; E222-R225 PolarHBondContact O-N 2.82Å; E222-L226 PolarHBondContact O-N 2.91Å; E222-L226 WeakPolarHBondContact OE1-CD1 3.41Å |
| 223 | E | 93.8 | Very high | 86 | Confident | 91 Ų | 91 | 116.8 Ų | 116.8 | 43% | 0.425 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -58 | -44.6 | 172.6 | -174.3 | -173.1 | -170.7 | 0 | 0 | 112.5 | S221 R227 | S221-E223 VanDerWaalsContact C-N 3.26Å; S221-E223 PolarHBondContact O-N 3.3Å; E223-R227 WeakPolarHBondContact O-CG 3.47Å; E223-R227 PolarHBondContact O-N 3.45Å; E223-R227 IonicContact OE1-CZ 2.84Å; E223-R227 IonicContact OE1-NE 2.66Å; E223-R227 IonicContact OE1-NH1 3.14Å; E223-R227 PolarHBondContact OE1-NH1 3.14Å; E223-R227 IonicContact OE1-NH2 3.3Å; E223-R227 PolarHBondContact OE1-NH2 3.38Å |
| 224 | Y | 95.5 | Very high | 88.3 | Confident | 74 Ų | 74 | 115.8 Ų | 115.8 | 29% | 0.29 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.2 | -46 | 176.9 | 177 | -95.9 | 0 | 0 | 0 | 111 | K219 S221 E222 L226 R227 R228 | K219-Y224 WeakPolarHBondContact O-CD1 3.19Å; S221-Y224 WeakPolarHBondContact O-CB 3.31Å; S221-Y224 PolarHBondContact O-N 3.11Å; S221-Y224 VanDerWaalsContact O-N 3.08Å; S221-Y224 WeakPolarHBondContact OG-CB 3.41Å; S221-Y224 PolarHBondContact OG-N 3.03Å; E222-Y224 PolarHBondContact O-N 3.45Å; Y224-L226 PolarHBondContact O-N 2.98Å; Y224-R227 PolarHBondContact O-N 3.28Å; Y224-R228 HydrophobicContact CD1-CG 3.93Å; Y224-R228 HydrophobicContact CD2-CG 4.31Å; Y224-R228 HydrophobicContact CE1-CG 3.49Å; Y224-R228 VanDerWaalsContact CE1-CG 3.49Å; Y224-R228 HydrophobicContact CE2-CG 3.91Å; Y224-R228 HydrophobicContact CG-CG 4.33Å; Y224-R228 VanDerWaalsContact CZ-CG 3.48Å; Y224-R228 WeakPolarHBondContact O-CG 3.44Å; Y224-R228 PolarHBondContact O-N 2.84Å |
| 225 | R | 95.3 | Very high | 90.1 | Very high | 181 Ų | 181 | 108.7 Ų | 108.7 | 68% | 0.683 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -56.3 | -50.7 | 177.4 | -78.3 | -178 | 58.3 | 140.4 | -1.8 | 112 | S221 E222 R227 R228 E229 | S221-R225 PolarHBondContact O-N 2.89Å; S221-R225 VanDerWaalsContact O-N 3.09Å; E222-R225 PolarHBondContact O-N 2.82Å; R225-R227 VanDerWaalsContact C-N 3.32Å; R225-R227 PolarHBondContact O-N 3.4Å; R225-R228 PolarHBondContact O-N 3.47Å; R225-R228 VanDerWaalsContact O-N 3.16Å; R225-E229 WeakPolarHBondContact O-CB 3.49Å; R225-E229 PolarHBondContact O-N 3.31Å |
| 226 | L | 95.8 | Very high | 91.9 | Very high | 58 Ų | 58 | 109.2 Ų | 109.2 | 30% | 0.304 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.8 | -38.6 | 178.9 | -71 | 175.2 | 0 | 0 | 0 | 112.2 | E222 Y224 R230 | E222-L226 PolarHBondContact O-N 2.91Å; E222-L226 WeakPolarHBondContact OE1-CD1 3.41Å; Y224-L226 PolarHBondContact O-N 2.98Å; L226-R230 WeakPolarHBondContact O-CG 3.3Å; L226-R230 PolarHBondContact O-N 3.17Å; L226-R230 PolarHBondContact O-NH1 3.39Å |
| 227 | R | 96.8 | Very high | 93.6 | Very high | 119 Ų | 119 | 105.2 Ų | 105.2 | 45% | 0.449 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.3 | -42.6 | 175 | -76.3 | 176.2 | 174.9 | 172.3 | 1.9 | 111.9 | L217 E223 Y224 R225 N231 | L217-R227 VanDerWaalsContact CD1-NH1 3.33Å; E223-R227 WeakPolarHBondContact O-CG 3.47Å; E223-R227 PolarHBondContact O-N 3.45Å; E223-R227 IonicContact OE1-CZ 2.84Å; E223-R227 IonicContact OE1-NE 2.66Å; E223-R227 IonicContact OE1-NH1 3.14Å; E223-R227 PolarHBondContact OE1-NH1 3.14Å; E223-R227 IonicContact OE1-NH2 3.3Å; E223-R227 PolarHBondContact OE1-NH2 3.38Å; Y224-R227 PolarHBondContact O-N 3.28Å; R225-R227 VanDerWaalsContact C-N 3.32Å; R225-R227 PolarHBondContact O-N 3.4Å; R227-N231 WeakPolarHBondContact O-CB 3.42Å; R227-N231 PolarHBondContact O-N 2.99Å |
| 228 | R | 97.8 | Very high | 95.1 | Very high | 106 Ų | 106 | 105.3 Ų | 105.3 | 40% | 0.4 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -67.1 | -41.8 | 177.7 | -68.6 | -58.2 | -63.1 | 157.5 | 2.1 | 111.8 | Y224 R225 N231 N232 | Y224-R228 HydrophobicContact CD1-CG 3.93Å; Y224-R228 HydrophobicContact CD2-CG 4.31Å; Y224-R228 HydrophobicContact CE1-CG 3.49Å; Y224-R228 VanDerWaalsContact CE1-CG 3.49Å; Y224-R228 HydrophobicContact CE2-CG 3.91Å; Y224-R228 HydrophobicContact CG-CG 4.33Å; Y224-R228 VanDerWaalsContact CZ-CG 3.48Å; Y224-R228 WeakPolarHBondContact O-CG 3.44Å; Y224-R228 PolarHBondContact O-N 2.84Å; R225-R228 PolarHBondContact O-N 3.47Å; R225-R228 VanDerWaalsContact O-N 3.16Å; R228-N231 PolarHBondContact NH1-OD1 3.24Å; R228-N231 PolarHBondContact O-N 3.14Å; R228-N232 WeakPolarHBondContact O-CB 3.44Å; R228-N232 PolarHBondContact O-N 3.45Å; R228-N232 PolarHBondContact O-ND2 2.66Å; R228-N232 PolarHBondContact O-OD1 3.29Å |
| 229 | E | 97.6 | Very high | 96 | Very high | 109 Ų | 109 | 107.8 Ų | 107.8 | 51% | 0.509 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.8 | -50.3 | 176.7 | -174.4 | 176.7 | -174.2 | 0 | 0 | 111.7 | R225 N231 N232 L233 | R225-E229 WeakPolarHBondContact O-CB 3.49Å; R225-E229 PolarHBondContact O-N 3.31Å; E229-N231 VanDerWaalsContact C-N 3.3Å; E229-N231 PolarHBondContact O-N 2.98Å; E229-N232 PolarHBondContact O-N 2.94Å; E229-N232 VanDerWaalsContact O-N 3.17Å; E229-L233 WeakPolarHBondContact O-CG 3.43Å; E229-L233 PolarHBondContact O-N 3.49Å |
