| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 42.4 | Very low | 46.6 | Very low | 240 Ų | 240 | 149.9 Ų | 149.9 | 100% | 1.182 | 84% | 0.842 | S | S | * | * | 0 | 112.6 | 0 | -71.7 | 176.6 | 170.9 | 0 | 0 | 106.5 | |||||
| 2 | N | 41.4 | Very low | 47 | Very low | 151 Ų | 151 | 149.8 Ų | 149.8 | 81% | 0.807 | 83% | 0.829 | S | S | * | * | trans | 39 | 104.1 | 162.2 | -51.2 | -15.4 | 0 | 0 | 0 | 116.4 | ||||
| 3 | S | 44.3 | Very low | 47.7 | Very low | 106 Ų | 106 | 148.2 Ų | 148.2 | 74% | 0.741 | 82% | 0.817 | S | S | * | * | 49.1 | 136.9 | 60.6 | -53.4 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 4 | D | 52.7 | Low | 47.8 | Very low | 145 Ų | 145 | 153.6 Ų | 153.6 | 78% | 0.775 | 82% | 0.821 | S | S | * | * | trans | 94.4 | 128.3 | 175.6 | -53.9 | -32.8 | 0 | 0 | 0 | 114.4 | ||||
| 5 | M | 50.4 | Low | 47.4 | Very low | 157 Ų | 157 | 148.8 Ų | 148.8 | 77% | 0.773 | 82% | 0.823 | S | S | * | * | cis | -161.8 | 124.4 | 4.4 | -99.8 | -92.8 | -179.5 | 0 | 0 | 103.8 | ||||
| 6 | A | 51.9 | Low | 46.6 | Very low | 96 Ų | 96 | 153.3 Ų | 153.3 | 79% | 0.793 | 83% | 0.825 | S | S | * | * | 44.3 | 107.8 | 101.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 7 | G | 58.6 | Low | 46.1 | Very low | 76 Ų | 76 | 150.8 Ų | 150.8 | 78% | 0.784 | 82% | 0.822 | S | S | * | * | trans | 178.4 | -16.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 8 | C | 42.4 | Very low | 46.5 | Very low | 142 Ų | 142 | 148.5 Ų | 148.5 | 96% | 0.959 | 82% | 0.816 | S | S | * | * | trans | -114.8 | 77.7 | -178.3 | -60 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 9 | Q | 48 | Very low | 46.1 | Very low | 192 Ų | 192 | 147.3 Ų | 147.3 | 90% | 0.897 | 81% | 0.809 | S | S | * | * | trans | -83.2 | 125.2 | 165.1 | -162.6 | 171.3 | -11.1 | 0 | 0 | 108.3 | ||||
| 10 | Y | 35.6 | Very low | 46 | Very low | 204 Ų | 204 | 148.9 Ų | 148.9 | 80% | 0.8 | 81% | 0.812 | S | S | * | * | trans | -65.3 | 124.4 | -177.5 | -152.1 | -98.2 | 0 | 0 | 0 | 110.1 | Q12 | Y10-Q12 HydrophobicContact CD1-CB 4.5Å; Y10-Q12 HydrophobicContact CD1-CG 4.22Å; Y10-Q12 HydrophobicContact CE1-CG 4.03Å | ||
| 11 | D | 45.1 | Very low | 45.8 | Very low | 140 Ų | 140 | 147.9 Ų | 147.9 | 75% | 0.749 | 81% | 0.806 | S | S | * | * | trans | -115.9 | 128.1 | 166.4 | -150.3 | -31.7 | 0 | 0 | 0 | 109.3 | I13 | D11-I13 PolarHBondContact O-N 3.17Š| ||
| 12 | Q | 51.7 | Low | 45.8 | Very low | 148 Ų | 148 | 144.7 Ų | 144.7 | 69% | 0.692 | 79% | 0.788 | S | S | * | * | trans | -97.9 | 17.2 | -147.6 | -149 | 169.1 | 56.7 | 0 | 0 | 113.9 | Y10 | Y10-Q12 HydrophobicContact CD1-CB 4.5Å; Y10-Q12 HydrophobicContact CD1-CG 4.22Å; Y10-Q12 HydrophobicContact CE1-CG 4.03Å | ||
| 13 | I | 56.3 | Low | 45.7 | Very low | 129 Ų | 129 | 142.5 Ų | 142.5 | 66% | 0.662 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -124.2 | -23.3 | -162.1 | -29.1 | -174.2 | 0 | 0 | 0 | 115.8 | D11 | D11-I13 PolarHBondContact O-N 3.17Š|
| 14 | Y | 49.1 | Very low | 45.6 | Very low | 224 Ų | 224 | 143.5 Ų | 143.5 | 88% | 0.878 | 79% | 0.792 | S | S | * | * | trans | -147.6 | 126.4 | -179.9 | -81.5 | -85 | 0 | 0 | 0 | 113.9 | ||||
| 15 | G | 41.5 | Very low | 44.9 | Very low | 82 Ų | 82 | 148 Ų | 148 | 85% | 0.845 | 80% | 0.798 | S | S | * | * | trans | -71.3 | 133.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 16 | Y | 34.9 | Very low | 44.4 | Very low | 221 Ų | 221 | 149 Ų | 149 | 87% | 0.867 | 81% | 0.805 | S | S | * | * | trans | -11 | 124.6 | 171.3 | -106.3 | -104.1 | 0 | 0 | 0 | 119.8 | ||||
| 17 | S | 37.3 | Very low | 43.8 | Very low | 111 Ų | 111 | 149.5 Ų | 149.5 | 78% | 0.776 | 80% | 0.803 | S | S | * | * | trans | -123.6 | 120.2 | 145.9 | -163.5 | 0 | 0 | 0 | 0 | 107.5 | N19 | S17-N19 PolarHBondContact O-N 3.27Š| ||
| 18 | P | 52.7 | Low | 43 | Very low | 109 Ų | 109 | 153 Ų | 153 | 71% | 0.708 | 81% | 0.81 | S | S | * | * | trans | -78.3 | 104.7 | 177.4 | 29.7 | -29.1 | 0 | 0 | 0 | 109.2 | ||||
| 19 | N | 39 | Very low | 42.8 | Very low | 126 Ų | 126 | 151.5 Ų | 151.5 | 67% | 0.674 | 80% | 0.801 | S | S | * | * | trans | -91.1 | 107.8 | 161.3 | -172.5 | -16.5 | 0 | 0 | 0 | 107.6 | S17 N21 | S17-N19 PolarHBondContact O-N 3.27Å; N19-N21 PolarHBondContact OD1-N 3.05Å | ||
| 20 | M | 45.3 | Very low | 42.5 | Very low | 179 Ų | 179 | 147.1 Ų | 147.1 | 88% | 0.882 | 79% | 0.791 | S | S | * | * | trans | -114 | 93.7 | 162.4 | -84.7 | -69.9 | 129.9 | 0 | 0 | 108.2 | ||||
| 21 | N | 42.1 | Very low | 42.7 | Very low | 127 Ų | 127 | 145.9 Ų | 145.9 | 68% | 0.679 | 79% | 0.793 | S | S | * | * | trans | -70.3 | 124.7 | 161.7 | -153.1 | -14.2 | 0 | 0 | 0 | 107.6 | N19 | N19-N21 PolarHBondContact OD1-N 3.05Š| ||
| 22 | Q | 42.5 | Very low | 42.4 | Very low | 174 Ų | 174 | 149.5 Ų | 149.5 | 81% | 0.813 | 80% | 0.802 | S | S | * | * | trans | 169.6 | 118.4 | 135.4 | -92 | 172 | 91.7 | 0 | 0 | 112.4 | ||||
| 23 | S | 38.6 | Very low | 42.1 | Very low | 104 Ų | 104 | 145.9 Ų | 145.9 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | trans | 68.6 | 94.2 | 134.9 | -53.9 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 24 | S | 41.8 | Very low | 41.2 | Very low | 128 Ų | 128 | 146.8 Ų | 146.8 | 90% | 0.895 | 80% | 0.804 | S | S | * | * | trans | -157.6 | 118.7 | 132.6 | -76.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 25 | R | 38.8 | Very low | 40.8 | Very low | 238 Ų | 238 | 144.6 Ų | 144.6 | 90% | 0.898 | 81% | 0.806 | S | S | * | * | trans | -64.3 | 144.5 | -175.3 | -64.3 | 172.4 | 166.4 | -171.7 | -5.5 | 111.7 | ||||
| 26 | L | 38.4 | Very low | 40.8 | Very low | 178 Ų | 178 | 145.3 Ų | 145.3 | 93% | 0.932 | 80% | 0.799 | S | S | * | * | -168 | 103.5 | 128.9 | -96 | 154.6 | 0 | 0 | 0 | 107.6 | |||||
| 27 | S | 39.6 | Very low | 40.8 | Very low | 108 Ų | 108 | 143.8 Ų | 143.8 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | trans | -81.1 | 127.6 | 177.7 | -46.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 28 | T | 42 | Very low | 40.9 | Very low | 149 Ų | 149 | 143 Ų | 143 | 91% | 0.914 | 80% | 0.799 | S | S | * | * | trans | -139.9 | 117.2 | 140.7 | 49.9 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 29 | S | 39.6 | Very low | 40.3 | Very low | 110 Ų | 110 | 143.3 Ų | 143.3 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | trans | -110.7 | 141.4 | -169.3 | 40.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 30 | S | 41.5 | Very low | 40.3 | Very low | 100 Ų | 100 | 142 Ų | 142 | 70% | 0.699 | 81% | 0.811 | S | S | * | * | trans | -178.4 | 104.2 | 135.8 | 46.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 31 | E | 39 | Very low | 40.3 | Very low | 178 Ų | 178 | 141.5 Ų | 141.5 | 83% | 0.832 | 81% | 0.812 | S | S | * | * | 86.4 | 107.4 | 98.8 | -76.7 | 175.3 | 138.4 | 0 | 0 | 113.4 | |||||
| 32 | F | 39.9 | Very low | 40 | Very low | 217 Ų | 217 | 142.4 Ų | 142.4 | 95% | 0.952 | 82% | 0.815 | S | S | * | * | -152 | 123.4 | 124.3 | -119.6 | -82.5 | 0 | 0 | 0 | 109.5 | |||||
| 33 | A | 44 | Very low | 40.1 | Very low | 72 Ų | 72 | 143 Ų | 143 | 60% | 0.595 | 82% | 0.818 | S | S | * | * | trans | -107.6 | 164 | -168.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 34 | N | 38.8 | Very low | 39.9 | Very low | 148 Ų | 148 | 142.2 Ų | 142.2 | 79% | 0.791 | 82% | 0.818 | S | S | * | * | trans | 71.1 | 117.6 | 147.9 | -77.5 | -58.6 | 0 | 0 | 0 | 120.2 | ||||
| 35 | L | 40.7 | Very low | 39.8 | Very low | 178 Ų | 178 | 146.1 Ų | 146.1 | 93% | 0.932 | 82% | 0.819 | S | S | * | * | -148.4 | 102.2 | 125.6 | -129.1 | 75.1 | 0 | 0 | 0 | 110.2 | |||||
| 36 | S | 40.1 | Very low | 39.8 | Very low | 97 Ų | 97 | 139.2 Ų | 139.2 | 68% | 0.678 | 81% | 0.807 | S | S | * | * | trans | 17.6 | 119.2 | 140.9 | -177.1 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 37 | Q | 36.1 | Very low | 39.8 | Very low | 188 Ų | 188 | 138.3 Ų | 138.3 | 88% | 0.879 | 80% | 0.803 | S | S | * | * | 74.6 | 109.7 | 68.9 | -162.1 | 175.4 | 49.3 | 0 | 0 | 115.1 | |||||
| 38 | A | 38.6 | Very low | 39.5 | Very low | 94 Ų | 94 | 141.1 Ų | 141.1 | 78% | 0.777 | 81% | 0.805 | S | S | * | * | trans | 166.1 | 136.5 | 151.1 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 39 | S | 40.8 | Very low | 39.4 | Very low | 117 Ų | 117 | 139.3 Ų | 139.3 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | cis | -169.1 | 138 | 10.2 | 25 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 40 | A | 38.1 | Very low | 39.2 | Very low | 99 Ų | 99 | 138 Ų | 138 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -82.5 | 136 | 167.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 41 | N | 44.5 | Very low | 39.3 | Very low | 168 Ų | 168 | 141.4 Ų | 141.4 | 90% | 0.898 | 80% | 0.797 | S | S | * | * | trans | -147.7 | 133.5 | 152.6 | -133.5 | -6.4 | 0 | 0 | 0 | 111.8 | ||||
| 42 | I | 37.6 | Very low | 39.1 | Very low | 145 Ų | 145 | 142.1 Ų | 142.1 | 74% | 0.744 | 80% | 0.8 | S | S | * | * | trans | -82.4 | 146.2 | -174.1 | -70.1 | 178.4 | 0 | 0 | 0 | 109.2 | ||||
| 43 | Q | 43.1 | Very low | 38.9 | Very low | 187 Ų | 187 | 141.3 Ų | 141.3 | 87% | 0.874 | 79% | 0.792 | S | S | * | * | 179.8 | 130.8 | 126.1 | -96 | 172.7 | 6.6 | 0 | 0 | 113.1 | |||||
| 44 | A | 35.6 | Very low | 38.8 | Very low | 87 Ų | 87 | 142.9 Ų | 142.9 | 72% | 0.719 | 79% | 0.794 | S | S | * | * | trans | -80.9 | 147.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 45 | F | 39.3 | Very low | 38.7 | Very low | 210 Ų | 210 | 142.1 Ų | 142.1 | 92% | 0.921 | 80% | 0.795 | S | S | * | * | trans | -143.7 | 121.9 | 149 | -105.2 | -81.9 | 0 | 0 | 0 | 110.4 | ||||
| 46 | S | 37.6 | Very low | 38.8 | Very low | 94 Ų | 94 | 139.4 Ų | 139.4 | 66% | 0.657 | 78% | 0.78 | S | S | * | * | trans | -70.8 | 137.5 | 172.5 | 163 | 0 | 0 | 0 | 0 | 111 | ||||
| 47 | N | 39.5 | Very low | 39.3 | Very low | 159 Ų | 159 | 138.8 Ų | 138.8 | 85% | 0.85 | 77% | 0.772 | S | S | * | * | -174.3 | 116.2 | 124.1 | -92 | -25.2 | 0 | 0 | 0 | 111.2 | |||||
| 48 | Q | 33 | Very low | 39.8 | Very low | 167 Ų | 167 | 135.8 Ų | 135.8 | 78% | 0.78 | 77% | 0.769 | S | S | * | * | trans | -83.2 | 166.6 | 165.6 | -113.6 | -139.7 | 14.1 | 0 | 0 | 109.2 | ||||