| 230 | R | 98.6 | Very high | 96.7 | Very high | 150 Ų | 150 | 104.3 Ų | 104.3 | 57% | 0.566 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -57.9 | -42.4 | 174.5 | -71 | -173.9 | -154.9 | 97.8 | -5.4 | 112.1 | L226 L233 A234 | L226-R230 WeakPolarHBondContact O-CG 3.3Å; L226-R230 PolarHBondContact O-N 3.17Å; L226-R230 PolarHBondContact O-NH1 3.39Å; R230-L233 PolarHBondContact O-N 2.78Å; R230-A234 WeakPolarHBondContact O-CB 3.25Å; R230-A234 PolarHBondContact O-N 3.46Å |
| 231 | N | 98.4 | Very high | 97.3 | Very high | 74 Ų | 74 | 103.9 Ų | 103.9 | 40% | 0.396 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65 | -42.5 | 177.7 | -177.7 | -112.1 | 0 | 0 | 0 | 111.8 | R227 R228 E229 L233 A234 V235 | R227-N231 WeakPolarHBondContact O-CB 3.42Å; R227-N231 PolarHBondContact O-N 2.99Å; R228-N231 PolarHBondContact NH1-OD1 3.24Å; R228-N231 PolarHBondContact O-N 3.14Å; E229-N231 VanDerWaalsContact C-N 3.3Å; E229-N231 PolarHBondContact O-N 2.98Å; N231-L233 VanDerWaalsContact C-N 3.29Å; N231-L233 PolarHBondContact O-N 3.37Å; N231-A234 PolarHBondContact O-N 3.04Å; N231-V235 VanDerWaalsContact O-CG2 3.3Å; N231-V235 WeakPolarHBondContact O-CG2 3.45Å; N231-V235 PolarHBondContact O-N 3.41Å |
| 232 | N | 98.6 | Very high | 97.5 | Very high | 73 Ų | 73 | 104 Ų | 104 | 39% | 0.39 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.4 | -39.4 | 176.5 | -69.6 | -17.3 | 0 | 0 | 0 | 111.5 | R228 E229 R236 | R228-N232 WeakPolarHBondContact O-CB 3.44Å; R228-N232 PolarHBondContact O-N 3.45Å; R228-N232 PolarHBondContact O-ND2 2.66Å; R228-N232 PolarHBondContact O-OD1 3.29Å; E229-N232 PolarHBondContact O-N 2.94Å; E229-N232 VanDerWaalsContact O-N 3.17Å; N232-R236 WeakPolarHBondContact O-CG 3.18Å; N232-R236 PolarHBondContact O-N 2.87Å |
| 233 | L | 98.5 | Very high | 97.8 | Very high | 90 Ų | 90 | 103.2 Ų | 103.2 | 47% | 0.471 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64 | -46.6 | 172.6 | -69.7 | 170.8 | 0 | 0 | 0 | 111.7 | E229 R230 N231 V235 R236 K237 | E229-L233 WeakPolarHBondContact O-CG 3.43Å; E229-L233 PolarHBondContact O-N 3.49Å; R230-L233 PolarHBondContact O-N 2.78Å; N231-L233 VanDerWaalsContact C-N 3.29Å; N231-L233 PolarHBondContact O-N 3.37Å; L233-V235 VanDerWaalsContact C-N 3.3Å; L233-V235 PolarHBondContact O-N 3.31Å; L233-R236 PolarHBondContact O-N 3.33Å; L233-K237 WeakPolarHBondContact O-CB 3.48Å; L233-K237 PolarHBondContact O-N 2.89Å |
| 234 | A | 98.6 | Very high | 98.1 | Very high | 54 Ų | 54 | 103.6 Ų | 103.6 | 45% | 0.446 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.8 | -39.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | R230 N231 S238 | R230-A234 WeakPolarHBondContact O-CB 3.25Å; R230-A234 PolarHBondContact O-N 3.46Å; N231-A234 PolarHBondContact O-N 3.04Å; A234-S238 VanDerWaalsContact O-CB 3.25Å; A234-S238 WeakPolarHBondContact O-CB 3.45Å; A234-S238 PolarHBondContact O-N 2.99Å |
| 235 | V | 98.8 | Very high | 98.2 | Very high | 66 Ų | 66 | 106.4 Ų | 106.4 | 40% | 0.4 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.3 | -47.4 | 175.9 | 170.1 | 0 | 0 | 0 | 0 | 110.8 | N231 L233 K237 S238 R239 | N231-V235 VanDerWaalsContact O-CG2 3.3Å; N231-V235 WeakPolarHBondContact O-CG2 3.45Å; N231-V235 PolarHBondContact O-N 3.41Å; L233-V235 VanDerWaalsContact C-N 3.3Å; L233-V235 PolarHBondContact O-N 3.31Å; V235-K237 PolarHBondContact O-N 3.44Å; V235-S238 PolarHBondContact O-N 3.45Å; V235-R239 HydrophobicContact CG1-CG 4.48Å; V235-R239 WeakPolarHBondContact O-CG 3.49Å; V235-R239 PolarHBondContact O-N 3.12Å |
| 236 | R | 98.8 | Very high | 98.4 | Very high | 148 Ų | 148 | 102.8 Ų | 102.8 | 56% | 0.558 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -56.2 | -52.5 | 175.4 | -77.5 | -174.2 | -84.5 | -179.8 | -4 | 110.9 | N232 L233 S238 R239 D240 | N232-R236 WeakPolarHBondContact O-CG 3.18Å; N232-R236 PolarHBondContact O-N 2.87Å; L233-R236 PolarHBondContact O-N 3.33Å; R236-S238 VanDerWaalsContact C-N 3.32Å; R236-S238 PolarHBondContact O-N 3.18Å; R236-R239 PolarHBondContact O-N 3.34Å; R236-R239 VanDerWaalsContact O-N 3.11Å; R236-D240 PolarHBondContact O-N 3.2Å |
| 237 | K | 98.8 | Very high | 98.5 | Very high | 164 Ų | 164 | 104.4 Ų | 104.4 | 71% | 0.713 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -57 | -42.2 | 177.2 | -172.6 | 173.3 | -175.7 | 172.3 | 0 | 112.8 | L233 V235 K241 | L233-K237 WeakPolarHBondContact O-CB 3.48Å; L233-K237 PolarHBondContact O-N 2.89Å; V235-K237 PolarHBondContact O-N 3.44Å; K237-K241 WeakPolarHBondContact O-CB 3.37Å; K237-K241 PolarHBondContact O-N 3.05Å |
| 238 | S | 98.8 | Very high | 98.6 | Very high | 78 Ų | 78 | 103.9 Ų | 103.9 | 55% | 0.545 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.2 | -43.7 | 177.2 | -176.2 | 0 | 0 | 0 | 0 | 111.9 | A234 V235 R236 K241 A242 | A234-S238 VanDerWaalsContact O-CB 3.25Å; A234-S238 WeakPolarHBondContact O-CB 3.45Å; A234-S238 PolarHBondContact O-N 2.99Å; V235-S238 PolarHBondContact O-N 3.45Å; R236-S238 VanDerWaalsContact C-N 3.32Å; R236-S238 PolarHBondContact O-N 3.18Å; S238-K241 PolarHBondContact O-N 3.5Å; S238-A242 PolarHBondContact O-N 2.94Å |