| 49 | P | 39.5 | Very low | 39.9 | Very low | 111 Ų | 111 | 136.3 Ų | 136.3 | 72% | 0.721 | 76% | 0.759 | S | S | * | * | -153.3 | 156.3 | 68 | 39.7 | -17.7 | 0 | 0 | 0 | 118.9 | |||||
| 50 | S | 35.8 | Very low | 40.2 | Very low | 83 Ų | 83 | 140 Ų | 140 | 58% | 0.58 | 76% | 0.763 | S | S | * | * | trans | 41.2 | 107.4 | 143.1 | 65.3 | 0 | 0 | 0 | 0 | 120 | ||||
| 51 | N | 42.8 | Very low | 40.6 | Very low | 171 Ų | 171 | 143.2 Ų | 143.2 | 91% | 0.914 | 76% | 0.755 | S | S | * | * | trans | -131.3 | 117.5 | 140.9 | -77.3 | -35.6 | 0 | 0 | 0 | 108.2 | ||||
| 52 | E | 34.8 | Very low | 40.5 | Very low | 192 Ų | 192 | 140.2 Ų | 140.2 | 90% | 0.897 | 74% | 0.739 | S | S | * | * | trans | -70.5 | 127.5 | 174.3 | -64.4 | 164.4 | 130 | 0 | 0 | 110.1 | ||||
| 53 | Y | 36.2 | Very low | 40.6 | Very low | 201 Ų | 201 | 137.8 Ų | 137.8 | 79% | 0.788 | 74% | 0.74 | S | S | * | * | trans | -155.5 | 119 | 140 | -158.6 | -99.7 | 0 | 0 | 0 | 111.2 | ||||
| 54 | T | 41.9 | Very low | 40.9 | Very low | 104 Ų | 104 | 134.8 Ų | 134.8 | 64% | 0.638 | 74% | 0.735 | S | S | * | * | trans | -32.7 | 124.8 | 173.2 | -53.3 | 0 | 0 | 0 | 0 | 116 | I56 | T54-I56 HydrophobicContact CG2-CG1 4.07Å; T54-I56 PolarHBondContact O-N 3.23Å | ||
| 55 | T | 37.1 | Very low | 41.6 | Very low | 132 Ų | 132 | 135.5 Ų | 135.5 | 81% | 0.81 | 73% | 0.731 | S | S | * | * | trans | -66.6 | 104.6 | 158.8 | -54.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 56 | I | 42 | Very low | 42 | Very low | 122 Ų | 122 | 133.1 Ų | 133.1 | 63% | 0.626 | 73% | 0.727 | S | S | * | * | trans | -87.4 | 109.1 | 168.2 | -59.9 | 175 | 0 | 0 | 0 | 106.9 | T54 | T54-I56 HydrophobicContact CG2-CG1 4.07Å; T54-I56 PolarHBondContact O-N 3.23Å | ||
| 57 | T | 50.8 | Low | 42.5 | Very low | 83 Ų | 83 | 138.9 Ų | 138.9 | 51% | 0.509 | 74% | 0.736 | S | S | . | * | trans | -57.9 | 132.6 | 165 | 46.5 | 0 | 0 | 0 | 0 | 109.5 | N59 | T57-N59 PolarHBondContact O-N 3.29Š| ||
| 58 | P | 47.3 | Very low | 42.8 | Very low | 126 Ų | 126 | 140.4 Ų | 140.4 | 82% | 0.818 | 74% | 0.737 | S | S | * | * | trans | -70.8 | 109.5 | 179.9 | 17.6 | -14.2 | 0 | 0 | 0 | 109.8 | H60 | P58-H60 PolarHBondContact O-N 2.95Š| ||
| 59 | N | 40.9 | Very low | 43.4 | Very low | 104 Ų | 104 | 143.8 Ų | 143.8 | 56% | 0.556 | 74% | 0.743 | S | S | * | * | trans | -60.8 | 121 | 168 | -87.6 | -35.5 | 0 | 0 | 0 | 109.5 | T57 Y61 | T57-N59 PolarHBondContact O-N 3.29Å; N59-Y61 HydrophobicContact CB-CD1 4.18Å; N59-Y61 HydrophobicContact CB-CE1 3.67Å; N59-Y61 HydrophobicContact CB-CE2 4.25Å; N59-Y61 PolarHBondContact ND2-OH 3.31Å; N59-Y61 PolarHBondContact O-N 3.38Å | ||
| 60 | H | 46.3 | Very low | 43.6 | Very low | 194 Ų | 194 | 149.1 Ų | 149.1 | 90% | 0.898 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | 68.1 | 178.5 | -159.2 | 72 | 0 | 0 | 0 | 109.9 | P58 | P58-H60 PolarHBondContact O-N 2.95Š|
| 61 | Y | 46.3 | Very low | 44.4 | Very low | 167 Ų | 167 | 150.4 Ų | 150.4 | 66% | 0.655 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -162.4 | 9.2 | 168.7 | 46.7 | -96.7 | 0 | 0 | 0 | 116.4 | N59 | N59-Y61 HydrophobicContact CB-CD1 4.18Å; N59-Y61 HydrophobicContact CB-CE1 3.67Å; N59-Y61 HydrophobicContact CB-CE2 4.25Å; N59-Y61 PolarHBondContact ND2-OH 3.31Å; N59-Y61 PolarHBondContact O-N 3.38Å |
| 62 | D | 43.1 | Very low | 44.4 | Very low | 106 Ų | 106 | 153.1 Ų | 153.1 | 57% | 0.567 | 76% | 0.755 | S | S | * | * | trans | -125.8 | 27.1 | -177.3 | -111.3 | -44.4 | 0 | 0 | 0 | 115.6 | T64 | D62-T64 PolarHBondContact O-N 3.45Š| ||
| 63 | A | 40.4 | Very low | 44.8 | Very low | 93 Ų | 93 | 154.5 Ų | 154.5 | 77% | 0.769 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | 2.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 64 | T | 48.6 | Very low | 45.4 | Very low | 124 Ų | 124 | 152.2 Ų | 152.2 | 76% | 0.761 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.6 | 0.8 | -170.4 | 33.3 | 0 | 0 | 0 | 0 | 115.9 | D62 | D62-T64 PolarHBondContact O-N 3.45Š|
| 65 | T | 51.4 | Low | 45.6 | Very low | 102 Ų | 102 | 151.8 Ų | 151.8 | 63% | 0.626 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -117.4 | -1.6 | -172.5 | 56.3 | 0 | 0 | 0 | 0 | 115.7 | ||
| 66 | L | 46.5 | Very low | 45.9 | Very low | 161 Ų | 161 | 155.4 Ų | 155.4 | 84% | 0.843 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -103.1 | 11.3 | -175.6 | -108.3 | 157.8 | 0 | 0 | 0 | 116 | ||
| 67 | Y | 48.4 | Very low | 45.9 | Very low | 214 Ų | 214 | 155 Ų | 155 | 84% | 0.839 | 76% | 0.757 | S | S | * | * | trans | -89.3 | 3.8 | -178.8 | -98.4 | -83.6 | 0 | 0 | 0 | 116.2 | ||||
| 68 | H | 45.9 | Very low | 45.8 | Very low | 192 Ų | 192 | 158.4 Ų | 158.4 | 89% | 0.889 | 78% | 0.778 | S | S | * | * | trans | -100.2 | 27.8 | -169.8 | -95.3 | -59.4 | 0 | 0 | 0 | 117.2 | ||||
| 69 | R | 45.7 | Very low | 46.3 | Very low | 238 Ų | 238 | 154.8 Ų | 154.8 | 90% | 0.898 | 76% | 0.764 | S | S | * | * | trans | -128 | 68.5 | 175.1 | -153.1 | 173.7 | -172.9 | 140.9 | -0.3 | 112.8 | ||||
| 70 | Y | 43.8 | Very low | 46.8 | Very low | 223 Ų | 223 | 155.6 Ų | 155.6 | 88% | 0.875 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -126.3 | 148 | 157.9 | -101.4 | -93.8 | 0 | 0 | 0 | 109.8 | ||
| 71 | P | 53 | Low | 47.3 | Very low | 109 Ų | 109 | 152.4 Ų | 152.4 | 71% | 0.708 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -68 | 139.1 | -161.3 | -9.2 | 23.2 | 0 | 0 | 0 | 112.6 | Y73 | P71-Y73 PolarHBondContact O-N 3.35Š|
| 72 | Y | 42 | Very low | 47.7 | Very low | 228 Ų | 228 | 150.1 Ų | 150.1 | 89% | 0.894 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -46.9 | 116.6 | 172.1 | -129.5 | -103.4 | 0 | 0 | 0 | 111.6 | ||
| 73 | Y | 43.9 | Very low | 47.9 | Very low | 222 Ų | 222 | 154.8 Ų | 154.8 | 87% | 0.871 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 124.9 | 163.7 | -103.7 | -92.4 | 0 | 0 | 0 | 109.3 | P71 | P71-Y73 PolarHBondContact O-N 3.35Š|
| 74 | H | 48.1 | Very low | 48.5 | Very low | 152 Ų | 152 | 160.1 Ų | 160.1 | 70% | 0.704 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 130.3 | -178.2 | -141 | -66.3 | 0 | 0 | 0 | 111 | Y76 | H74-Y76 VanDerWaalsContact C-N 3.3Å; H74-Y76 PolarHBondContact O-N 3.22Å |
| 75 | P | 46.5 | Very low | 48.9 | Very low | 95 Ų | 95 | 159.2 Ų | 159.2 | 62% | 0.617 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -90 | 54.5 | -174 | 37.2 | -35.5 | 0 | 0 | 0 | 111.8 | ||
| 76 | Y | 44 | Very low | 48.6 | Very low | 208 Ų | 208 | 159.4 Ų | 159.4 | 82% | 0.816 | 79% | 0.786 | S | S | * | * | trans | -153.7 | 63.3 | 170.1 | -60.8 | -71.7 | 0 | 0 | 0 | 110.8 | H74 | H74-Y76 VanDerWaalsContact C-N 3.3Å; H74-Y76 PolarHBondContact O-N 3.22Å | ||
| 77 | S | 41.3 | Very low | 48.9 | Very low | 113 Ų | 113 | 159.1 Ų | 159.1 | 79% | 0.79 | 78% | 0.784 | S | S | * | * | trans | -130.8 | 104.6 | 168.9 | -163.8 | 0 | 0 | 0 | 0 | 109.9 | G79 | S77-G79 VanDerWaalsContact C-N 3.32Å; S77-G79 PolarHBondContact O-N 3.41Å | ||
| 78 | T | 48.4 | Very low | 49.2 | Very low | 155 Ų | 155 | 151.6 Ų | 151.6 | 95% | 0.951 | 77% | 0.766 | S | S | * | * | trans | -74.5 | 83.8 | 173 | 51.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 79 | G | 58.8 | Low | 49.2 | Very low | 50 Ų | 50 | 146.9 Ų | 146.9 | 52% | 0.515 | 76% | 0.755 | S | S | . | * | trans | -136.9 | 144.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110 | S77 | S77-G79 VanDerWaalsContact C-N 3.32Å; S77-G79 PolarHBondContact O-N 3.41Å | ||
| 80 | P | 50.9 | Low | 49.2 | Very low | 121 Ų | 121 | 144.7 Ų | 144.7 | 79% | 0.786 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 142.2 | -174.1 | 26 | -32.7 | 0 | 0 | 0 | 110.9 | T82 | P80-T82 PolarHBondContact O-N 3.41Š|
| 81 | P | 55.5 | Low | 49.3 | Very low | 128 Ų | 128 | 139 Ų | 139 | 83% | 0.831 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 126.3 | -172.9 | 27.2 | -32.6 | 0 | 0 | 0 | 109.8 | F83 | P81-F83 PolarHBondContact O-N 3.35Š|
| 82 | T | 55.6 | Low | 48.8 | Very low | 119 Ų | 119 | 139 Ų | 139 | 73% | 0.73 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 126.4 | 171.2 | 46.5 | 0 | 0 | 0 | 0 | 108.6 | P80 Y84 | P80-T82 PolarHBondContact O-N 3.41Å; T82-Y84 VanDerWaalsContact C-N 3.26Å; T82-Y84 PolarHBondContact O-N 3.47Å |
| 83 | F | 47.4 | Very low | 48.8 | Very low | 204 Ų | 204 | 133.1 Ų | 133.1 | 90% | 0.895 | 74% | 0.736 | S | S | * | * | trans | -69.2 | 81.3 | 177.9 | -171.1 | -93.6 | 0 | 0 | 0 | 109.4 | P81 | P81-F83 PolarHBondContact O-N 3.35Š| ||
| 84 | Y | 52.1 | Low | 48.8 | Very low | 205 Ų | 205 | 128.6 Ų | 128.6 | 80% | 0.804 | 73% | 0.731 | S | S | * | * | trans | -117.8 | 120.2 | 163.7 | -88.6 | -82.6 | 0 | 0 | 0 | 108.3 | T82 D86 | T82-Y84 VanDerWaalsContact C-N 3.26Å; T82-Y84 PolarHBondContact O-N 3.47Å; Y84-D86 PolarHBondContact O-N 2.95Å | ||
| 85 | P | 58 | Low | 48.7 | Very low | 104 Ų | 104 | 130.3 Ų | 130.3 | 68% | 0.675 | 74% | 0.739 | S | S | * | * | trans | -65.8 | 128.2 | 174.4 | 27 | -31.3 | 0 | 0 | 0 | 109.1 | L87 | P85-L87 PolarHBondContact O-N 3.32Š| ||
| 86 | D | 44.1 | Very low | 48.6 | Very low | 107 Ų | 107 | 133.4 Ų | 133.4 | 57% | 0.572 | 75% | 0.751 | S | S | * | * | trans | -56.3 | 117.5 | 173.1 | 177.3 | 16.5 | 0 | 0 | 0 | 110.5 | Y84 A88 S89 | Y84-D86 PolarHBondContact O-N 2.95Å; D86-A88 PolarHBondContact O-N 3.44Å; D86-A88 VanDerWaalsContact O-N 3.16Å; D86-A88 VanDerWaalsContact OD1-CB 3.3Å; D86-A88 WeakPolarHBondContact OD1-CB 3.33Å; D86-A88 PolarHBondContact OD1-N 2.8Å; D86-S89 PolarHBondContact O-N 2.79Å | ||
| 87 | L | 52.8 | Low | 48.4 | Very low | 154 Ų | 154 | 130.3 Ų | 130.3 | 81% | 0.806 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -62.9 | -16.6 | 177.1 | -83.7 | 94 | 0 | 0 | 0 | 112.4 | P85 S89 F90 | P85-L87 PolarHBondContact O-N 3.32Å; L87-S89 VanDerWaalsContact C-N 3.29Å; L87-S89 PolarHBondContact O-N 3.1Å; L87-F90 PolarHBondContact O-N 3.05Å |
| 88 | A | 54.7 | Low | 48.4 | Very low | 56 Ų | 56 | 128.6 Ų | 128.6 | 46% | 0.463 | 75% | 0.748 | S | S | . | * | G | 310 helix | trans | -69.6 | -26.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | D86 F90 T91 | D86-A88 PolarHBondContact O-N 3.44Å; D86-A88 VanDerWaalsContact O-N 3.16Å; D86-A88 VanDerWaalsContact OD1-CB 3.3Å; D86-A88 WeakPolarHBondContact OD1-CB 3.33Å; D86-A88 PolarHBondContact OD1-N 2.8Å; A88-F90 VanDerWaalsContact C-N 3.26Å; A88-F90 PolarHBondContact O-N 2.94Å; A88-T91 PolarHBondContact O-N 2.9Å; A88-T91 PolarHBondContact O-OG1 3Å |
| 89 | S | 47.7 | Very low | 48.4 | Very low | 94 Ų | 94 | 130 Ų | 130 | 66% | 0.657 | 74% | 0.744 | S | S | * | * | G | 310 helix | trans | -76.3 | -8.2 | -179.1 | -65.4 | 0 | 0 | 0 | 0 | 114.2 | D86 L87 | D86-S89 PolarHBondContact O-N 2.79Å; L87-S89 VanDerWaalsContact C-N 3.29Å; L87-S89 PolarHBondContact O-N 3.1Å |
| 90 | F | 43.9 | Very low | 47.7 | Very low | 191 Ų | 191 | 136.6 Ų | 136.6 | 84% | 0.838 | 76% | 0.759 | S | S | * | * | G | 310 helix | trans | -91 | -4.5 | 177.9 | -128.6 | -92.7 | 0 | 0 | 0 | 113.9 | L87 A88 | L87-F90 PolarHBondContact O-N 3.05Å; A88-F90 VanDerWaalsContact C-N 3.26Å; A88-F90 PolarHBondContact O-N 2.94Å |
| 91 | T | 45.7 | Very low | 47.1 | Very low | 103 Ų | 103 | 136.6 Ų | 136.6 | 63% | 0.632 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -95.9 | -3.9 | -173.1 | 64.1 | 0 | 0 | 0 | 0 | 114.5 | A88 | A88-T91 PolarHBondContact O-N 2.9Å; A88-T91 PolarHBondContact O-OG1 3Å |
| 92 | S | 42.4 | Very low | 46.6 | Very low | 109 Ų | 109 | 139.3 Ų | 139.3 | 76% | 0.762 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.8 | 10.8 | -172.5 | -46 | 0 | 0 | 0 | 0 | 116.1 | ||
| 93 | S | 42.4 | Very low | 46.2 | Very low | 105 Ų | 105 | 140.5 Ų | 140.5 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.1 | 8.3 | 178.8 | -156.3 | 0 | 0 | 0 | 0 | 114.9 | Q95 | S93-Q95 PolarHBondContact O-N 3.27Š|
| 94 | V | 45 | Very low | 45.6 | Very low | 128 Ų | 128 | 141 Ų | 141 | 78% | 0.776 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | 12 | -178.5 | -176.3 | 0 | 0 | 0 | 0 | 112.9 | ||
| 95 | Q | 46.4 | Very low | 45.3 | Very low | 188 Ų | 188 | 136 Ų | 136 | 88% | 0.879 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.8 | 11.5 | -177.7 | -70.9 | -172.5 | -28 | 0 | 0 | 115.8 | S93 | S93-Q95 PolarHBondContact O-N 3.27Š|
| 96 | N | 43.7 | Very low | 44.6 | Very low | 159 Ų | 159 | 135.5 Ų | 135.5 | 85% | 0.85 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -131.6 | 21.6 | -178.8 | -102 | -39 | 0 | 0 | 0 | 116.5 | ||
| 97 | N | 38.7 | Very low | 44.5 | Very low | 144 Ų | 144 | 137.4 Ų | 137.4 | 77% | 0.77 | 78% | 0.783 | S | S | * | * | trans | -124.4 | 30.2 | -178.6 | -133.2 | 3.6 | 0 | 0 | 0 | 115 | Q99 | N97-Q99 VanDerWaalsContact C-N 3.31Å; N97-Q99 PolarHBondContact O-N 3.15Å | ||
| 98 | G | 41.5 | Very low | 43.9 | Very low | 76 Ų | 76 | 140 Ų | 140 | 78% | 0.784 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.8 | 5.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||
| 99 | Q | 48.6 | Very low | 42.9 | Very low | 186 Ų | 186 | 140.4 Ų | 140.4 | 87% | 0.869 | 80% | 0.801 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.2 | 12.9 | -167.3 | -142.5 | 71.6 | 39 | 0 | 0 | 116.6 | N97 | N97-Q99 VanDerWaalsContact C-N 3.31Å; N97-Q99 PolarHBondContact O-N 3.15Å |
| 100 | K | 43.6 | Very low | 42.6 | Very low | 188 Ų | 188 | 144 Ų | 144 | 82% | 0.817 | 81% | 0.813 | S | S | * | * | trans | -128.3 | 25.1 | -175.6 | -107.1 | -177.1 | 179.3 | -175.3 | 0 | 116.9 | ||||
| 101 | S | 39.6 | Very low | 42.2 | Very low | 121 Ų | 121 | 142.2 Ų | 142.2 | 85% | 0.846 | 81% | 0.811 | S | S | * | * | trans | -106.3 | 34.1 | -172.5 | -162.2 | 0 | 0 | 0 | 0 | 116 | ||||
| 102 | Q | 45.5 | Very low | 42 | Very low | 184 Ų | 184 | 144.8 Ų | 144.8 | 86% | 0.86 | 82% | 0.82 | S | S | * | * | trans | -124.2 | -0.9 | -178.3 | -76.8 | -170 | -2.6 | 0 | 0 | 118.2 | ||||
| 103 | D | 47.1 | Very low | 41.9 | Very low | 144 Ų | 144 | 148 Ų | 148 | 77% | 0.77 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -104.2 | 13.1 | -168.2 | -66 | -37.6 | 0 | 0 | 0 | 117.7 | ||
| 104 | Y | 34.3 | Very low | 41.8 | Very low | 216 Ų | 216 | 148.6 Ų | 148.6 | 85% | 0.847 | 83% | 0.827 | S | S | * | * | S | Bend | trans | -126.7 | 65 | 176.6 | -63.8 | -81.4 | 0 | 0 | 0 | 112.8 | ||
| 105 | A | 45.5 | Very low | 41.1 | Very low | 100 Ų | 100 | 150.4 Ų | 150.4 | 83% | 0.826 | 83% | 0.833 | S | S | * | * | trans | -155.3 | 58.7 | 167.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 106 | A | 44.2 | Very low | 40.9 | Very low | 93 Ų | 93 | 147.8 Ų | 147.8 | 77% | 0.769 | 83% | 0.83 | S | S | * | * | trans | -156.4 | 149.4 | 164.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 107 | V | 41.8 | Very low | 40.6 | Very low | 147 Ų | 147 | 146.3 Ų | 146.3 | 89% | 0.891 | 83% | 0.826 | S | S | * | * | trans | 86.5 | 61 | -178.8 | -158.8 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 108 | Q | 39 | Very low | 40.7 | Very low | 207 Ų | 207 | 147.5 Ų | 147.5 | 97% | 0.967 | 83% | 0.832 | S | S | * | * | trans | -129.6 | 114.3 | 146.4 | -113.4 | -174.1 | 4 | 0 | 0 | 107.7 | ||||
| 109 | G | 35.3 | Very low | 40.4 | Very low | 65 Ų | 65 | 153.1 Ų | 153.1 | 67% | 0.67 | 84% | 0.838 | S | S | * | * | trans | 131.2 | 78.6 | -179 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 110 | N | 40.8 | Very low | 39.8 | Very low | 171 Ų | 171 | 147.5 Ų | 147.5 | 91% | 0.914 | 83% | 0.829 | S | S | * | * | trans | -179.5 | 146.2 | 141.9 | -88.4 | -18.9 | 0 | 0 | 0 | 110.1 | ||||
| 111 | L | 36.1 | Very low | 39.6 | Very low | 152 Ų | 152 | 144.1 Ų | 144.1 | 80% | 0.796 | 83% | 0.83 | S | S | * | * | trans | 87.7 | 68.7 | 167 | -129.6 | 68 | 0 | 0 | 0 | 117.4 | ||||
| 112 | L | 41.4 | Very low | 39.8 | Very low | 157 Ų | 157 | 144.9 Ų | 144.9 | 82% | 0.822 | 83% | 0.83 | S | S | * | * | -58.6 | 157.1 | 127.1 | -68.8 | 97.1 | 0 | 0 | 0 | 109.1 | |||||
| 113 | E | 38.9 | Very low | 39.5 | Very low | 176 Ų | 176 | 145.5 Ų | 145.5 | 82% | 0.822 | 83% | 0.829 | S | S | * | * | trans | 85.6 | 89.8 | -176.9 | -71.4 | 160.5 | 117.5 | 0 | 0 | 116 | ||||
| 114 | S | 41.1 | Very low | 39.3 | Very low | 118 Ų | 118 | 148.4 Ų | 148.4 | 83% | 0.825 | 84% | 0.835 | S | S | * | * | trans | -179.5 | 80.1 | 131.9 | -74.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 115 | N | 30.8 | Very low | 39.3 | Very low | 167 Ų | 167 | 142.3 Ų | 142.3 | 89% | 0.893 | 83% | 0.829 | S | S | * | * | trans | -130.5 | 91.3 | 166.3 | -99.8 | -22.6 | 0 | 0 | 0 | 108.1 | ||||
| 116 | T | 40.5 | Very low | 38.8 | Very low | 132 Ų | 132 | 148.9 Ų | 148.9 | 81% | 0.81 | 84% | 0.835 | S | S | * | * | trans | -152.5 | 126.3 | 159.8 | 54.4 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 117 | T | 37.5 | Very low | 38.3 | Very low | 128 Ų | 128 | 149.7 Ų | 149.7 | 79% | 0.785 | 83% | 0.834 | S | S | * | * | trans | 81.2 | 98.6 | 147.4 | -38.8 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 118 | L | 41.1 | Very low | 38.3 | Very low | 170 Ų | 170 | 150.7 Ų | 150.7 | 89% | 0.89 | 83% | 0.829 | S | S | * | * | -164 | 101.6 | 112.8 | -153.4 | 70.3 | 0 | 0 | 0 | 110.4 | |||||
| 119 | E | 35.6 | Very low | 38.3 | Very low | 194 Ų | 194 | 146.5 Ų | 146.5 | 91% | 0.907 | 82% | 0.817 | S | S | * | * | trans | -74 | 151 | 161.6 | -64.1 | -156.7 | 119.4 | 0 | 0 | 110.6 | ||||
| 120 | G | 36.3 | Very low | 38.4 | Very low | 67 Ų | 67 | 146.8 Ų | 146.8 | 69% | 0.691 | 82% | 0.821 | S | S | * | * | trans | 146.8 | 107.6 | 153.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 121 | S | 39.1 | Very low | 38.1 | Very low | 118 Ų | 118 | 146.7 Ų | 146.7 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | trans | 66.2 | 121.3 | 139.9 | -60.7 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 122 | T | 43.6 | Very low | 38.4 | Very low | 137 Ų | 137 | 147.5 Ų | 147.5 | 84% | 0.84 | 82% | 0.818 | S | S | * | * | -165.1 | 135.3 | 50.7 | 45.1 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 123 | K | 40 | Very low | 38.4 | Very low | 197 Ų | 197 | 147.2 Ų | 147.2 | 86% | 0.857 | 81% | 0.812 | S | S | * | * | trans | -73.5 | 146.7 | 162.9 | -63.8 | 171.1 | 176.8 | 174.9 | 0 | 110.8 | ||||
| 124 | K | 42.1 | Very low | 38.2 | Very low | 204 Ų | 204 | 142.7 Ų | 142.7 | 89% | 0.887 | 80% | 0.804 | S | S | * | * | trans | 162.4 | 103.1 | 142.6 | -88.3 | 161.8 | -172.3 | -172.1 | 0 | 108.4 | ||||
| 125 | A | 35.6 | Very low | 38 | Very low | 88 Ų | 88 | 144.4 Ų | 144.4 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | 79.9 | 109.6 | 86.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 126 | Y | 34.2 | Very low | 38.5 | Very low | 239 Ų | 239 | 144.4 Ų | 144.4 | 94% | 0.937 | 80% | 0.804 | S | S | * | * | trans | -160.2 | 117 | 132.7 | -112.4 | -81.6 | 0 | 0 | 0 | 109.7 | ||||
| 127 | S | 33.3 | Very low | 39 | Very low | 109 Ų | 109 | 149 Ų | 149 | 76% | 0.762 | 81% | 0.807 | S | S | * | * | trans | -86.6 | 140.7 | 168 | 166 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 128 | H | 42.6 | Very low | 39 | Very low | 168 Ų | 168 | 154.6 Ų | 154.6 | 78% | 0.778 | 81% | 0.814 | S | S | * | * | trans | -173.3 | 109.2 | 136.6 | -161.7 | -99.7 | 0 | 0 | 0 | 112.9 | ||||
| 129 | V | 39.2 | Very low | 39.8 | Very low | 119 Ų | 119 | 153 Ų | 153 | 72% | 0.721 | 80% | 0.804 | S | S | * | * | trans | 68 | 128.7 | 135.5 | -178.9 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 130 | G | 36.3 | Very low | 40.7 | Very low | 72 Ų | 72 | 152.4 Ų | 152.4 | 74% | 0.742 | 80% | 0.799 | S | S | * | * | trans | 167.5 | 68.4 | 156.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 131 | Q | 34.5 | Very low | 41.2 | Very low | 168 Ų | 168 | 158 Ų | 158 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | trans | -74.5 | 119.1 | -178.9 | -170.5 | 174.9 | 7.7 | 0 | 0 | 111.4 | ||||
| 132 | I | 43.4 | Very low | 41.7 | Very low | 169 Ų | 169 | 160.4 Ų | 160.4 | 87% | 0.867 | 81% | 0.805 | S | S | * | * | trans | -136.4 | 132 | 159.1 | -61.4 | -169.6 | 0 | 0 | 0 | 109.7 | ||||
| 133 | H | 40.7 | Very low | 41.7 | Very low | 152 Ų | 152 | 160 Ų | 160 | 70% | 0.704 | 80% | 0.803 | S | S | * | * | trans | -76 | 145.9 | -166.3 | -85.3 | -139.2 | 0 | 0 | 0 | 116 | ||||
| 134 | A | 34.5 | Very low | 42.5 | Very low | 80 Ų | 80 | 158 Ų | 158 | 66% | 0.661 | 80% | 0.8 | S | S | * | * | trans | 76.7 | 133.1 | 134.1 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 135 | N | 36.8 | Very low | 42.7 | Very low | 154 Ų | 154 | 155.9 Ų | 155.9 | 82% | 0.824 | 79% | 0.793 | S | S | * | * | trans | 88.9 | 78.5 | 158.2 | -55.1 | -29.4 | 0 | 0 | 0 | 118 | ||||