| 239 | R | 98.9 | Very high | 98.6 | Very high | 164 Ų | 164 | 102.9 Ų | 102.9 | 62% | 0.619 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63.2 | -44.8 | 177 | -71.7 | 177.1 | 73.3 | 162.8 | 3 | 111.6 | V235 R236 A242 K243 | V235-R239 HydrophobicContact CG1-CG 4.48Å; V235-R239 WeakPolarHBondContact O-CG 3.49Å; V235-R239 PolarHBondContact O-N 3.12Å; R236-R239 PolarHBondContact O-N 3.34Å; R236-R239 VanDerWaalsContact O-N 3.11Å; R239-A242 WeakPolarHBondContact O-CB 3.48Å; R239-A242 PolarHBondContact O-N 2.84Å; R239-K243 WeakPolarHBondContact O-CG 3.27Å; R239-K243 PolarHBondContact O-N 2.74Å |
| 240 | D | 98.8 | Very high | 98.7 | Very high | 77 Ų | 77 | 104 Ų | 104 | 41% | 0.412 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -69.5 | -37.5 | -179.1 | -63.3 | -29.4 | 0 | 0 | 0 | 111.5 | R236 A242 K243 M244 | R236-D240 PolarHBondContact O-N 3.2Å; D240-A242 VanDerWaalsContact C-N 3.3Å; D240-A242 PolarHBondContact O-N 2.84Å; D240-K243 PolarHBondContact O-N 3.15Å; D240-K243 IonicContact OD1-NZ 3.73Å; D240-K243 PolarHBondContact OD1-NZ 3.24Å; D240-M244 WeakPolarHBondContact O-CG 3.3Å; D240-M244 PolarHBondContact O-N 3.32Å |
| 241 | K | 98.8 | Very high | 98.7 | Very high | 133 Ų | 133 | 101.9 Ų | 101.9 | 58% | 0.578 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -59.5 | -40.5 | 169.6 | -174.4 | 173.7 | -176.6 | 175 | 0 | 112.1 | K237 S238 M244 R245 | K237-K241 WeakPolarHBondContact O-CB 3.37Å; K237-K241 PolarHBondContact O-N 3.05Å; S238-K241 PolarHBondContact O-N 3.5Å; K241-M244 PolarHBondContact O-N 3.02Å; K241-R245 WeakPolarHBondContact O-CG 3.4Å; K241-R245 PolarHBondContact O-N 3.19Å |
| 242 | A | 98.7 | Very high | 98.7 | Very high | 34 Ų | 34 | 103.3 Ų | 103.3 | 28% | 0.281 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.1 | -41.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | S238 R239 D240 R245 N246 | S238-A242 PolarHBondContact O-N 2.94Å; R239-A242 WeakPolarHBondContact O-CB 3.48Å; R239-A242 PolarHBondContact O-N 2.84Å; D240-A242 VanDerWaalsContact C-N 3.3Å; D240-A242 PolarHBondContact O-N 2.84Å; A242-R245 PolarHBondContact O-N 2.9Å; A242-N246 PolarHBondContact O-N 3.17Å; A242-N246 PolarHBondContact O-ND2 3.42Å |
| 243 | K | 98.8 | Very high | 98.7 | Very high | 124 Ų | 124 | 104.1 Ų | 104.1 | 54% | 0.539 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.9 | -45.6 | 174.1 | -68.6 | 173.6 | -167.6 | 157.8 | 0 | 111.8 | R239 D240 R245 N246 L247 | R239-K243 WeakPolarHBondContact O-CG 3.27Å; R239-K243 PolarHBondContact O-N 2.74Å; D240-K243 PolarHBondContact O-N 3.15Å; D240-K243 IonicContact OD1-NZ 3.73Å; D240-K243 PolarHBondContact OD1-NZ 3.24Å; K243-R245 PolarHBondContact O-N 3.41Å; K243-N246 WeakPolarHBondContact O-CB 3.36Å; K243-N246 PolarHBondContact O-N 3.49Å; K243-L247 PolarHBondContact O-N 3.45Å |
| 244 | M | 98.7 | Very high | 98.7 | Very high | 99 Ų | 99 | 105.7 Ų | 105.7 | 49% | 0.488 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.2 | -47.3 | 177.3 | -75.9 | -57.9 | -58.5 | 0 | 0 | 111.6 | D240 K241 N246 L247 E248 | D240-M244 WeakPolarHBondContact O-CG 3.3Å; D240-M244 PolarHBondContact O-N 3.32Å; K241-M244 PolarHBondContact O-N 3.02Å; M244-N246 VanDerWaalsContact C-N 3.29Å; M244-N246 PolarHBondContact O-N 3.4Å; M244-L247 PolarHBondContact O-N 2.88Å; M244-L247 VanDerWaalsContact O-N 3.12Å; M244-E248 WeakPolarHBondContact O-CB 3.42Å; M244-E248 VanDerWaalsContact O-CG 3.32Å; M244-E248 WeakPolarHBondContact O-CG 3.49Å; M244-E248 PolarHBondContact O-N 2.89Å |
| 245 | R | 98.7 | Very high | 98.7 | Very high | 134 Ų | 134 | 107.3 Ų | 107.3 | 51% | 0.506 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59 | -39.7 | 175.9 | -74.1 | -170.7 | -59.5 | -155.3 | 2.2 | 113 | K241 A242 K243 T249 | K241-R245 WeakPolarHBondContact O-CG 3.4Å; K241-R245 PolarHBondContact O-N 3.19Å; A242-R245 PolarHBondContact O-N 2.9Å; K243-R245 PolarHBondContact O-N 3.41Å; R245-T249 WeakPolarHBondContact O-CB 3.27Å; R245-T249 PolarHBondContact O-N 2.93Å; R245-T249 PolarHBondContact O-OG1 2.92Å |
| 246 | N | 98.7 | Very high | 98.7 | Very high | 104 Ų | 104 | 109 Ų | 109 | 56% | 0.556 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.7 | -41.9 | 176.7 | -72.8 | -22.5 | 0 | 0 | 0 | 111.6 | A242 K243 M244 T249 Q250 | A242-N246 PolarHBondContact O-N 3.17Å; A242-N246 PolarHBondContact O-ND2 3.42Å; K243-N246 WeakPolarHBondContact O-CB 3.36Å; K243-N246 PolarHBondContact O-N 3.49Å; M244-N246 VanDerWaalsContact C-N 3.29Å; M244-N246 PolarHBondContact O-N 3.4Å; N246-T249 PolarHBondContact O-N 2.98Å; N246-Q250 WeakPolarHBondContact O-CG 3.5Å; N246-Q250 PolarHBondContact O-N 2.96Å |
| 247 | L | 98.6 | Very high | 98.7 | Very high | 93 Ų | 93 | 104.2 Ų | 104.2 | 49% | 0.487 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66 | -45.3 | 177 | -174.8 | 144.2 | 0 | 0 | 0 | 111.7 | K243 M244 T249 Q250 Q251 | K243-L247 PolarHBondContact O-N 3.45Å; M244-L247 PolarHBondContact O-N 2.88Å; M244-L247 VanDerWaalsContact O-N 3.12Å; L247-T249 PolarHBondContact O-N 3.38Å; L247-Q250 WeakPolarHBondContact O-CB 3.48Å; L247-Q250 PolarHBondContact O-N 2.97Å; L247-Q251 PolarHBondContact O-N 3.03Å |
| 248 | E | 98.6 | Very high | 98.7 | Very high | 107 Ų | 107 | 101.4 Ų | 101.4 | 50% | 0.5 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -57 | -40.5 | 173.7 | -72.6 | 165.5 | -172.6 | 0 | 0 | 111.2 | M244 Q251 K252 | M244-E248 WeakPolarHBondContact O-CB 3.42Å; M244-E248 VanDerWaalsContact O-CG 3.32Å; M244-E248 WeakPolarHBondContact O-CG 3.49Å; M244-E248 PolarHBondContact O-N 2.89Å; E248-Q251 PolarHBondContact O-N 3.49Å; E248-K252 WeakPolarHBondContact O-CB 3.49Å; E248-K252 PolarHBondContact O-N 3.23Å |
| 249 | T | 98.8 | Very high | 98.7 | Very high | 85 Ų | 85 | 101.1 Ų | 101.1 | 52% | 0.521 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.8 | -45.1 | 177.5 | -58.3 | 0 | 0 | 0 | 0 | 111 | R245 N246 L247 Q251 K252 V253 | R245-T249 WeakPolarHBondContact O-CB 3.27Å; R245-T249 PolarHBondContact O-N 2.93Å; R245-T249 PolarHBondContact O-OG1 2.92Å; N246-T249 PolarHBondContact O-N 2.98Å; L247-T249 PolarHBondContact O-N 3.38Å; T249-Q251 VanDerWaalsContact C-N 3.33Å; T249-Q251 PolarHBondContact O-N 2.82Å; T249-K252 PolarHBondContact O-N 3.39Å; T249-V253 WeakPolarHBondContact O-CG2 3.16Å; T249-V253 PolarHBondContact O-N 3.18Å |
| 250 | Q | 98.8 | Very high | 98.7 | Very high | 133 Ų | 133 | 97.2 Ų | 97.2 | 62% | 0.621 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60 | -44.6 | 175.4 | -72.7 | 174.1 | 0.7 | 0 | 0 | 111.5 | N246 L247 K252 V253 L254 | N246-Q250 WeakPolarHBondContact O-CG 3.5Å; N246-Q250 PolarHBondContact O-N 2.96Å; L247-Q250 WeakPolarHBondContact O-CB 3.48Å; L247-Q250 PolarHBondContact O-N 2.97Å; Q250-K252 VanDerWaalsContact C-N 3.31Å; Q250-K252 PolarHBondContact O-N 2.88Å; Q250-V253 PolarHBondContact O-N 2.93Å; Q250-L254 PolarHBondContact O-N 3.41Å |
| 251 | Q | 98.8 | Very high | 98.7 | Very high | 105 Ų | 105 | 97.7 Ų | 97.7 | 49% | 0.491 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.4 | -41.9 | 175.4 | -173 | 177.3 | -14.9 | 0 | 0 | 111.1 | L247 E248 T249 V253 L254 E255 | L247-Q251 PolarHBondContact O-N 3.03Å; E248-Q251 PolarHBondContact O-N 3.49Å; T249-Q251 VanDerWaalsContact C-N 3.33Å; T249-Q251 PolarHBondContact O-N 2.82Å; Q251-V253 VanDerWaalsContact C-N 3.31Å; Q251-V253 PolarHBondContact O-N 2.89Å; Q251-L254 WeakPolarHBondContact O-CB 3.46Å; Q251-L254 PolarHBondContact O-N 2.89Å; Q251-L254 VanDerWaalsContact O-N 3.14Å; Q251-E255 WeakPolarHBondContact O-CG 3.37Å; Q251-E255 PolarHBondContact O-N 3.11Å |
| 252 | K | 98.8 | Very high | 98.7 | Very high | 104 Ų | 104 | 97.8 Ų | 97.8 | 45% | 0.452 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.9 | -36.8 | 179.2 | -169.2 | 57.8 | 179.7 | 177.6 | 0 | 112.9 | E248 T249 Q250 L254 E255 L256 | E248-K252 WeakPolarHBondContact O-CB 3.49Å; E248-K252 PolarHBondContact O-N 3.23Å; T249-K252 PolarHBondContact O-N 3.39Å; Q250-K252 VanDerWaalsContact C-N 3.31Å; Q250-K252 PolarHBondContact O-N 2.88Å; K252-L254 VanDerWaalsContact C-N 3.32Å; K252-E255 VanDerWaalsContact CD-OE2 3.27Å; K252-E255 WeakPolarHBondContact CD-OE2 3.43Å; K252-E255 IonicContact NZ-OE2 3.63Å; K252-E255 PolarHBondContact NZ-OE2 3.5Å; K252-E255 PolarHBondContact O-N 2.92Å; K252-L256 HydrophobicContact CD-CG 4.48Å; K252-L256 HydrophobicContact CG-CD1 4.16Å; K252-L256 HydrophobicContact CG-CG 4.41Å; K252-L256 WeakPolarHBondContact O-CB 3.39Å; K252-L256 VanDerWaalsContact O-CG 3.27Å; K252-L256 WeakPolarHBondContact O-CG 3.39Å; K252-L256 PolarHBondContact O-N 3.39Å |
| 253 | V | 98.8 | Very high | 98.7 | Very high | 91 Ų | 91 | 100.2 Ų | 100.2 | 55% | 0.552 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -60.9 | -43.4 | 174.2 | 169.8 | 0 | 0 | 0 | 0 | 110.8 | T249 Q250 Q251 L256 A257 | T249-V253 WeakPolarHBondContact O-CG2 3.16Å; T249-V253 PolarHBondContact O-N 3.18Å; Q250-V253 PolarHBondContact O-N 2.93Å; Q251-V253 VanDerWaalsContact C-N 3.31Å; Q251-V253 PolarHBondContact O-N 2.89Å; V253-L256 PolarHBondContact O-N 2.96Å; V253-A257 WeakPolarHBondContact O-CB 3.34Å; V253-A257 PolarHBondContact O-N 3.3Å |
| 254 | L | 98.8 | Very high | 98.7 | Very high | 123 Ų | 123 | 99 Ų | 99 | 64% | 0.644 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -65 | -44.3 | 177.3 | -64 | 175.5 | 0 | 0 | 0 | 111.9 | Q250 Q251 K252 L256 A257 V258 | Q250-L254 PolarHBondContact O-N 3.41Å; Q251-L254 WeakPolarHBondContact O-CB 3.46Å; Q251-L254 PolarHBondContact O-N 2.89Å; Q251-L254 VanDerWaalsContact O-N 3.14Å; K252-L254 VanDerWaalsContact C-N 3.32Å; L254-L256 VanDerWaalsContact C-N 3.33Å; L254-L256 PolarHBondContact O-N 3.01Å; L254-A257 PolarHBondContact O-N 3.37Å; L254-V258 WeakPolarHBondContact O-CG2 3.42Å; L254-V258 PolarHBondContact O-N 2.97Å; L254-V258 VanDerWaalsContact O-N 3.1Å |
| 255 | E | 98.7 | Very high | 98.7 | Very high | 87 Ų | 87 | 101 Ų | 101 | 41% | 0.407 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -57.8 | -46.6 | 175.2 | -71.4 | 173.5 | -168.4 | 0 | 0 | 111.8 | Q251 K252 A257 V258 E259 | Q251-E255 WeakPolarHBondContact O-CG 3.37Å; Q251-E255 PolarHBondContact O-N 3.11Å; K252-E255 VanDerWaalsContact CD-OE2 3.27Å; K252-E255 WeakPolarHBondContact CD-OE2 3.43Å; K252-E255 IonicContact NZ-OE2 3.63Å; K252-E255 PolarHBondContact NZ-OE2 3.5Å; K252-E255 PolarHBondContact O-N 2.92Å; E255-A257 VanDerWaalsContact C-N 3.34Å; E255-A257 PolarHBondContact O-N 3.26Å; E255-V258 PolarHBondContact O-N 3.46Å; E255-E259 PolarHBondContact O-N 3.49Å |