| 136 | D | 41.8 | Very low | 43 | Very low | 167 Ų | 167 | 160.8 Ų | 160.8 | 89% | 0.893 | 80% | 0.801 | S | S | * | * | -155.7 | 140.2 | 127.8 | -132.4 | -47.3 | 0 | 0 | 0 | 112.4 | R138 | D136-R138 PolarHBondContact O-N 3.04Š| |||
| 137 | R | 50.5 | Low | 43.6 | Very low | 228 Ų | 228 | 153.7 Ų | 153.7 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | trans | -68.7 | 128.7 | -170.5 | -77.1 | 174.2 | 168.2 | -179.3 | -3.9 | 110.8 | I139 | R137-I139 PolarHBondContact O-N 3.28Š| ||
| 138 | R | 37.3 | Very low | 43.8 | Very low | 247 Ų | 247 | 156.6 Ų | 156.6 | 93% | 0.932 | 78% | 0.784 | S | S | * | * | trans | -39.4 | 91.5 | 168.1 | -167.2 | 179 | -143.9 | -148.7 | 2.8 | 112.9 | D136 | D136-R138 PolarHBondContact O-N 3.04Š| ||
| 139 | I | 59 | Low | 43.7 | Very low | 135 Ų | 135 | 154.7 Ų | 154.7 | 69% | 0.692 | 78% | 0.775 | S | S | * | * | trans | -80.7 | 118.8 | 157.8 | -63 | 175.2 | 0 | 0 | 0 | 105.3 | R137 E141 | R137-I139 PolarHBondContact O-N 3.28Å; I139-E141 PolarHBondContact O-N 3.13Å | ||
| 140 | K | 54 | Low | 43.7 | Very low | 183 Ų | 183 | 154.7 Ų | 154.7 | 80% | 0.796 | 78% | 0.777 | S | S | * | * | trans | -44.4 | 111.6 | 174.7 | -122.2 | 170.1 | 174.8 | -179.3 | 0 | 109.3 | E142 | K140-E142 PolarHBondContact O-N 3.07Š| ||
| 141 | E | 46 | Very low | 44.3 | Very low | 185 Ų | 185 | 159.9 Ų | 159.9 | 86% | 0.864 | 78% | 0.779 | S | S | * | * | trans | -65.8 | 98.4 | 165.9 | -85.2 | 173.7 | 139.3 | 0 | 0 | 107.2 | I139 T143 | I139-E141 PolarHBondContact O-N 3.13Å; E141-T143 PolarHBondContact O-N 3.23Å | ||
| 142 | E | 50.7 | Low | 44.5 | Very low | 167 Ų | 167 | 159.1 Ų | 159.1 | 78% | 0.78 | 78% | 0.776 | S | S | * | * | trans | -77 | 107.1 | 157.8 | -69.6 | -178.9 | 168.9 | 0 | 0 | 106.3 | K140 I144 | K140-E142 PolarHBondContact O-N 3.07Å; E142-I144 VanDerWaalsContact C-N 3.34Å; E142-I144 PolarHBondContact O-N 3.02Å | ||
| 143 | T | 42.5 | Very low | 44.9 | Very low | 129 Ų | 129 | 156.6 Ų | 156.6 | 79% | 0.791 | 77% | 0.77 | S | S | * | * | trans | -54.2 | 95 | 168.8 | -55.4 | 0 | 0 | 0 | 0 | 108.7 | E141 E145 | E141-T143 PolarHBondContact O-N 3.23Å; T143-E145 PolarHBondContact O-N 2.94Å | ||
| 144 | I | 57.8 | Low | 45.1 | Very low | 155 Ų | 155 | 156.5 Ų | 156.5 | 80% | 0.795 | 77% | 0.774 | S | S | * | * | trans | -80.7 | 104.1 | 164.6 | -60.7 | 174.5 | 0 | 0 | 0 | 105.1 | E142 E146 | E142-I144 VanDerWaalsContact C-N 3.34Å; E142-I144 PolarHBondContact O-N 3.02Å; I144-E146 PolarHBondContact O-N 3.31Å | ||
| 145 | E | 46 | Very low | 45.4 | Very low | 159 Ų | 159 | 157.2 Ų | 157.2 | 74% | 0.743 | 77% | 0.774 | S | S | * | * | trans | -46.2 | 124.2 | 171.3 | -75.5 | -174 | 142.3 | 0 | 0 | 110.2 | T143 V147 | T143-E145 PolarHBondContact O-N 2.94Å; E145-V147 HydrophobicContact CB-CG2 4.47Å; E145-V147 PolarHBondContact O-N 2.8Å | ||
| 146 | E | 41.3 | Very low | 45.8 | Very low | 191 Ų | 191 | 157.8 Ų | 157.8 | 89% | 0.893 | 78% | 0.775 | S | S | * | * | trans | -72.7 | 76.9 | 176.8 | -164.1 | 176.7 | -164.3 | 0 | 0 | 108.4 | I144 H148 | I144-E146 PolarHBondContact O-N 3.31Å; E146-H148 PolarHBondContact O-N 3.43Å | ||
| 147 | V | 47 | Very low | 45.9 | Very low | 91 Ų | 91 | 153.3 Ų | 153.3 | 55% | 0.552 | 76% | 0.761 | S | S | * | * | trans | -73.9 | 101.6 | 171.9 | -164 | 0 | 0 | 0 | 0 | 108 | E145 H149 | E145-V147 HydrophobicContact CB-CG2 4.47Å; E145-V147 PolarHBondContact O-N 2.8Å; V147-H149 VanDerWaalsContact C-N 3.33Å; V147-H149 VanDerWaalsContact CB-CE1 3.44Å; V147-H149 WeakPolarHBondContact CB-CE1 3.41Å; V147-H149 WeakPolarHBondContact CG1-CE1 3.31Å; V147-H149 WeakPolarHBondContact CG1-ND1 3.14Å; V147-H149 PolarHBondContact O-N 3.43Å | ||
| 148 | H | 37.8 | Very low | 45.9 | Very low | 170 Ų | 170 | 151 Ų | 151 | 79% | 0.787 | 76% | 0.76 | S | S | * | * | trans | -61.9 | 90 | 172.7 | -164.9 | 80.8 | 0 | 0 | 0 | 109.6 | E146 | E146-H148 PolarHBondContact O-N 3.43Š| ||
| 149 | H | 41.4 | Very low | 46.3 | Very low | 128 Ų | 128 | 145 Ų | 145 | 59% | 0.593 | 75% | 0.753 | S | S | * | * | trans | -91.6 | 117.8 | 168 | -48.8 | -45.3 | 0 | 0 | 0 | 108.8 | V147 K151 | V147-H149 VanDerWaalsContact C-N 3.33Å; V147-H149 VanDerWaalsContact CB-CE1 3.44Å; V147-H149 WeakPolarHBondContact CB-CE1 3.41Å; V147-H149 WeakPolarHBondContact CG1-CE1 3.31Å; V147-H149 WeakPolarHBondContact CG1-ND1 3.14Å; V147-H149 PolarHBondContact O-N 3.43Å; H149-K151 VanDerWaalsContact C-N 3.32Å; H149-K151 HydrophobicContact CB-CG 4.46Å; H149-K151 PolarHBondContact O-N 2.94Å | ||
| 150 | P | 39.2 | Very low | 46.3 | Very low | 119 Ų | 119 | 145.2 Ų | 145.2 | 77% | 0.773 | 75% | 0.751 | S | S | * | * | trans | -76.2 | 93.2 | 165.3 | 31.8 | -26.8 | 0 | 0 | 0 | 106.1 | ||||
| 151 | K | 47.3 | Very low | 46.7 | Very low | 180 Ų | 180 | 144.5 Ų | 144.5 | 78% | 0.783 | 75% | 0.751 | S | S | * | * | trans | -120.8 | 112 | 171 | -79.2 | -175.9 | 177.3 | 178.3 | 0 | 109.2 | H149 | H149-K151 VanDerWaalsContact C-N 3.32Å; H149-K151 HydrophobicContact CB-CG 4.46Å; H149-K151 PolarHBondContact O-N 2.94Å | ||
| 152 | E | 38.8 | Very low | 47.8 | Very low | 152 Ų | 152 | 144.2 Ų | 144.2 | 71% | 0.71 | 75% | 0.749 | S | S | * | * | trans | -47 | 126.6 | 177.1 | -56.4 | -174.3 | 153.5 | 0 | 0 | 111.7 | I154 | E152-I154 PolarHBondContact O-N 3.37Š| ||
| 153 | P | 52.1 | Low | 48.9 | Very low | 116 Ų | 116 | 138.8 Ų | 138.8 | 75% | 0.753 | 73% | 0.725 | S | S | * | * | trans | -84.5 | 104.4 | 161.3 | 30.5 | -26 | 0 | 0 | 0 | 108.2 | S155 | P153-S155 PolarHBondContact O-N 3.1Š| ||
| 154 | I | 46.3 | Very low | 50.5 | Low | 151 Ų | 151 | 137.5 Ų | 137.5 | 77% | 0.774 | 72% | 0.719 | S | S | * | * | trans | -61.5 | 92.7 | 158.5 | -62.8 | 167.1 | 0 | 0 | 0 | 106.3 | E152 I156 | E152-I154 PolarHBondContact O-N 3.37Å; I154-I156 HydrophobicContact CG2-CG1 4.38Å | ||
| 155 | S | 40.6 | Very low | 51.7 | Low | 94 Ų | 94 | 134.4 Ų | 134.4 | 66% | 0.657 | 70% | 0.701 | S | S | * | * | trans | -109.5 | 97 | 172.8 | 175.7 | 0 | 0 | 0 | 0 | 107.6 | P153 A157 | P153-S155 PolarHBondContact O-N 3.1Å; S155-A157 PolarHBondContact O-N 3.44Å; S155-A157 VanDerWaalsContact O-N 3.09Å | ||
| 156 | I | 44.9 | Very low | 53.5 | Low | 167 Ų | 167 | 130 Ų | 130 | 86% | 0.856 | 68% | 0.684 | S | S | * | * | trans | -70.9 | 92.8 | 166.2 | -57.3 | 168.2 | 0 | 0 | 0 | 106.6 | I154 | I154-I156 HydrophobicContact CG2-CG1 4.38Š| ||
| 157 | A | 42.9 | Very low | 55.4 | Low | 73 Ų | 73 | 124.5 Ų | 124.5 | 60% | 0.603 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -177.5 | 114.4 | 160.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | S155 | S155-A157 PolarHBondContact O-N 3.44Å; S155-A157 VanDerWaalsContact O-N 3.09Å |
| 158 | E | 51.5 | Low | 56.8 | Low | 180 Ų | 180 | 121.5 Ų | 121.5 | 84% | 0.841 | 65% | 0.645 | S | S | * | * | trans | 62.4 | 143.2 | 164.6 | -69.9 | -142.8 | 130.5 | 0 | 0 | 119.3 | E160 | E158-E160 VanDerWaalsContact C-N 3.34Å; E158-E160 PolarHBondContact O-N 2.94Å | ||
| 159 | P | 45.9 | Very low | 58.5 | Low | 120 Ų | 120 | 118.2 Ų | 118.2 | 78% | 0.779 | 64% | 0.639 | S | S | * | * | trans | -64.3 | 98.6 | 171.8 | 28.8 | -32.4 | 0 | 0 | 0 | 108.2 | E161 | P159-E161 VanDerWaalsContact C-N 3.29Å; P159-E161 PolarHBondContact O-N 3.18Å | ||
| 160 | E | 58.9 | Low | 59.8 | Low | 139 Ų | 139 | 115.6 Ų | 115.6 | 65% | 0.65 | 64% | 0.635 | S | S | * | * | trans | -65.8 | 92.3 | 175.2 | -159.6 | 155.6 | -146.7 | 0 | 0 | 107.3 | E158 H162 K189 | E158-E160 VanDerWaalsContact C-N 3.34Å; E158-E160 PolarHBondContact O-N 2.94Å; E160-H162 PolarHBondContact O-N 3.13Å; E160-K189 IonicContact OE1-NZ 2.7Å; E160-K189 PolarHBondContact OE1-NZ 2.91Å | ||
| 161 | E | 61.4 | Low | 61.2 | Low | 169 Ų | 169 | 115.8 Ų | 115.8 | 79% | 0.79 | 64% | 0.635 | S | S | * | * | trans | -44 | 127.3 | 167 | -75.1 | -178.2 | 161.4 | 0 | 0 | 107.7 | P159 I163 | P159-E161 VanDerWaalsContact C-N 3.29Å; P159-E161 PolarHBondContact O-N 3.18Å; E161-I163 VanDerWaalsContact C-N 3.28Å; E161-I163 WeakPolarHBondContact O-CG1 3.48Å; E161-I163 PolarHBondContact O-N 3.07Å | ||
| 162 | H | 68.5 | Low | 61.9 | Low | 178 Ų | 178 | 112.6 Ų | 112.6 | 82% | 0.824 | 63% | 0.626 | S | S | * | * | trans | -65.1 | 86.9 | -172.5 | -159 | 85.7 | 0 | 0 | 0 | 109.8 | E160 P164 | E160-H162 PolarHBondContact O-N 3.13Å; H162-P164 VanDerWaalsContact O-CD 3.32Å; H162-P164 WeakPolarHBondContact O-CD 3.35Å | ||
| 163 | I | 73.8 | Confident | 63.1 | Low | 54 Ų | 54 | 109 Ų | 109 | 28% | 0.277 | 63% | 0.63 | S | S | . | * | P | Polyproline II helix | trans | -65.6 | 116.9 | -176.5 | -63.2 | 173 | 0 | 0 | 0 | 107.7 | E161 H165 K185 A186 | E161-I163 VanDerWaalsContact C-N 3.28Å; E161-I163 WeakPolarHBondContact O-CG1 3.48Å; E161-I163 PolarHBondContact O-N 3.07Å; I163-H165 PolarHBondContact O-N 2.91Å; I163-K185 HydrophobicContact CD1-CD 4.25Å; I163-K185 HydrophobicContact CD1-CG 4.36Å; I163-K185 HydrophobicContact CG2-CB 3.91Å; I163-K185 HydrophobicContact CG2-CD 4.47Å; I163-K185 HydrophobicContact CG2-CG 4.43Å; I163-A186 HydrophobicContact CB-CB 4.35Å; I163-A186 HydrophobicContact CG2-CB 4.37Å |
| 164 | P | 77.4 | Confident | 63.5 | Low | 102 Ų | 102 | 112 Ų | 112 | 66% | 0.662 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 137.5 | -176.6 | 24.7 | -32.9 | 0 | 0 | 0 | 110.7 | H162 | H162-P164 VanDerWaalsContact O-CD 3.32Å; H162-P164 WeakPolarHBondContact O-CD 3.35Å |
| 165 | H | 83 | Confident | 64.4 | Low | 90 Ų | 90 | 111.6 Ų | 111.6 | 42% | 0.417 | 63% | 0.628 | S | S | . | * | P | Polyproline II helix | trans | -71.4 | 130.7 | 174.4 | -73 | -91.6 | 0 | 0 | 0 | 110.3 | I163 L167 C179 C184 C187 | I163-H165 PolarHBondContact O-N 2.91Å; H165-L167 HydrophobicContact CB-CD2 4.11Å; H165-L167 PolarHBondContact O-N 3.07Å; H165-C179 VanDerWaalsContact CB-SG 3.54Å; H165-C179 VanDerWaalsContact CG-SG 3.58Å; H165-C179 PolarHBondContact ND1-SG 3.11Å; H165-C184 PolarHBondContact ND1-SG 3.41Å; H165-C187 VanDerWaalsContact CE1-SG 3.51Å; H165-C187 PolarHBondContact ND1-SG 3.48Å |