| 256 | L | 98.8 | Very high | 98.7 | Very high | 102 Ų | 102 | 100.1 Ų | 100.1 | 53% | 0.534 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.8 | -35.1 | 179.6 | -71.7 | 174.3 | 0 | 0 | 0 | 112.1 | K252 V253 L254 E259 N260 | K252-L256 HydrophobicContact CD-CG 4.48Å; K252-L256 HydrophobicContact CG-CD1 4.16Å; K252-L256 HydrophobicContact CG-CG 4.41Å; K252-L256 WeakPolarHBondContact O-CB 3.39Å; K252-L256 VanDerWaalsContact O-CG 3.27Å; K252-L256 WeakPolarHBondContact O-CG 3.39Å; K252-L256 PolarHBondContact O-N 3.39Å; V253-L256 PolarHBondContact O-N 2.96Å; L254-L256 VanDerWaalsContact C-N 3.33Å; L254-L256 PolarHBondContact O-N 3.01Å; L256-E259 PolarHBondContact O-N 2.87Å; L256-N260 VanDerWaalsContact O-CB 3.25Å; L256-N260 WeakPolarHBondContact O-CB 3.32Å; L256-N260 PolarHBondContact O-N 2.89Å |
| 257 | A | 98.6 | Very high | 98.7 | Very high | 48 Ų | 48 | 99.5 Ų | 99.5 | 40% | 0.397 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.7 | -46.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | V253 L254 E255 E259 N260 D261 | V253-A257 WeakPolarHBondContact O-CB 3.34Å; V253-A257 PolarHBondContact O-N 3.3Å; L254-A257 PolarHBondContact O-N 3.37Å; E255-A257 VanDerWaalsContact C-N 3.34Å; E255-A257 PolarHBondContact O-N 3.26Å; A257-E259 VanDerWaalsContact C-N 3.34Å; A257-E259 PolarHBondContact O-N 3.38Å; A257-N260 WeakPolarHBondContact O-CB 3.49Å; A257-N260 PolarHBondContact O-N 3.02Å; A257-D261 PolarHBondContact O-N 3.27Å |
| 258 | V | 98.8 | Very high | 98.7 | Very high | 105 Ų | 105 | 99.7 Ų | 99.7 | 64% | 0.636 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.2 | -43.8 | 176.7 | 173.5 | 0 | 0 | 0 | 0 | 111.4 | L254 E255 D261 R262 | L254-V258 WeakPolarHBondContact O-CG2 3.42Å; L254-V258 PolarHBondContact O-N 2.97Å; L254-V258 VanDerWaalsContact O-N 3.1Å; E255-V258 PolarHBondContact O-N 3.46Å; V258-D261 PolarHBondContact O-N 2.85Å; V258-R262 PolarHBondContact O-N 2.83Å |
| 259 | E | 98.6 | Very high | 98.7 | Very high | 72 Ų | 72 | 98.1 Ų | 98.1 | 34% | 0.336 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.2 | -37.3 | 178 | -177.5 | 56.8 | -160.2 | 0 | 0 | 112 | E255 L256 A257 R262 L263 | E255-E259 PolarHBondContact O-N 3.49Å; L256-E259 PolarHBondContact O-N 2.87Å; A257-E259 VanDerWaalsContact C-N 3.34Å; A257-E259 PolarHBondContact O-N 3.38Å; E259-R262 VanDerWaalsContact CD-NE 3.34Å; E259-R262 WeakPolarHBondContact O-CB 3.25Å; E259-R262 PolarHBondContact O-N 2.96Å; E259-R262 IonicContact OE1-CZ 2.72Å; E259-R262 VanDerWaalsContact OE1-CZ 3.3Å; E259-R262 IonicContact OE1-NE 3.79Å; E259-R262 PolarHBondContact OE1-NE 3.4Å; E259-R262 VanDerWaalsContact OE1-NE 3.14Å; E259-R262 IonicContact OE1-NH2 3.39Å; E259-R262 PolarHBondContact OE1-NH2 2.85Å; E259-R262 IonicContact OE2-CZ 2.98Å; E259-R262 IonicContact OE2-NE 2.59Å; E259-R262 PolarHBondContact OE2-NE 3.01Å; E259-R262 IonicContact OE2-NH2 2.89Å; E259-L263 HydrophobicContact CG-CD1 4.22Å; E259-L263 VanDerWaalsContact O-CG 3.3Å; E259-L263 WeakPolarHBondContact O-CG 3.47Å; E259-L263 PolarHBondContact O-N 3.35Å |
| 260 | N | 98.7 | Very high | 98.7 | Very high | 82 Ų | 82 | 97.5 Ų | 97.5 | 44% | 0.439 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.9 | -48.9 | 175.2 | -162.5 | -72.8 | 0 | 0 | 0 | 111 | L256 A257 R262 L263 Q264 | L256-N260 VanDerWaalsContact O-CB 3.25Å; L256-N260 WeakPolarHBondContact O-CB 3.32Å; L256-N260 PolarHBondContact O-N 2.89Å; A257-N260 WeakPolarHBondContact O-CB 3.49Å; A257-N260 PolarHBondContact O-N 3.02Å; N260-R262 VanDerWaalsContact C-N 3.27Å; N260-R262 PolarHBondContact O-N 3.37Å; N260-L263 PolarHBondContact O-N 3.44Å; N260-L263 VanDerWaalsContact O-N 3.12Å; N260-Q264 WeakPolarHBondContact O-CG 3.35Å; N260-Q264 PolarHBondContact O-N 3.17Å; N260-Q264 PolarHBondContact OD1-NE2 3.18Å |
| 261 | D | 98.7 | Very high | 98.7 | Very high | 86 Ų | 86 | 94.3 Ų | 94.3 | 46% | 0.46 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -58.9 | -40 | 176.6 | -72.3 | -7.3 | 0 | 0 | 0 | 111.9 | A257 V258 Q264 K265 | A257-D261 PolarHBondContact O-N 3.27Å; V258-D261 PolarHBondContact O-N 2.85Å; D261-Q264 PolarHBondContact O-N 3.38Å; D261-K265 WeakPolarHBondContact O-CG 3.42Å; D261-K265 PolarHBondContact O-N 3.27Å; D261-K265 VanDerWaalsContact O-N 3.07Å |
| 262 | R | 98.8 | Very high | 98.6 | Very high | 136 Ų | 136 | 96.3 Ų | 96.3 | 51% | 0.513 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.3 | -45.2 | 176 | -168.5 | -168.5 | 75 | 80 | 1.2 | 111.3 | V258 E259 N260 R266 | V258-R262 PolarHBondContact O-N 2.83Å; E259-R262 VanDerWaalsContact CD-NE 3.34Å; E259-R262 WeakPolarHBondContact O-CB 3.25Å; E259-R262 PolarHBondContact O-N 2.96Å; E259-R262 IonicContact OE1-CZ 2.72Å; E259-R262 VanDerWaalsContact OE1-CZ 3.3Å; E259-R262 IonicContact OE1-NE 3.79Å; E259-R262 PolarHBondContact OE1-NE 3.4Å; E259-R262 VanDerWaalsContact OE1-NE 3.14Å; E259-R262 IonicContact OE1-NH2 3.39Å; E259-R262 PolarHBondContact OE1-NH2 2.85Å; E259-R262 IonicContact OE2-CZ 2.98Å; E259-R262 IonicContact OE2-NE 2.59Å; E259-R262 PolarHBondContact OE2-NE 3.01Å; E259-R262 IonicContact OE2-NH2 2.89Å; N260-R262 VanDerWaalsContact C-N 3.27Å; N260-R262 PolarHBondContact O-N 3.37Å; R262-R266 PolarHBondContact O-N 2.84Å; R262-R266 VanDerWaalsContact O-N 3.12Å |
| 263 | L | 98.8 | Very high | 98.6 | Very high | 85 Ų | 85 | 95.3 Ų | 95.3 | 45% | 0.445 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66.9 | -42.3 | 178.4 | -70.5 | 172.4 | 0 | 0 | 0 | 111.7 | E259 N260 K265 R266 V267 | E259-L263 HydrophobicContact CG-CD1 4.22Å; E259-L263 VanDerWaalsContact O-CG 3.3Å; E259-L263 WeakPolarHBondContact O-CG 3.47Å; E259-L263 PolarHBondContact O-N 3.35Å; N260-L263 PolarHBondContact O-N 3.44Å; N260-L263 VanDerWaalsContact O-N 3.12Å; L263-K265 PolarHBondContact O-N 3.38Å; L263-R266 WeakPolarHBondContact O-CB 3.24Å; L263-R266 PolarHBondContact O-N 3.23Å; L263-R266 VanDerWaalsContact O-N 3.1Å; L263-V267 WeakPolarHBondContact O-CG2 3.42Å; L263-V267 PolarHBondContact O-N 3Å |
| 264 | Q | 98.6 | Very high | 98.6 | Very high | 97 Ų | 97 | 95.1 Ų | 95.1 | 45% | 0.453 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -56.5 | -48.5 | 175 | -73.3 | -178.9 | 8.2 | 0 | 0 | 111.3 | N260 D261 R266 V267 E268 | N260-Q264 WeakPolarHBondContact O-CG 3.35Å; N260-Q264 PolarHBondContact O-N 3.17Å; N260-Q264 PolarHBondContact OD1-NE2 3.18Å; D261-Q264 PolarHBondContact O-N 3.38Å; Q264-R266 VanDerWaalsContact C-N 3.28Å; Q264-R266 PolarHBondContact O-N 2.78Å; Q264-V267 PolarHBondContact O-N 3.34Å; Q264-E268 WeakPolarHBondContact O-CG 3.38Å; Q264-E268 PolarHBondContact O-N 2.91Å |
| 265 | K | 98.7 | Very high | 98.5 | Very high | 143 Ų | 143 | 91.3 Ų | 91.3 | 62% | 0.622 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -59 | -38.3 | 175.5 | -72.6 | 171.2 | -176.9 | 170.1 | 0 | 112.6 | D261 L263 Q269 | D261-K265 WeakPolarHBondContact O-CG 3.42Å; D261-K265 PolarHBondContact O-N 3.27Å; D261-K265 VanDerWaalsContact O-N 3.07Å; L263-K265 PolarHBondContact O-N 3.38Å; K265-Q269 WeakPolarHBondContact O-CB 3.25Å; K265-Q269 PolarHBondContact O-N 3.48Å |
| 266 | R | 98.5 | Very high | 98.4 | Very high | 115 Ų | 115 | 90.8 Ų | 90.8 | 43% | 0.434 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -68.3 | -41.5 | 177.6 | -174.4 | 58.2 | 177.4 | 165.8 | 4.9 | 111.7 | R262 L263 Q264 Q269 L270 | R262-R266 PolarHBondContact O-N 2.84Å; R262-R266 VanDerWaalsContact O-N 3.12Å; L263-R266 WeakPolarHBondContact O-CB 3.24Å; L263-R266 PolarHBondContact O-N 3.23Å; L263-R266 VanDerWaalsContact O-N 3.1Å; Q264-R266 VanDerWaalsContact C-N 3.28Å; Q264-R266 PolarHBondContact O-N 2.78Å; R266-Q269 VanDerWaalsContact NH1-NE2 3.18Å; R266-Q269 PolarHBondContact O-N 3.26Å; R266-L270 HydrophobicContact CG-CD1 4.26Å; R266-L270 WeakPolarHBondContact O-CG 3.3Å; R266-L270 PolarHBondContact O-N 2.99Å |
| 267 | V | 98.7 | Very high | 98.2 | Very high | 91 Ų | 91 | 90.6 Ų | 90.6 | 55% | 0.552 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -60.3 | -51.3 | 173.9 | 170.4 | 0 | 0 | 0 | 0 | 109.8 | L263 Q264 Q269 L270 S271 | L263-V267 WeakPolarHBondContact O-CG2 3.42Å; L263-V267 PolarHBondContact O-N 3Å; Q264-V267 PolarHBondContact O-N 3.34Å; V267-Q269 VanDerWaalsContact C-N 3.31Å; V267-Q269 PolarHBondContact O-N 3.41Å; V267-L270 PolarHBondContact O-N 3.49Å; V267-S271 WeakPolarHBondContact O-CB 3.25Å; V267-S271 PolarHBondContact O-N 2.85Å; V267-S271 PolarHBondContact O-OG 3.43Å |
| 268 | E | 98.6 | Very high | 98.1 | Very high | 96 Ų | 96 | 96 Ų | 96 | 45% | 0.449 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -57.1 | -42.7 | 177.9 | -73.9 | 179.5 | -166.6 | 0 | 0 | 112.9 | Q264 S271 R272 | Q264-E268 WeakPolarHBondContact O-CG 3.38Å; Q264-E268 PolarHBondContact O-N 2.91Å; E268-S271 PolarHBondContact O-N 2.88Å; E268-R272 WeakPolarHBondContact O-CG 3.39Å; E268-R272 PolarHBondContact O-N 3.19Å; E268-R272 IonicContact OE2-NH1 3.65Å; E268-R272 IonicContact OE2-NH2 3.92Å |
| 269 | Q | 98.6 | Very high | 97.8 | Very high | 75 Ų | 75 | 96.5 Ų | 96.5 | 35% | 0.35 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -58.8 | -53.3 | 176 | 178.6 | -174 | -8.1 | 0 | 0 | 111 | K265 R266 V267 S271 R272 E273 | K265-Q269 WeakPolarHBondContact O-CB 3.25Å; K265-Q269 PolarHBondContact O-N 3.48Å; R266-Q269 VanDerWaalsContact NH1-NE2 3.18Å; R266-Q269 PolarHBondContact O-N 3.26Å; V267-Q269 VanDerWaalsContact C-N 3.31Å; V267-Q269 PolarHBondContact O-N 3.41Å; Q269-S271 VanDerWaalsContact C-N 3.3Å; Q269-S271 PolarHBondContact O-N 3.16Å; Q269-R272 WeakPolarHBondContact O-CB 3.45Å; Q269-R272 PolarHBondContact O-N 3.37Å; Q269-R272 VanDerWaalsContact O-N 3.16Å; Q269-E273 WeakPolarHBondContact CG-OE1 3.28Å; Q269-E273 PolarHBondContact NE2-OE1 3.06Å; Q269-E273 WeakPolarHBondContact O-CG 3.28Å; Q269-E273 PolarHBondContact O-N 3.09Å |