| 166 | V | 83.4 | Confident | 65.8 | Low | 65 Ų | 65 | 112.3 Ų | 112.3 | 39% | 0.394 | 63% | 0.63 | S | S | . | * | trans | -82.6 | 108.8 | 172.1 | -175.6 | 0 | 0 | 0 | 0 | 108 | C179 L180 A183 C184 | V166-C179 CarbonylContact O-C 3.56Å; V166-C179 WeakPolarHBondContact O-CA 3.28Å; V166-L180 HydrophobicContact CG1-CD1 4.14Å; V166-L180 PolarHBondContact O-N 3.36Å; V166-A183 HydrophobicContact CB-CB 4.01Å; V166-A183 HydrophobicContact CG1-CB 3.82Å; V166-A183 HydrophobicContact CG2-CB 4.29Å; V166-A183 WeakPolarHBondContact CG2-O 3.4Å; V166-C184 HydrophobicContact CB-CB 4.24Å | ||
| 167 | L | 81.2 | Confident | 67.1 | Low | 77 Ų | 77 | 109.3 Ų | 109.3 | 40% | 0.403 | 61% | 0.608 | S | S | . | * | B | Isolated β-bridge | trans | -91.5 | 131.6 | -172.3 | -59.7 | 177.9 | 0 | 0 | 0 | 112 | H165 R177 | H165-L167 HydrophobicContact CB-CD2 4.11Å; H165-L167 PolarHBondContact O-N 3.07Å; L167-R177 HydrophobicContact CB-CB 3.85Å; L167-R177 HydrophobicContact CB-CG 4.46Å; L167-R177 HydrophobicContact CD1-CB 4.07Å; L167-R177 HydrophobicContact CD1-CG 4.41Å; L167-R177 HydrophobicContact CD2-CB 4.09Å; L167-R177 HydrophobicContact CG-CB 4.22Å; L167-R177 PolarHBondContact O-NH2 3.28Å |
| 168 | A | 77.2 | Confident | 69 | Low | 27 Ų | 27 | 115.5 Ų | 115.5 | 22% | 0.223 | 62% | 0.616 | C | S | . | * | P | Polyproline II helix | trans | -60.3 | 137.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | S170 R177 R178 L180 | A168-S170 PolarHBondContact O-N 3.4Å; A168-R177 VanDerWaalsContact O-CD 3.23Å; A168-R177 WeakPolarHBondContact O-CD 3.41Å; A168-R177 PolarHBondContact O-NE 2.96Å; A168-R177 PolarHBondContact O-NH2 3.19Å; A168-R177 VanDerWaalsContact O-NH2 3.13Å; A168-R178 WeakPolarHBondContact CB-O 3.37Å; A168-R178 PolarHBondContact N-O 2.99Å; A168-L180 HydrophobicContact CB-CD2 3.49Å; A168-L180 VanDerWaalsContact CB-CD2 3.49Å; A168-L180 HydrophobicContact CB-CG 3.92Å |
| 169 | P | 72.8 | Confident | 70.7 | Confident | 101 Ų | 101 | 108.5 Ų | 108.5 | 66% | 0.656 | 59% | 0.587 | S | S | * | * | P | Polyproline II helix | trans | -47.5 | 134.7 | 177.8 | -28.5 | 35.6 | 0 | 0 | 0 | 113.3 | T171 | P169-T171 PolarHBondContact O-N 2.8Š|
| 170 | S | 68.6 | Low | 72.6 | Confident | 74 Ų | 74 | 104.8 Ų | 104.8 | 52% | 0.517 | 56% | 0.56 | S | S | . | * | P | Polyproline II helix | trans | -67.9 | 116.5 | 179.6 | -57.4 | 0 | 0 | 0 | 0 | 107.7 | A168 R177 | A168-S170 PolarHBondContact O-N 3.4Å; S170-R177 WeakPolarHBondContact OG-CD 3.33Å; S170-R177 PolarHBondContact OG-NH1 3.13Å |
| 171 | T | 69.3 | Low | 73.7 | Confident | 123 Ų | 123 | 103 Ų | 103 | 76% | 0.755 | 55% | 0.554 | S | S | * | * | S | Bend | trans | -86.5 | -22.4 | 165.2 | 49.9 | 0 | 0 | 0 | 0 | 111.3 | P169 | P169-T171 PolarHBondContact O-N 2.8Š|
| 172 | D | 61 | Low | 74.8 | Confident | 112 Ų | 112 | 104.2 Ų | 104.2 | 60% | 0.599 | 55% | 0.552 | S | S | * | * | S | Bend | trans | -143.3 | 122.8 | -171.8 | -42.7 | -70.5 | 0 | 0 | 0 | 109.7 | H174 | D172-H174 PolarHBondContact O-N 3.2Š|
| 173 | G | 64.3 | Low | 75.7 | Confident | 77 Ų | 77 | 97.2 Ų | 97.2 | 79% | 0.794 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.2 | 15.4 | -167.6 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||
| 174 | H | 61.7 | Low | 76.3 | Confident | 179 Ų | 179 | 94.7 Ų | 94.7 | 83% | 0.829 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -138 | 15.5 | -171.4 | -79.5 | -32.3 | 0 | 0 | 0 | 116.1 | D172 | D172-H174 PolarHBondContact O-N 3.2Š|
| 175 | Q | 64.8 | Low | 76.6 | Confident | 142 Ų | 142 | 96.8 Ų | 96.8 | 66% | 0.664 | 51% | 0.511 | S | S | * | . | S | Bend | trans | -125.1 | 142 | 176.2 | -67.2 | -65.6 | -58.6 | 0 | 0 | 112.5 | R177 | Q175-R177 PolarHBondContact O-N 3.43Š|
| 176 | P | 69.6 | Low | 76.5 | Confident | 109 Ų | 109 | 93.8 Ų | 93.8 | 71% | 0.708 | 50% | 0.502 | S | S | * | . | P | Polyproline II helix | trans | -59.6 | 127.2 | 173.8 | 24.7 | -32.1 | 0 | 0 | 0 | 109.8 | R178 | P176-R178 PolarHBondContact O-N 3.11Š|
| 177 | R | 72.2 | Confident | 76.6 | Confident | 104 Ų | 104 | 91.9 Ų | 91.9 | 39% | 0.392 | 49% | 0.491 | S | S | . | . | P | Polyproline II helix | trans | -64.5 | 131.5 | -173.5 | -56.9 | -108.6 | -67.6 | -151.3 | 11.4 | 110.4 | L167 A168 S170 Q175 | L167-R177 HydrophobicContact CB-CB 3.85Å; L167-R177 HydrophobicContact CB-CG 4.46Å; L167-R177 HydrophobicContact CD1-CB 4.07Å; L167-R177 HydrophobicContact CD1-CG 4.41Å; L167-R177 HydrophobicContact CD2-CB 4.09Å; L167-R177 HydrophobicContact CG-CB 4.22Å; L167-R177 PolarHBondContact O-NH2 3.28Å; A168-R177 VanDerWaalsContact O-CD 3.23Å; A168-R177 WeakPolarHBondContact O-CD 3.41Å; A168-R177 PolarHBondContact O-NE 2.96Å; A168-R177 PolarHBondContact O-NH2 3.19Å; A168-R177 VanDerWaalsContact O-NH2 3.13Å; S170-R177 WeakPolarHBondContact OG-CD 3.33Å; S170-R177 PolarHBondContact OG-NH1 3.13Å; Q175-R177 PolarHBondContact O-N 3.43Å |
| 178 | R | 82.4 | Confident | 76.7 | Confident | 203 Ų | 203 | 93.4 Ų | 93.4 | 77% | 0.766 | 49% | 0.494 | S | S | * | . | P | Polyproline II helix | trans | -78.1 | 146.2 | 172.2 | -54.8 | -177.3 | -168.2 | -81.6 | -1.9 | 109.6 | A168 P176 | A168-R178 WeakPolarHBondContact CB-O 3.37Å; A168-R178 PolarHBondContact N-O 2.99Å; P176-R178 PolarHBondContact O-N 3.11Å |
| 179 | C | 87.3 | Confident | 77 | Confident | 34 Ų | 34 | 97.8 Ų | 97.8 | 23% | 0.23 | 51% | 0.508 | C | S | . | . | B | Isolated β-bridge | trans | -71.8 | 139.1 | 175 | -61.4 | 0 | 0 | 0 | 0 | 110.5 | H165 V166 L181 C184 C187 | H165-C179 VanDerWaalsContact CB-SG 3.54Å; H165-C179 VanDerWaalsContact CG-SG 3.58Å; H165-C179 PolarHBondContact ND1-SG 3.11Å; V166-C179 CarbonylContact O-C 3.56Å; V166-C179 WeakPolarHBondContact O-CA 3.28Å; C179-L181 PolarHBondContact O-N 3.34Å; C179-C184 HydrophobicContact CB-CB 3.96Å; C179-C187 HydrophobicContact CB-CB 4.41Å; C179-C187 VanDerWaalsContact CB-SG 3.53Å; C179-C187 VanDerWaalsContact SG-SG 3.6Å |
| 180 | L | 85.6 | Confident | 77.5 | Confident | 41 Ų | 41 | 100.2 Ų | 100.2 | 22% | 0.215 | 51% | 0.509 | C | S | . | . | trans | -71.1 | 98.2 | 167.5 | -68.2 | 177.4 | 0 | 0 | 0 | 108.3 | V166 A168 W182 A183 C184 | V166-L180 HydrophobicContact CG1-CD1 4.14Å; V166-L180 PolarHBondContact O-N 3.36Å; A168-L180 HydrophobicContact CB-CD2 3.49Å; A168-L180 VanDerWaalsContact CB-CD2 3.49Å; A168-L180 HydrophobicContact CB-CG 3.92Å; L180-W182 HydrophobicContact CD1-CZ2 3.93Å; L180-W182 PolarHBondContact O-N 3.32Å; L180-A183 HydrophobicContact CB-CB 4Å; L180-A183 PolarHBondContact O-N 3.26Å; L180-C184 WeakPolarHBondContact O-CB 3.41Å; L180-C184 PolarHBondContact O-N 3.09Å | ||
| 181 | L | 82.2 | Confident | 78.4 | Confident | 101 Ų | 101 | 98.8 Ų | 98.8 | 53% | 0.529 | 50% | 0.497 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.6 | -30.3 | -176.2 | -67.9 | 175.2 | 0 | 0 | 0 | 113.6 | C179 C187 | C179-L181 PolarHBondContact O-N 3.34Å; L181-C187 HydrophobicContact CD2-CB 3.88Å |
| 182 | W | 85.2 | Confident | 79.2 | Confident | 195 Ų | 195 | 96.6 Ų | 96.6 | 74% | 0.739 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.2 | -31.3 | 177.4 | 67.1 | -96.3 | 0 | 0 | 0 | 113.4 | L180 | L180-W182 HydrophobicContact CD1-CZ2 3.93Å; L180-W182 PolarHBondContact O-N 3.32Å |
| 183 | A | 86.2 | Confident | 80.6 | Confident | 32 Ų | 32 | 95 Ų | 95 | 26% | 0.264 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.6 | -27 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | V166 L180 K185 | V166-A183 HydrophobicContact CB-CB 4.01Å; V166-A183 HydrophobicContact CG1-CB 3.82Å; V166-A183 HydrophobicContact CG2-CB 4.29Å; V166-A183 WeakPolarHBondContact CG2-O 3.4Å; L180-A183 HydrophobicContact CB-CB 4Å; L180-A183 PolarHBondContact O-N 3.26Å; A183-K185 PolarHBondContact O-N 3.17Å |
| 184 | C | 86.9 | Confident | 81.6 | Confident | 0 Ų | 0 | 94.8 Ų | 94.8 | 0% | 0 | 46% | 0.457 | C | S | . | . | trans | -79.2 | 102.8 | -175.2 | 177.1 | 0 | 0 | 0 | 0 | 110.2 | H165 V166 C179 L180 A186 C187 K188 | H165-C184 PolarHBondContact ND1-SG 3.41Å; V166-C184 HydrophobicContact CB-CB 4.24Å; C179-C184 HydrophobicContact CB-CB 3.96Å; L180-C184 WeakPolarHBondContact O-CB 3.41Å; L180-C184 PolarHBondContact O-N 3.09Å; C184-A186 VanDerWaalsContact C-N 3.3Å; C184-A186 PolarHBondContact O-N 3.01Å; C184-C187 HydrophobicContact CB-CB 4.12Å; C184-C187 PolarHBondContact O-N 3Å; C184-C187 PolarHBondContact SG-N 3.06Å; C184-C187 VanDerWaalsContact SG-N 3.39Å; C184-K188 WeakPolarHBondContact O-CB 3.39Å; C184-K188 PolarHBondContact O-N 3.18Å | ||
| 185 | K | 83.5 | Confident | 83.1 | Confident | 146 Ų | 146 | 90 Ų | 90 | 64% | 0.635 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -61.7 | -35.2 | -178.3 | -171.8 | 179.8 | -172.2 | -162 | 0 | 112.7 | I163 A183 K189 | I163-K185 HydrophobicContact CD1-CD 4.25Å; I163-K185 HydrophobicContact CD1-CG 4.36Å; I163-K185 HydrophobicContact CG2-CB 3.91Å; I163-K185 HydrophobicContact CG2-CD 4.47Å; I163-K185 HydrophobicContact CG2-CG 4.43Å; A183-K185 PolarHBondContact O-N 3.17Å; K185-K189 WeakPolarHBondContact O-CB 3.36Å; K185-K189 PolarHBondContact O-N 3.38Å |
| 186 | A | 82.2 | Confident | 84.5 | Confident | 27 Ų | 27 | 92.5 Ų | 92.5 | 22% | 0.223 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -62.1 | -53.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | I163 C184 K190 | I163-A186 HydrophobicContact CB-CB 4.35Å; I163-A186 HydrophobicContact CG2-CB 4.37Å; C184-A186 VanDerWaalsContact C-N 3.3Å; C184-A186 PolarHBondContact O-N 3.01Å; A186-K190 PolarHBondContact O-N 3.09Å |
| 187 | C | 83.6 | Confident | 85.6 | Confident | 25 Ų | 25 | 95.9 Ų | 95.9 | 17% | 0.169 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -66.5 | -40.6 | 176.7 | -67.4 | 0 | 0 | 0 | 0 | 112 | H165 C179 L181 C184 K189 K190 T191 | H165-C187 VanDerWaalsContact CE1-SG 3.51Å; H165-C187 PolarHBondContact ND1-SG 3.48Å; C179-C187 HydrophobicContact CB-CB 4.41Å; C179-C187 VanDerWaalsContact CB-SG 3.53Å; C179-C187 VanDerWaalsContact SG-SG 3.6Å; L181-C187 HydrophobicContact CD2-CB 3.88Å; C184-C187 HydrophobicContact CB-CB 4.12Å; C184-C187 PolarHBondContact O-N 3Å; C184-C187 PolarHBondContact SG-N 3.06Å; C184-C187 VanDerWaalsContact SG-N 3.39Å; C187-K189 PolarHBondContact O-N 3.19Å; C187-K190 PolarHBondContact O-N 3.11Å; C187-T191 WeakPolarHBondContact O-CB 3.23Å; C187-T191 PolarHBondContact O-N 3.49Å; C187-T191 PolarHBondContact O-OG1 3.21Å; C187-T191 VanDerWaalsContact O-OG1 3.06Å |
| 188 | K | 85.3 | Confident | 86.7 | Confident | 109 Ų | 109 | 97.2 Ų | 97.2 | 47% | 0.474 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -60.7 | -42 | 179.7 | -172.8 | 175.7 | -177.9 | -176.9 | 0 | 111.6 | C184 K190 T191 V192 | C184-K188 WeakPolarHBondContact O-CB 3.39Å; C184-K188 PolarHBondContact O-N 3.18Å; K188-K190 VanDerWaalsContact C-N 3.34Å; K188-K190 PolarHBondContact O-N 3.29Å; K188-T191 PolarHBondContact O-N 3.26Å; K188-V192 HydrophobicContact CG-CG2 3.72Å; K188-V192 WeakPolarHBondContact O-CB 3.3Å; K188-V192 WeakPolarHBondContact O-CG2 3.48Å; K188-V192 PolarHBondContact O-N 2.74Å |
| 189 | K | 83.5 | Confident | 87.3 | Confident | 120 Ų | 120 | 89.8 Ų | 89.8 | 52% | 0.522 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -59.4 | -45.3 | 176.1 | -174.2 | -178.7 | 175.5 | -170 | 0 | 111.3 | E160 K185 C187 T193 | E160-K189 IonicContact OE1-NZ 2.7Å; E160-K189 PolarHBondContact OE1-NZ 2.91Å; K185-K189 WeakPolarHBondContact O-CB 3.36Å; K185-K189 PolarHBondContact O-N 3.38Å; C187-K189 PolarHBondContact O-N 3.19Å; K189-T193 WeakPolarHBondContact O-CB 3.42Å; K189-T193 PolarHBondContact O-N 3.23Å; K189-T193 PolarHBondContact O-OG1 3.29Å |
| 190 | K | 83.4 | Confident | 87.7 | Confident | 151 Ų | 151 | 90.4 Ų | 90.4 | 66% | 0.657 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -65.6 | -50 | 176.9 | -171.7 | 172.4 | -178.4 | 178.1 | 0 | 111.6 | A186 C187 K188 T193 I194 | A186-K190 PolarHBondContact O-N 3.09Å; C187-K190 PolarHBondContact O-N 3.11Å; K188-K190 VanDerWaalsContact C-N 3.34Å; K188-K190 PolarHBondContact O-N 3.29Å; K190-T193 PolarHBondContact O-N 3.22Å; K190-I194 HydrophobicContact CG-CD1 4Å; K190-I194 VanDerWaalsContact O-CG1 3.3Å; K190-I194 WeakPolarHBondContact O-CG1 3.41Å; K190-I194 PolarHBondContact O-N 3.02Å; K190-I194 VanDerWaalsContact O-N 3.08Å |
| 191 | T | 86 | Confident | 88.3 | Confident | 45 Ų | 45 | 91.6 Ų | 91.6 | 28% | 0.276 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -64.7 | -48.5 | -179 | -60.5 | 0 | 0 | 0 | 0 | 112.1 | C187 K188 T193 I194 D195 | C187-T191 WeakPolarHBondContact O-CB 3.23Å; C187-T191 PolarHBondContact O-N 3.49Å; C187-T191 PolarHBondContact O-OG1 3.21Å; C187-T191 VanDerWaalsContact O-OG1 3.06Å; K188-T191 PolarHBondContact O-N 3.26Å; T191-T193 VanDerWaalsContact C-N 3.29Å; T191-T193 PolarHBondContact O-N 2.89Å; T191-I194 CarbonylContact O-C 3.6Å; T191-I194 PolarHBondContact O-N 3.1Å; T191-I194 VanDerWaalsContact O-N 3.13Å; T191-D195 WeakPolarHBondContact CG2-OD2 3.27Å; T191-D195 WeakPolarHBondContact O-CB 3.47Å; T191-D195 VanDerWaalsContact O-CG 3.26Å; T191-D195 PolarHBondContact O-N 3.29Å |
| 192 | V | 87.1 | Confident | 89.1 | Confident | 77 Ų | 77 | 89.7 Ų | 89.7 | 47% | 0.467 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -59.8 | -39.5 | 178.4 | 170.5 | 0 | 0 | 0 | 0 | 111.4 | K188 D195 R196 | K188-V192 HydrophobicContact CG-CG2 3.72Å; K188-V192 WeakPolarHBondContact O-CB 3.3Å; K188-V192 WeakPolarHBondContact O-CG2 3.48Å; K188-V192 PolarHBondContact O-N 2.74Å; V192-D195 PolarHBondContact O-N 3.46Å; V192-R196 VanDerWaalsContact O-CB 3.22Å; V192-R196 WeakPolarHBondContact O-CB 3.39Å; V192-R196 PolarHBondContact O-N 3.43Å |
| 193 | T | 88.9 | Confident | 89.7 | Confident | 78 Ų | 78 | 88 Ų | 88 | 48% | 0.479 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.3 | -44.8 | 176.6 | -59.7 | 0 | 0 | 0 | 0 | 111.3 | K189 K190 T191 R196 R197 | K189-T193 WeakPolarHBondContact O-CB 3.42Å; K189-T193 PolarHBondContact O-N 3.23Å; K189-T193 PolarHBondContact O-OG1 3.29Å; K190-T193 PolarHBondContact O-N 3.22Å; T191-T193 VanDerWaalsContact C-N 3.29Å; T191-T193 PolarHBondContact O-N 2.89Å; T193-R196 PolarHBondContact O-N 3.04Å; T193-R197 PolarHBondContact O-N 3.02Å |
| 194 | I | 87 | Confident | 90.3 | Very high | 72 Ų | 72 | 90.2 Ų | 90.2 | 37% | 0.369 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -63.6 | -45.4 | 176 | -68.2 | 167 | 0 | 0 | 0 | 110.6 | K190 T191 R196 R197 K198 | K190-I194 HydrophobicContact CG-CD1 4Å; K190-I194 VanDerWaalsContact O-CG1 3.3Å; K190-I194 WeakPolarHBondContact O-CG1 3.41Å; K190-I194 PolarHBondContact O-N 3.02Å; K190-I194 VanDerWaalsContact O-N 3.08Å; T191-I194 CarbonylContact O-C 3.6Å; T191-I194 PolarHBondContact O-N 3.1Å; T191-I194 VanDerWaalsContact O-N 3.13Å; I194-R196 PolarHBondContact O-N 3.01Å; I194-R197 WeakPolarHBondContact O-CB 3.23Å; I194-R197 PolarHBondContact O-N 3.31Å; I194-R197 VanDerWaalsContact O-N 3.12Å; I194-K198 HydrophobicContact CG2-CD 4.12Å; I194-K198 HydrophobicContact CG2-CG 4.38Å; I194-K198 WeakPolarHBondContact O-CG 3.41Å; I194-K198 PolarHBondContact O-N 3.47Å |
| 195 | D | 92.9 | Very high | 90.8 | Very high | 80 Ų | 80 | 97.6 Ų | 97.6 | 43% | 0.428 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -65.2 | -39.6 | 180 | -70.7 | -18.2 | 0 | 0 | 0 | 111.4 | T191 V192 R197 K198 A199 | T191-D195 WeakPolarHBondContact CG2-OD2 3.27Å; T191-D195 WeakPolarHBondContact O-CB 3.47Å; T191-D195 VanDerWaalsContact O-CG 3.26Å; T191-D195 PolarHBondContact O-N 3.29Å; V192-D195 PolarHBondContact O-N 3.46Å; D195-R197 VanDerWaalsContact C-N 3.3Å; D195-R197 PolarHBondContact O-N 3.26Å; D195-K198 PolarHBondContact O-N 3.27Å; D195-A199 VanDerWaalsContact O-CB 3.26Å; D195-A199 WeakPolarHBondContact O-CB 3.44Å; D195-A199 PolarHBondContact O-N 3.28Å |
| 196 | R | 93 | Very high | 91.5 | Very high | 193 Ų | 193 | 96.7 Ų | 96.7 | 73% | 0.728 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -59.6 | -41.9 | 172 | -172.9 | 178.1 | -176.4 | -166.4 | 1.2 | 111.2 | V192 T193 I194 A200 | V192-R196 VanDerWaalsContact O-CB 3.22Å; V192-R196 WeakPolarHBondContact O-CB 3.39Å; V192-R196 PolarHBondContact O-N 3.43Å; T193-R196 PolarHBondContact O-N 3.04Å; I194-R196 PolarHBondContact O-N 3.01Å; R196-A200 WeakPolarHBondContact O-CB 2.88Å; R196-A200 PolarHBondContact O-N 3.42Å |
| 197 | R | 94.1 | Very high | 92.3 | Very high | 181 Ų | 181 | 101.5 Ų | 101.5 | 68% | 0.683 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -66.1 | -45.1 | 176.3 | -170.1 | -175.8 | -64.7 | -174.3 | -0.9 | 111.7 | T193 I194 D195 A200 T201 | T193-R197 PolarHBondContact O-N 3.02Å; I194-R197 WeakPolarHBondContact O-CB 3.23Å; I194-R197 PolarHBondContact O-N 3.31Å; I194-R197 VanDerWaalsContact O-N 3.12Å; D195-R197 VanDerWaalsContact C-N 3.3Å; D195-R197 PolarHBondContact O-N 3.26Å; R197-A200 PolarHBondContact O-N 3.16Å; R197-T201 WeakPolarHBondContact O-CB 3.39Å; R197-T201 PolarHBondContact O-N 3.22Å; R197-T201 PolarHBondContact O-OG1 2.79Å |
| 198 | K | 94 | Very high | 93 | Very high | 132 Ų | 132 | 103.6 Ų | 103.6 | 57% | 0.574 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -61.2 | -46 | 175.6 | -72.8 | 178.9 | 177.6 | 179.3 | 0 | 111.2 | I194 D195 A200 T201 M202 | I194-K198 HydrophobicContact CG2-CD 4.12Å; I194-K198 HydrophobicContact CG2-CG 4.38Å; I194-K198 WeakPolarHBondContact O-CG 3.41Å; I194-K198 PolarHBondContact O-N 3.47Å; D195-K198 PolarHBondContact O-N 3.27Å; K198-A200 PolarHBondContact O-N 3.35Å; K198-T201 PolarHBondContact O-N 3.12Å; K198-M202 WeakPolarHBondContact O-CB 3.24Å; K198-M202 WeakPolarHBondContact O-CG 3.19Å; K198-M202 PolarHBondContact O-N 3.22Å |
| 199 | A | 95.7 | Very high | 93.7 | Very high | 46 Ų | 46 | 104.6 Ų | 104.6 | 38% | 0.38 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.7 | -40.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | D195 M202 R203 | D195-A199 VanDerWaalsContact O-CB 3.26Å; D195-A199 WeakPolarHBondContact O-CB 3.44Å; D195-A199 PolarHBondContact O-N 3.28Å; A199-M202 PolarHBondContact O-N 2.98Å; A199-R203 WeakPolarHBondContact O-CG 3.44Å; A199-R203 PolarHBondContact O-N 3.37Å |
| 200 | A | 96.4 | Very high | 94.4 | Very high | 47 Ų | 47 | 106.3 Ų | 106.3 | 39% | 0.388 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.5 | -45.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | R196 R197 K198 M202 R203 E204 | R196-A200 WeakPolarHBondContact O-CB 2.88Å; R196-A200 PolarHBondContact O-N 3.42Å; R197-A200 PolarHBondContact O-N 3.16Å; K198-A200 PolarHBondContact O-N 3.35Å; A200-M202 VanDerWaalsContact C-N 3.34Å; A200-M202 PolarHBondContact O-N 2.68Å; A200-R203 WeakPolarHBondContact O-CB 3.15Å; A200-R203 PolarHBondContact O-N 2.76Å; A200-R203 VanDerWaalsContact O-N 3.16Å; A200-E204 PolarHBondContact O-N 3.47Å |
| 201 | T | 97.7 | Very high | 95.1 | Very high | 66 Ų | 66 | 101.5 Ų | 101.5 | 41% | 0.405 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -59.8 | -44 | 176.4 | -55.6 | 0 | 0 | 0 | 0 | 111.4 | R197 K198 R203 E204 R205 | R197-T201 WeakPolarHBondContact O-CB 3.39Å; R197-T201 PolarHBondContact O-N 3.22Å; R197-T201 PolarHBondContact O-OG1 2.79Å; K198-T201 PolarHBondContact O-N 3.12Å; T201-R203 VanDerWaalsContact C-N 3.33Å; T201-R203 PolarHBondContact O-N 3.4Å; T201-E204 PolarHBondContact O-N 3.19Å; T201-R205 WeakPolarHBondContact O-CG 3.43Å; T201-R205 PolarHBondContact O-N 3.33Å |
| 202 | M | 97.9 | Very high | 95.7 | Very high | 61 Ų | 61 | 102.7 Ų | 102.7 | 30% | 0.3 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.1 | -34.3 | 177.2 | -74.1 | -59.9 | -71.1 | 0 | 0 | 112.7 | K198 A199 A200 R206 | K198-M202 WeakPolarHBondContact O-CB 3.24Å; K198-M202 WeakPolarHBondContact O-CG 3.19Å; K198-M202 PolarHBondContact O-N 3.22Å; A199-M202 PolarHBondContact O-N 2.98Å; A200-M202 VanDerWaalsContact C-N 3.34Å; A200-M202 PolarHBondContact O-N 2.68Å; M202-R206 WeakPolarHBondContact O-CG 3.46Å; M202-R206 PolarHBondContact O-N 3.22Å; M202-R206 VanDerWaalsContact O-N 3.14Å |
| 203 | R | 98.3 | Very high | 96.2 | Very high | 161 Ų | 161 | 105 Ų | 105 | 61% | 0.608 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -63.3 | -46.4 | 171.3 | -78 | -172.7 | -80.9 | -153.4 | -0.7 | 111.4 | A199 A200 T201 R206 R207 | A199-R203 WeakPolarHBondContact O-CG 3.44Å; A199-R203 PolarHBondContact O-N 3.37Å; A200-R203 WeakPolarHBondContact O-CB 3.15Å; A200-R203 PolarHBondContact O-N 2.76Å; A200-R203 VanDerWaalsContact O-N 3.16Å; T201-R203 VanDerWaalsContact C-N 3.33Å; T201-R203 PolarHBondContact O-N 3.4Å; R203-R206 WeakPolarHBondContact O-CB 3.41Å; R203-R206 PolarHBondContact O-N 2.86Å; R203-R206 VanDerWaalsContact O-N 3.16Å; R203-R207 PolarHBondContact O-N 3.4Å |