| 270 | L | 98.5 | Very high | 97.6 | Very high | 71 Ų | 71 | 98.4 Ų | 98.4 | 37% | 0.372 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.6 | -37.4 | -179.4 | -68.3 | 172.9 | 0 | 0 | 0 | 111.5 | R266 V267 R272 E273 L274 | R266-L270 HydrophobicContact CG-CD1 4.26Å; R266-L270 WeakPolarHBondContact O-CG 3.3Å; R266-L270 PolarHBondContact O-N 2.99Å; V267-L270 PolarHBondContact O-N 3.49Å; L270-R272 PolarHBondContact O-N 3.04Å; L270-E273 PolarHBondContact O-N 2.92Å; L270-L274 WeakPolarHBondContact O-CB 3.28Å; L270-L274 WeakPolarHBondContact O-CG 3.42Å; L270-L274 PolarHBondContact O-N 3.01Å |
| 271 | S | 98.2 | Very high | 97.4 | Very high | 67 Ų | 67 | 99 Ų | 99 | 47% | 0.469 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.8 | -41.8 | 174 | -63.8 | 0 | 0 | 0 | 0 | 112 | V267 E268 Q269 A275 | V267-S271 WeakPolarHBondContact O-CB 3.25Å; V267-S271 PolarHBondContact O-N 2.85Å; V267-S271 PolarHBondContact O-OG 3.43Å; E268-S271 PolarHBondContact O-N 2.88Å; Q269-S271 VanDerWaalsContact C-N 3.3Å; Q269-S271 PolarHBondContact O-N 3.16Å; S271-A275 WeakPolarHBondContact O-CB 3.42Å; S271-A275 PolarHBondContact O-N 2.83Å |
| 272 | R | 98.3 | Very high | 97 | Very high | 147 Ų | 147 | 99.2 Ų | 99.2 | 56% | 0.555 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.9 | -47.4 | 173.8 | -75.7 | -174.4 | -72.8 | -110.6 | -3.5 | 111.5 | E268 Q269 L270 L274 A275 T276 | E268-R272 WeakPolarHBondContact O-CG 3.39Å; E268-R272 PolarHBondContact O-N 3.19Å; E268-R272 IonicContact OE2-NH1 3.65Å; E268-R272 IonicContact OE2-NH2 3.92Å; Q269-R272 WeakPolarHBondContact O-CB 3.45Å; Q269-R272 PolarHBondContact O-N 3.37Å; Q269-R272 VanDerWaalsContact O-N 3.16Å; L270-R272 PolarHBondContact O-N 3.04Å; R272-L274 PolarHBondContact O-N 3.05Å; R272-A275 PolarHBondContact O-N 3.32Å; R272-T276 WeakPolarHBondContact O-CG2 3.45Å; R272-T276 PolarHBondContact O-N 3.28Å; R272-T276 PolarHBondContact O-OG1 3.37Å |
| 273 | E | 97.8 | Very high | 96.4 | Very high | 82 Ų | 82 | 96.8 Ų | 96.8 | 38% | 0.383 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58 | -47.8 | 177.3 | -71.5 | 172.8 | -163.7 | 0 | 0 | 111.2 | Q269 L270 A275 T276 L277 | Q269-E273 WeakPolarHBondContact CG-OE1 3.28Å; Q269-E273 PolarHBondContact NE2-OE1 3.06Å; Q269-E273 WeakPolarHBondContact O-CG 3.28Å; Q269-E273 PolarHBondContact O-N 3.09Å; L270-E273 PolarHBondContact O-N 2.92Å; E273-A275 PolarHBondContact O-N 3.22Å; E273-T276 WeakPolarHBondContact CA-OG1 3.37Å; E273-T276 PolarHBondContact O-N 3.27Å; E273-T276 PolarHBondContact O-OG1 2.99Å; E273-L277 WeakPolarHBondContact O-CG 3.08Å; E273-L277 PolarHBondContact O-N 3.46Å |
| 274 | L | 98 | Very high | 95.7 | Very high | 88 Ų | 88 | 97 Ų | 97 | 46% | 0.461 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.4 | -40.3 | 176.2 | -72.5 | 178.5 | 0 | 0 | 0 | 112.9 | L270 R272 T276 L277 R278 | L270-L274 WeakPolarHBondContact O-CB 3.28Å; L270-L274 WeakPolarHBondContact O-CG 3.42Å; L270-L274 PolarHBondContact O-N 3.01Å; R272-L274 PolarHBondContact O-N 3.05Å; L274-T276 VanDerWaalsContact C-N 3.34Å; L274-L277 PolarHBondContact O-N 3.18Å; L274-R278 WeakPolarHBondContact O-CB 3.2Å; L274-R278 VanDerWaalsContact O-CG 3.31Å; L274-R278 WeakPolarHBondContact O-CG 3.34Å; L274-R278 PolarHBondContact O-N 2.7Å |
| 275 | A | 97.2 | Very high | 94.3 | Very high | 43 Ų | 43 | 95.2 Ų | 95.2 | 36% | 0.355 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.8 | -43.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | S271 R272 E273 R278 N279 | S271-A275 WeakPolarHBondContact O-CB 3.42Å; S271-A275 PolarHBondContact O-N 2.83Å; R272-A275 PolarHBondContact O-N 3.32Å; E273-A275 PolarHBondContact O-N 3.22Å; A275-R278 PolarHBondContact O-N 2.8Å; A275-N279 WeakPolarHBondContact O-CB 3.41Å; A275-N279 PolarHBondContact O-N 3.08Å; A275-N279 PolarHBondContact O-ND2 3.35Å |
| 276 | T | 96.5 | Very high | 92.5 | Very high | 76 Ų | 76 | 95.8 Ų | 95.8 | 47% | 0.466 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.2 | -44.7 | 175.8 | 58.4 | 0 | 0 | 0 | 0 | 112.2 | R272 E273 L274 R278 N279 L280 | R272-T276 WeakPolarHBondContact O-CG2 3.45Å; R272-T276 PolarHBondContact O-N 3.28Å; R272-T276 PolarHBondContact O-OG1 3.37Å; E273-T276 WeakPolarHBondContact CA-OG1 3.37Å; E273-T276 PolarHBondContact O-N 3.27Å; E273-T276 PolarHBondContact O-OG1 2.99Å; L274-T276 VanDerWaalsContact C-N 3.34Å; T276-R278 PolarHBondContact O-N 3.39Å; T276-N279 PolarHBondContact O-N 3.41Å; T276-L280 WeakPolarHBondContact O-CG 3.33Å; T276-L280 PolarHBondContact O-N 3.22Å |
| 277 | L | 96.1 | Very high | 90.2 | Very high | 97 Ų | 97 | 99.4 Ų | 99.4 | 51% | 0.508 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.6 | -41.8 | 177.9 | -69.9 | 174.1 | 0 | 0 | 0 | 112.2 | E273 L274 L280 L281 | E273-L277 WeakPolarHBondContact O-CG 3.08Å; E273-L277 PolarHBondContact O-N 3.46Å; L274-L277 PolarHBondContact O-N 3.18Å; L277-L280 PolarHBondContact O-N 3.29Å; L277-L281 WeakPolarHBondContact O-CG 3.39Å; L277-L281 PolarHBondContact O-N 3.24Å |