| 204 | E | 98.4 | Very high | 96.6 | Very high | 78 Ų | 78 | 103.9 Ų | 103.9 | 36% | 0.364 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -65.7 | -40.9 | 179.3 | -177.2 | 55.1 | -161.8 | 0 | 0 | 112.5 | A200 T201 R206 R207 L208 | A200-E204 PolarHBondContact O-N 3.47Å; T201-E204 PolarHBondContact O-N 3.19Å; E204-R206 VanDerWaalsContact C-N 3.28Å; E204-R206 PolarHBondContact O-N 3.22Å; E204-R207 WeakPolarHBondContact O-CB 3.49Å; E204-R207 PolarHBondContact O-N 3.34Å; E204-R207 VanDerWaalsContact O-N 3.13Å; E204-R207 IonicContact OE1-CZ 3.31Å; E204-R207 VanDerWaalsContact OE1-CZ 3.31Å; E204-R207 IonicContact OE1-NE 3.14Å; E204-R207 PolarHBondContact OE1-NE 3.01Å; E204-R207 VanDerWaalsContact OE1-NE 3.14Å; E204-R207 IonicContact OE1-NH2 2.67Å; E204-R207 PolarHBondContact OE1-NH2 2.9Å; E204-R207 IonicContact OE2-CZ 3.75Å; E204-R207 IonicContact OE2-NE 2.81Å; E204-R207 PolarHBondContact OE2-NE 3.31Å; E204-R207 IonicContact OE2-NH2 3.83Å; E204-L208 HydrophobicContact CG-CD1 4.26Å; E204-L208 PolarHBondContact O-N 3.28Å |
| 205 | R | 98.5 | Very high | 97.2 | Very high | 155 Ų | 155 | 102.2 Ų | 102.2 | 59% | 0.585 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -57.7 | -38.3 | 172 | -74.2 | 179.6 | 179.3 | -168.5 | -1.3 | 112.5 | T201 R209 | T201-R205 WeakPolarHBondContact O-CG 3.43Å; T201-R205 PolarHBondContact O-N 3.33Å; R205-R209 WeakPolarHBondContact O-CG 3.38Å; R205-R209 PolarHBondContact O-N 3.48Å; R205-R209 PolarHBondContact O-NE 2.98Å |
| 206 | R | 98.6 | Very high | 97.4 | Very high | 127 Ų | 127 | 102.5 Ų | 102.5 | 48% | 0.479 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -69 | -40.3 | 175.6 | -72.3 | 175.3 | -170.2 | 120.5 | -4.4 | 111.6 | M202 R203 E204 R209 K210 | M202-R206 WeakPolarHBondContact O-CG 3.46Å; M202-R206 PolarHBondContact O-N 3.22Å; M202-R206 VanDerWaalsContact O-N 3.14Å; R203-R206 WeakPolarHBondContact O-CB 3.41Å; R203-R206 PolarHBondContact O-N 2.86Å; R203-R206 VanDerWaalsContact O-N 3.16Å; E204-R206 VanDerWaalsContact C-N 3.28Å; E204-R206 PolarHBondContact O-N 3.22Å; R206-R209 PolarHBondContact O-N 2.92Å; R206-K210 PolarHBondContact O-N 3.34Å |
| 207 | R | 98.7 | Very high | 97.6 | Very high | 128 Ų | 128 | 97.1 Ų | 97.1 | 48% | 0.483 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61.8 | -49.2 | 176.8 | -167.5 | -167 | 71.4 | 81.6 | -0.1 | 111.5 | R203 E204 R209 K210 V211 | R203-R207 PolarHBondContact O-N 3.4Å; E204-R207 WeakPolarHBondContact O-CB 3.49Å; E204-R207 PolarHBondContact O-N 3.34Å; E204-R207 VanDerWaalsContact O-N 3.13Å; E204-R207 IonicContact OE1-CZ 3.31Å; E204-R207 VanDerWaalsContact OE1-CZ 3.31Å; E204-R207 IonicContact OE1-NE 3.14Å; E204-R207 PolarHBondContact OE1-NE 3.01Å; E204-R207 VanDerWaalsContact OE1-NE 3.14Å; E204-R207 IonicContact OE1-NH2 2.67Å; E204-R207 PolarHBondContact OE1-NH2 2.9Å; E204-R207 IonicContact OE2-CZ 3.75Å; E204-R207 IonicContact OE2-NE 2.81Å; E204-R207 PolarHBondContact OE2-NE 3.31Å; E204-R207 IonicContact OE2-NH2 3.83Å; R207-R209 VanDerWaalsContact C-N 3.3Å; R207-R209 PolarHBondContact O-N 3.42Å; R207-K210 PolarHBondContact O-N 3.4Å; R207-V211 PolarHBondContact O-N 3.46Å; R207-V211 VanDerWaalsContact O-N 3.12Å |
| 208 | L | 98.3 | Very high | 97.8 | Very high | 69 Ų | 69 | 91.2 Ų | 91.2 | 36% | 0.361 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -63.4 | -33.1 | 178.9 | -70.3 | 173.9 | 0 | 0 | 0 | 113 | E204 V211 N212 | E204-L208 HydrophobicContact CG-CD1 4.26Å; E204-L208 PolarHBondContact O-N 3.28Å; L208-V211 PolarHBondContact O-N 2.87Å; L208-N212 WeakPolarHBondContact O-CB 3.38Å; L208-N212 PolarHBondContact O-N 2.81Å |
| 209 | R | 98.4 | Very high | 98 | Very high | 130 Ų | 130 | 85.6 Ų | 85.6 | 49% | 0.491 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -59.8 | -46.7 | 172.6 | -83.6 | -178.5 | -86.5 | 146.3 | -20.3 | 112.3 | R205 R206 R207 V211 N212 E213 | R205-R209 WeakPolarHBondContact O-CG 3.38Å; R205-R209 PolarHBondContact O-N 3.48Å; R205-R209 PolarHBondContact O-NE 2.98Å; R206-R209 PolarHBondContact O-N 2.92Å; R207-R209 VanDerWaalsContact C-N 3.3Å; R207-R209 PolarHBondContact O-N 3.42Å; R209-V211 VanDerWaalsContact C-N 3.34Å; R209-V211 PolarHBondContact O-N 3.37Å; R209-N212 PolarHBondContact O-N 3.14Å; R209-E213 PolarHBondContact O-N 3.21Å |
| 210 | K | 98.4 | Very high | 98 | Very high | 155 Ų | 155 | 90.2 Ų | 90.2 | 67% | 0.674 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -62.3 | -41.2 | 176.1 | -65.6 | -175.3 | 176 | -170.2 | 0 | 112.1 | R206 R207 E213 A214 | R206-K210 PolarHBondContact O-N 3.34Å; R207-K210 PolarHBondContact O-N 3.4Å; K210-E213 PolarHBondContact O-N 2.92Å; K210-A214 PolarHBondContact O-N 3.2Å |
| 211 | V | 98.5 | Very high | 98.1 | Very high | 50 Ų | 50 | 96.7 Ų | 96.7 | 30% | 0.303 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62.6 | -45.8 | 175.9 | 174.2 | 0 | 0 | 0 | 0 | 110.6 | R207 L208 R209 E213 A214 F215 | R207-V211 PolarHBondContact O-N 3.46Å; R207-V211 VanDerWaalsContact O-N 3.12Å; L208-V211 PolarHBondContact O-N 2.87Å; R209-V211 VanDerWaalsContact C-N 3.34Å; R209-V211 PolarHBondContact O-N 3.37Å; V211-E213 VanDerWaalsContact C-N 3.34Å; V211-E213 PolarHBondContact O-N 3.12Å; V211-A214 WeakPolarHBondContact O-CB 3.42Å; V211-A214 PolarHBondContact O-N 3.47Å; V211-F215 HydrophobicContact CG1-CD2 3.93Å; V211-F215 HydrophobicContact CG1-CE2 3.94Å; V211-F215 WeakPolarHBondContact O-CD2 3.4Å; V211-F215 PolarHBondContact O-N 3.32Å |
| 212 | N | 98.2 | Very high | 98 | Very high | 70 Ų | 70 | 94.5 Ų | 94.5 | 37% | 0.374 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -64.4 | -38.3 | 178.8 | -69.8 | -11.2 | 0 | 0 | 0 | 112 | L208 R209 A214 F215 E216 K232 | L208-N212 WeakPolarHBondContact O-CB 3.38Å; L208-N212 PolarHBondContact O-N 2.81Å; R209-N212 PolarHBondContact O-N 3.14Å; N212-A214 VanDerWaalsContact C-N 3.33Å; N212-A214 PolarHBondContact O-N 2.67Å; N212-F215 WeakPolarHBondContact O-CB 3.39Å; N212-F215 PolarHBondContact O-N 3.25Å; N212-E216 WeakPolarHBondContact O-CG 3.47Å; N212-E216 PolarHBondContact O-N 2.84Å; N212-K232 WeakPolarHBondContact OD1-CE 3.49Å; N212-K232 PolarHBondContact OD1-NZ 3.39Å |
| 213 | E | 98.4 | Very high | 97.9 | Very high | 125 Ų | 125 | 92 Ų | 92 | 58% | 0.584 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -59.8 | -42.7 | 172.9 | -176.8 | 177.8 | -174.8 | 0 | 0 | 112 | R209 K210 V211 F215 E216 I217 | R209-E213 PolarHBondContact O-N 3.21Å; K210-E213 PolarHBondContact O-N 2.92Å; V211-E213 VanDerWaalsContact C-N 3.34Å; V211-E213 PolarHBondContact O-N 3.12Å; E213-F215 VanDerWaalsContact C-N 3.34Å; E213-F215 PolarHBondContact O-N 3.43Å; E213-E216 PolarHBondContact O-N 2.82Å; E213-I217 HydrophobicContact CG-CD1 4.37Å; E213-I217 WeakPolarHBondContact O-CG1 3.46Å; E213-I217 PolarHBondContact O-N 3.26Å |
| 214 | A | 98.2 | Very high | 97.5 | Very high | 55 Ų | 55 | 89 Ų | 89 | 46% | 0.455 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.8 | -38.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | K210 V211 N212 I217 L218 | K210-A214 PolarHBondContact O-N 3.2Å; V211-A214 WeakPolarHBondContact O-CB 3.42Å; V211-A214 PolarHBondContact O-N 3.47Å; N212-A214 VanDerWaalsContact C-N 3.33Å; N212-A214 PolarHBondContact O-N 2.67Å; A214-I217 PolarHBondContact O-N 3.34Å; A214-L218 WeakPolarHBondContact O-CB 3.48Å; A214-L218 PolarHBondContact O-N 3.06Å |
| 215 | F | 98.2 | Very high | 97.2 | Very high | 37 Ų | 37 | 90.2 Ų | 90.2 | 16% | 0.162 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -61.8 | -41.6 | 173 | -93.8 | -86.5 | 0 | 0 | 0 | 112.1 | V211 N212 E213 L218 K219 K232 I235 L236 | V211-F215 HydrophobicContact CG1-CD2 3.93Å; V211-F215 HydrophobicContact CG1-CE2 3.94Å; V211-F215 WeakPolarHBondContact O-CD2 3.4Å; V211-F215 PolarHBondContact O-N 3.32Å; N212-F215 WeakPolarHBondContact O-CB 3.39Å; N212-F215 PolarHBondContact O-N 3.25Å; E213-F215 VanDerWaalsContact C-N 3.34Å; E213-F215 PolarHBondContact O-N 3.43Å; F215-L218 PolarHBondContact O-N 3.22Å; F215-K219 VanDerWaalsContact O-CB 3.24Å; F215-K219 WeakPolarHBondContact O-CB 3.34Å; F215-K219 PolarHBondContact O-N 2.91Å; F215-K232 HydrophobicContact CD1-CB 4.25Å; F215-K232 HydrophobicContact CD1-CG 4.03Å; F215-K232 HydrophobicContact CD2-CD 4.43Å; F215-K232 HydrophobicContact CE1-CB 3.68Å; F215-K232 HydrophobicContact CE1-CD 4.25Å; F215-K232 HydrophobicContact CE1-CG 3.88Å; F215-K232 HydrophobicContact CE2-CD 4.16Å; F215-K232 HydrophobicContact CG-CG 4.48Å; F215-K232 HydrophobicContact CZ-CB 4.07Å; F215-K232 HydrophobicContact CZ-CD 4.06Å; F215-K232 HydrophobicContact CZ-CG 4.2Å; F215-I235 HydrophobicContact CD1-CB 4.29Å; F215-I235 HydrophobicContact CD1-CD1 4.08Å; F215-I235 HydrophobicContact CD1-CG2 4.17Å; F215-L236 HydrophobicContact CE1-CD2 4.11Å; F215-L236 HydrophobicContact CE1-CG 4.11Å; F215-L236 HydrophobicContact CZ-CD1 4.48Å; F215-L236 HydrophobicContact CZ-CD2 4.25Å; F215-L236 HydrophobicContact CZ-CG 4.42Å |
| 216 | E | 97.3 | Very high | 96.9 | Very high | 87 Ų | 87 | 85.2 Ų | 85.2 | 41% | 0.407 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -66.5 | -36.6 | 176.5 | -67.3 | -54.7 | 131.9 | 0 | 0 | 112.2 | N212 E213 R220 | N212-E216 WeakPolarHBondContact O-CG 3.47Å; N212-E216 PolarHBondContact O-N 2.84Å; E213-E216 PolarHBondContact O-N 2.82Å; E216-R220 WeakPolarHBondContact O-CG 3.1Å; E216-R220 PolarHBondContact O-N 3.13Å; E216-R220 VanDerWaalsContact O-N 3.12Å; E216-R220 PolarHBondContact O-NH1 3.16Å |
| 217 | I | 97.5 | Very high | 96.6 | Very high | 79 Ų | 79 | 86.8 Ų | 86.8 | 41% | 0.405 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63.7 | -49.5 | 172.8 | -66.1 | 163.9 | 0 | 0 | 0 | 110.4 | E213 A214 K219 R220 R221 | E213-I217 HydrophobicContact CG-CD1 4.37Å; E213-I217 WeakPolarHBondContact O-CG1 3.46Å; E213-I217 PolarHBondContact O-N 3.26Å; A214-I217 PolarHBondContact O-N 3.34Å; I217-K219 VanDerWaalsContact C-N 3.33Å; I217-K219 PolarHBondContact O-N 3.28Å; I217-R220 PolarHBondContact O-N 3.01Å; I217-R221 WeakPolarHBondContact O-CG 3.43Å; I217-R221 PolarHBondContact O-N 3.14Å |