| 278 | R | 95 | Very high | 89.8 | Confident | 163 Ų | 163 | 99.8 Ų | 99.8 | 62% | 0.615 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -60.6 | -46.6 | 173.8 | -76 | 176.6 | 176.8 | 142.8 | -0.6 | 111.5 | L274 A275 T276 L280 L281 S282 | L274-R278 WeakPolarHBondContact O-CB 3.2Å; L274-R278 VanDerWaalsContact O-CG 3.31Å; L274-R278 WeakPolarHBondContact O-CG 3.34Å; L274-R278 PolarHBondContact O-N 2.7Å; A275-R278 PolarHBondContact O-N 2.8Å; T276-R278 PolarHBondContact O-N 3.39Å; R278-L280 VanDerWaalsContact C-N 3.3Å; R278-L280 PolarHBondContact O-N 2.59Å; R278-L281 PolarHBondContact O-N 2.73Å; R278-S282 WeakPolarHBondContact O-CB 3.47Å; R278-S282 PolarHBondContact O-N 3.09Å; R278-S282 PolarHBondContact O-OG 3.35Å; R278-S282 VanDerWaalsContact O-OG 3.09Å |
| 279 | N | 94 | Very high | 89.3 | Confident | 114 Ų | 114 | 100 Ų | 100 | 61% | 0.61 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -60.9 | -40 | 178 | -69.9 | -17.1 | 0 | 0 | 0 | 111.9 | A275 T276 A283 | A275-N279 WeakPolarHBondContact O-CB 3.41Å; A275-N279 PolarHBondContact O-N 3.08Å; A275-N279 PolarHBondContact O-ND2 3.35Å; T276-N279 PolarHBondContact O-N 3.41Å; N279-A283 VanDerWaalsContact O-CB 3.25Å; N279-A283 WeakPolarHBondContact O-CB 3.47Å; N279-A283 PolarHBondContact O-N 3.04Å |
| 280 | L | 94.4 | Very high | 88.8 | Confident | 112 Ų | 112 | 101.4 Ų | 101.4 | 59% | 0.586 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -64.7 | -47.9 | 175.9 | -70.6 | 173 | 0 | 0 | 0 | 111.7 | T276 L277 R278 S282 A283 T284 | T276-L280 WeakPolarHBondContact O-CG 3.33Å; T276-L280 PolarHBondContact O-N 3.22Å; L277-L280 PolarHBondContact O-N 3.29Å; R278-L280 VanDerWaalsContact C-N 3.3Å; R278-L280 PolarHBondContact O-N 2.59Å; L280-S282 PolarHBondContact O-N 3.16Å; L280-A283 PolarHBondContact O-N 3.21Å; L280-T284 WeakPolarHBondContact O-CG2 3.39Å; L280-T284 PolarHBondContact O-N 3.39Å; L280-T284 PolarHBondContact O-OG1 2.66Å |
| 281 | L | 92.5 | Very high | 88.2 | Confident | 96 Ų | 96 | 103.2 Ų | 103.2 | 50% | 0.503 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -59.9 | -47.2 | 178.1 | -75.7 | 163 | 0 | 0 | 0 | 111.5 | L277 R278 A283 T284 G285 | L277-L281 WeakPolarHBondContact O-CG 3.39Å; L277-L281 PolarHBondContact O-N 3.24Å; R278-L281 PolarHBondContact O-N 2.73Å; L281-A283 VanDerWaalsContact C-N 3.32Å; L281-A283 PolarHBondContact O-N 3.3Å; L281-T284 WeakPolarHBondContact CA-OG1 3.34Å; L281-T284 PolarHBondContact O-N 3.14Å; L281-T284 VanDerWaalsContact O-N 3.16Å; L281-T284 PolarHBondContact O-OG1 3.25Å; L281-G285 PolarHBondContact O-N 3.39Å |
| 282 | S | 91.3 | Very high | 87.6 | Confident | 89 Ų | 89 | 105.4 Ų | 105.4 | 62% | 0.622 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -61.3 | -37.9 | 175.6 | -62 | 0 | 0 | 0 | 0 | 112.6 | R278 L280 T284 G285 | R278-S282 WeakPolarHBondContact O-CB 3.47Å; R278-S282 PolarHBondContact O-N 3.09Å; R278-S282 PolarHBondContact O-OG 3.35Å; R278-S282 VanDerWaalsContact O-OG 3.09Å; L280-S282 PolarHBondContact O-N 3.16Å; S282-T284 VanDerWaalsContact C-N 3.35Å; S282-G285 PolarHBondContact O-N 2.93Å |
| 283 | A | 87.1 | Confident | 86.9 | Confident | 86 Ų | 86 | 102.7 Ų | 102.7 | 71% | 0.711 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -69.3 | -31.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | N279 L280 L281 G285 | N279-A283 VanDerWaalsContact O-CB 3.25Å; N279-A283 WeakPolarHBondContact O-CB 3.47Å; N279-A283 PolarHBondContact O-N 3.04Å; L280-A283 PolarHBondContact O-N 3.21Å; L281-A283 VanDerWaalsContact C-N 3.32Å; L281-A283 PolarHBondContact O-N 3.3Å; A283-G285 VanDerWaalsContact C-N 3.29Å; A283-G285 PolarHBondContact O-N 3.02Å |
| 284 | T | 84.2 | Confident | 86.1 | Confident | 89 Ų | 89 | 104.1 Ų | 104.1 | 55% | 0.546 | 62% | 0.615 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.7 | 0.3 | 178.7 | 55 | 0 | 0 | 0 | 0 | 114.7 | L280 L281 S282 Q286 | L280-T284 WeakPolarHBondContact O-CG2 3.39Å; L280-T284 PolarHBondContact O-N 3.39Å; L280-T284 PolarHBondContact O-OG1 2.66Å; L281-T284 WeakPolarHBondContact CA-OG1 3.34Å; L281-T284 PolarHBondContact O-N 3.14Å; L281-T284 VanDerWaalsContact O-N 3.16Å; L281-T284 PolarHBondContact O-OG1 3.25Å; S282-T284 VanDerWaalsContact C-N 3.35Å; T284-Q286 PolarHBondContact O-N 3.1Å; T284-Q286 VanDerWaalsContact O-N 3.17Å |
| 285 | G | 68.1 | Low | 85.2 | Confident | 59 Ų | 59 | 105.4 Ų | 105.4 | 61% | 0.608 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 65.9 | 17.3 | 171.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | L281 S282 A283 C287 | L281-G285 PolarHBondContact O-N 3.39Å; S282-G285 PolarHBondContact O-N 2.93Å; A283-G285 VanDerWaalsContact C-N 3.29Å; A283-G285 PolarHBondContact O-N 3.02Å; G285-C287 VanDerWaalsContact C-N 3.32Å; G285-C287 PolarHBondContact O-N 3.18Å; G285-C287 VanDerWaalsContact O-N 3.13Å |
| 286 | Q | 61.3 | Low | 84.2 | Confident | 155 Ų | 155 | 110.6 Ų | 110.6 | 72% | 0.724 | 65% | 0.649 | S | S | * | * | trans | -83.4 | 82 | 170.8 | -64.1 | -177.2 | 13.5 | 0 | 0 | 108.3 | T284 | T284-Q286 PolarHBondContact O-N 3.1Å; T284-Q286 VanDerWaalsContact O-N 3.17Å | ||
| 287 | C | 50.4 | Low | 83.1 | Confident | 191 Ų | 191 | 113.7 Ų | 113.7 | 100% | 1.291 | 67% | 0.666 | S | S | * | * | trans | -105.3 | 0 | 166.2 | -65.5 | 0 | 0 | 0 | 0 | 109.1 | G285 | G285-C287 VanDerWaalsContact C-N 3.32Å; G285-C287 PolarHBondContact O-N 3.18Å; G285-C287 VanDerWaalsContact O-N 3.13Å |
Retrieved 287 of 287 residues in 146.5 ms
(Link to these results)