| 218 | L | 98.1 | Very high | 96.3 | Very high | 57 Ų | 57 | 85.8 Ų | 85.8 | 30% | 0.298 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -59.2 | -45.6 | -180 | -178.4 | 61.3 | 0 | 0 | 0 | 111.4 | A214 F215 R220 R221 T222 I235 L236 A239 | A214-L218 WeakPolarHBondContact O-CB 3.48Å; A214-L218 PolarHBondContact O-N 3.06Å; F215-L218 PolarHBondContact O-N 3.22Å; L218-R220 VanDerWaalsContact C-N 3.33Å; L218-R220 PolarHBondContact O-N 3.3Å; L218-R221 PolarHBondContact O-N 2.98Å; L218-T222 HydrophobicContact CD1-CG2 3.73Å; L218-T222 HydrophobicContact CG-CG2 4.4Å; L218-T222 PolarHBondContact O-N 3.46Å; L218-T222 PolarHBondContact O-OG1 3.09Å; L218-I235 HydrophobicContact CB-CG2 4.31Å; L218-I235 HydrophobicContact CD2-CG2 3.96Å; L218-I235 HydrophobicContact CG-CG2 3.99Å; L218-L236 HydrophobicContact CD2-CD2 4.28Å; L218-A239 HydrophobicContact CD1-CB 3.85Å; L218-A239 HydrophobicContact CD2-CB 4.06Å; L218-A239 HydrophobicContact CG-CB 4.15Å |
| 219 | K | 97.6 | Very high | 96.2 | Very high | 15 Ų | 15 | 93.8 Ų | 93.8 | 7% | 0.065 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -57.2 | -43.9 | 176.7 | -175.5 | -169.7 | 178.9 | -155.3 | 0 | 112.1 | F215 I217 R221 T222 C223 P226 Q228 I235 | F215-K219 VanDerWaalsContact O-CB 3.24Å; F215-K219 WeakPolarHBondContact O-CB 3.34Å; F215-K219 PolarHBondContact O-N 2.91Å; I217-K219 VanDerWaalsContact C-N 3.33Å; I217-K219 PolarHBondContact O-N 3.28Å; K219-R221 PolarHBondContact O-N 2.93Å; K219-T222 PolarHBondContact O-N 3.16Å; K219-C223 HydrophobicContact CG-CB 4.2Å; K219-C223 VanDerWaalsContact O-CB 3.23Å; K219-C223 WeakPolarHBondContact O-CB 3.44Å; K219-C223 PolarHBondContact O-N 3.02Å; K219-P226 WeakPolarHBondContact CE-O 3.43Å; K219-P226 PolarHBondContact NZ-O 3.42Å; K219-Q228 WeakPolarHBondContact CE-O 3.38Å; K219-Q228 PolarHBondContact NZ-O 2.8Å; K219-I235 HydrophobicContact CB-CD1 4.12Å; K219-I235 HydrophobicContact CB-CG1 4.29Å; K219-I235 HydrophobicContact CB-CG2 4.09Å; K219-I235 HydrophobicContact CD-CD1 4.14Å; K219-I235 HydrophobicContact CG-CD1 4.23Å; K219-I235 HydrophobicContact CG-CG1 4.25Å |
| 220 | R | 97.1 | Very high | 96 | Very high | 142 Ų | 142 | 89.4 Ų | 89.4 | 54% | 0.536 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.1 | -24 | 176.1 | -76.1 | -171.1 | -62.5 | -89.1 | 5.6 | 114.1 | E216 I217 L218 P226 | E216-R220 WeakPolarHBondContact O-CG 3.1Å; E216-R220 PolarHBondContact O-N 3.13Å; E216-R220 VanDerWaalsContact O-N 3.12Å; E216-R220 PolarHBondContact O-NH1 3.16Å; I217-R220 PolarHBondContact O-N 3.01Å; L218-R220 VanDerWaalsContact C-N 3.33Å; L218-R220 PolarHBondContact O-N 3.3Å; R220-P226 HydrophobicContact CG-CB 4.06Å |
| 221 | R | 96.8 | Very high | 95.9 | Very high | 183 Ų | 183 | 86 Ų | 86 | 69% | 0.691 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -93.8 | -26.9 | -177.2 | -65.3 | -65.2 | -173 | 171.7 | 1.7 | 113.7 | I217 L218 K219 | I217-R221 WeakPolarHBondContact O-CG 3.43Å; I217-R221 PolarHBondContact O-N 3.14Å; L218-R221 PolarHBondContact O-N 2.98Å; K219-R221 PolarHBondContact O-N 2.93Å |
| 222 | T | 97.1 | Very high | 95.9 | Very high | 20 Ų | 20 | 88.2 Ų | 88.2 | 12% | 0.123 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -116.2 | -27.8 | -167.3 | 55.9 | 0 | 0 | 0 | 0 | 112.9 | L218 K219 A239 Y242 | L218-T222 HydrophobicContact CD1-CG2 3.73Å; L218-T222 HydrophobicContact CG-CG2 4.4Å; L218-T222 PolarHBondContact O-N 3.46Å; L218-T222 PolarHBondContact O-OG1 3.09Å; K219-T222 PolarHBondContact O-N 3.16Å; T222-A239 HydrophobicContact CG2-CB 3.79Å; T222-Y242 HydrophobicContact CG2-CD1 4Å; T222-Y242 HydrophobicContact CG2-CG 4.32Å |
| 223 | C | 94.1 | Very high | 95.9 | Very high | 10 Ų | 10 | 88.9 Ų | 88.9 | 7% | 0.068 | 45% | 0.447 | C | S | . | . | trans | -93.2 | 133 | -177.6 | -54.5 | 0 | 0 | 0 | 0 | 110.3 | K219 N225 L230 | K219-C223 HydrophobicContact CG-CB 4.2Å; K219-C223 VanDerWaalsContact O-CB 3.23Å; K219-C223 WeakPolarHBondContact O-CB 3.44Å; K219-C223 PolarHBondContact O-N 3.02Å; C223-N225 VanDerWaalsContact C-N 3.26Å; C223-N225 PolarHBondContact O-N 3.48Å; C223-L230 HydrophobicContact CB-CD1 3.93Å; C223-L230 VanDerWaalsContact SG-CD1 3.53Å | ||
| 224 | A | 91.4 | Very high | 95.9 | Very high | 96 Ų | 96 | 86.1 Ų | 86.1 | 79% | 0.793 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -58.9 | -36.9 | 178 | 0 | 0 | 0 | 0 | 0 | 113 | P226 | A224-P226 WeakPolarHBondContact O-CD 3.38Š|
| 225 | N | 91.8 | Very high | 95.8 | Very high | 104 Ų | 104 | 83.7 Ų | 83.7 | 56% | 0.556 | 41% | 0.414 | S | S | * | . | trans | -116.7 | 86.9 | -179.9 | -67.6 | -48.9 | 0 | 0 | 0 | 110.9 | C223 N227 Q228 | C223-N225 VanDerWaalsContact C-N 3.26Å; C223-N225 PolarHBondContact O-N 3.48Å; N225-N227 PolarHBondContact O-N 3.12Å; N225-N227 VanDerWaalsContact O-N 3.11Å; N225-Q228 HydrophobicContact CB-CB 4.27Å; N225-Q228 WeakPolarHBondContact O-CB 3.45Å; N225-Q228 PolarHBondContact O-N 2.84Å; N225-Q228 VanDerWaalsContact O-N 3.09Å | ||
| 226 | P | 91.2 | Very high | 95.9 | Very high | 50 Ų | 50 | 85.9 Ų | 85.9 | 33% | 0.325 | 43% | 0.426 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -19.4 | -176.4 | 25.9 | -35.6 | 0 | 0 | 0 | 114 | K219 R220 A224 Q228 | K219-P226 WeakPolarHBondContact CE-O 3.43Å; K219-P226 PolarHBondContact NZ-O 3.42Å; R220-P226 HydrophobicContact CG-CB 4.06Å; A224-P226 WeakPolarHBondContact O-CD 3.38Å; P226-Q228 VanDerWaalsContact C-N 3.34Å |
| 227 | N | 92.7 | Very high | 95.9 | Very high | 161 Ų | 161 | 88.4 Ų | 88.4 | 86% | 0.861 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78 | -18 | 177.8 | -63.4 | -34.7 | 0 | 0 | 0 | 113 | N225 | N225-N227 PolarHBondContact O-N 3.12Å; N225-N227 VanDerWaalsContact O-N 3.11Å |
| 228 | Q | 93.7 | Very high | 95.9 | Very high | 106 Ų | 106 | 86.4 Ų | 86.4 | 50% | 0.495 | 42% | 0.422 | S | S | . | . | S | Bend | trans | -69.9 | 134.1 | 178.6 | -175.6 | 178.3 | -1.5 | 0 | 0 | 110.4 | K219 N225 P226 L230 | K219-Q228 WeakPolarHBondContact CE-O 3.38Å; K219-Q228 PolarHBondContact NZ-O 2.8Å; N225-Q228 HydrophobicContact CB-CB 4.27Å; N225-Q228 WeakPolarHBondContact O-CB 3.45Å; N225-Q228 PolarHBondContact O-N 2.84Å; N225-Q228 VanDerWaalsContact O-N 3.09Å; P226-Q228 VanDerWaalsContact C-N 3.34Å; Q228-L230 HydrophobicContact CB-CG 4.46Å; Q228-L230 HydrophobicContact CG-CD2 4.01Å; Q228-L230 HydrophobicContact CG-CG 4.26Å; Q228-L230 PolarHBondContact O-N 3.3Å |
| 229 | R | 95.2 | Very high | 95.9 | Very high | 237 Ų | 237 | 84.1 Ų | 84.1 | 89% | 0.894 | 41% | 0.412 | S | S | * | . | trans | -70.7 | 116.9 | 170.6 | -69.2 | 176.7 | 65.9 | -158.1 | -0 | 108.7 | ||||
| 230 | L | 94.5 | Very high | 95.9 | Very high | 39 Ų | 39 | 88 Ų | 88 | 20% | 0.204 | 43% | 0.432 | C | S | . | . | trans | -118.8 | 139.3 | -179.9 | -67.5 | 173.5 | 0 | 0 | 0 | 110.1 | C223 Q228 E234 I235 | C223-L230 HydrophobicContact CB-CD1 3.93Å; C223-L230 VanDerWaalsContact SG-CD1 3.53Å; Q228-L230 HydrophobicContact CB-CG 4.46Å; Q228-L230 HydrophobicContact CG-CD2 4.01Å; Q228-L230 HydrophobicContact CG-CG 4.26Å; Q228-L230 PolarHBondContact O-N 3.3Å; L230-E234 HydrophobicContact CD2-CG 4.21Å; L230-I235 HydrophobicContact CB-CD1 4.41Å; L230-I235 HydrophobicContact CB-CG1 3.91Å | ||
| 231 | P | 97.1 | Very high | 96 | Very high | 82 Ų | 82 | 86.4 Ų | 86.4 | 53% | 0.532 | 43% | 0.431 | S | S | . | . | trans | -67.8 | 153.1 | 172.8 | 26.9 | -29.9 | 0 | 0 | 0 | 110.7 | V233 E234 I235 | P231-V233 VanDerWaalsContact C-N 3.27Å; P231-V233 HydrophobicContact CB-CG1 4.45Å; P231-V233 PolarHBondContact O-N 2.97Å; P231-E234 HydrophobicContact CG-CB 3.71Å; P231-E234 WeakPolarHBondContact O-CB 3.38Å; P231-E234 PolarHBondContact O-N 3.5Å; P231-I235 PolarHBondContact O-N 2.94Å | ||
| 232 | K | 97.7 | Very high | 96 | Very high | 98 Ų | 98 | 82.6 Ų | 82.6 | 43% | 0.426 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -56.4 | -39.6 | -175.8 | -72.5 | -172.1 | 174 | -173 | 0 | 113.3 | N212 F215 E234 I235 L236 | N212-K232 WeakPolarHBondContact OD1-CE 3.49Å; N212-K232 PolarHBondContact OD1-NZ 3.39Å; F215-K232 HydrophobicContact CD1-CB 4.25Å; F215-K232 HydrophobicContact CD1-CG 4.03Å; F215-K232 HydrophobicContact CD2-CD 4.43Å; F215-K232 HydrophobicContact CE1-CB 3.68Å; F215-K232 HydrophobicContact CE1-CD 4.25Å; F215-K232 HydrophobicContact CE1-CG 3.88Å; F215-K232 HydrophobicContact CE2-CD 4.16Å; F215-K232 HydrophobicContact CG-CG 4.48Å; F215-K232 HydrophobicContact CZ-CB 4.07Å; F215-K232 HydrophobicContact CZ-CD 4.06Å; F215-K232 HydrophobicContact CZ-CG 4.2Å; K232-E234 VanDerWaalsContact C-N 3.26Å; K232-E234 PolarHBondContact O-N 2.79Å; K232-I235 PolarHBondContact O-N 2.83Å; K232-L236 WeakPolarHBondContact O-CG 3.26Å; K232-L236 PolarHBondContact O-N 3.02Å |
| 233 | V | 98.2 | Very high | 96.1 | Very high | 84 Ų | 84 | 86 Ų | 86 | 51% | 0.509 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.7 | -35.1 | 178.4 | 66.7 | 0 | 0 | 0 | 0 | 112 | P231 L236 R237 | P231-V233 VanDerWaalsContact C-N 3.27Å; P231-V233 HydrophobicContact CB-CG1 4.45Å; P231-V233 PolarHBondContact O-N 2.97Å; V233-L236 WeakPolarHBondContact O-CB 3.34Å; V233-L236 PolarHBondContact O-N 2.88Å; V233-R237 WeakPolarHBondContact O-CG 3.3Å; V233-R237 PolarHBondContact O-N 3.46Å; V233-R237 VanDerWaalsContact O-N 3.11Å |
| 234 | E | 97.7 | Very high | 96.2 | Very high | 67 Ų | 67 | 91 Ų | 91 | 31% | 0.313 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -74.4 | -39.3 | -178.8 | -171.6 | 56.6 | -151.2 | 0 | 0 | 111.6 | L230 P231 K232 L236 R237 N238 | L230-E234 HydrophobicContact CD2-CG 4.21Å; P231-E234 HydrophobicContact CG-CB 3.71Å; P231-E234 WeakPolarHBondContact O-CB 3.38Å; P231-E234 PolarHBondContact O-N 3.5Å; K232-E234 VanDerWaalsContact C-N 3.26Å; K232-E234 PolarHBondContact O-N 2.79Å; E234-L236 PolarHBondContact O-N 3.49Å; E234-R237 PolarHBondContact O-N 3.07Å; E234-R237 VanDerWaalsContact O-N 3.13Å; E234-N238 PolarHBondContact O-N 3.41Å; E234-N238 PolarHBondContact O-ND2 3.04Å; E234-N238 PolarHBondContact OE1-ND2 2.89Å |
| 235 | I | 97.8 | Very high | 96.5 | Very high | 4 Ų | 4 | 89 Ų | 89 | 2% | 0.021 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -57.4 | -38 | 172.2 | -61.6 | 168.2 | 0 | 0 | 0 | 110.6 | F215 L218 K219 L230 P231 K232 A239 | F215-I235 HydrophobicContact CD1-CB 4.29Å; F215-I235 HydrophobicContact CD1-CD1 4.08Å; F215-I235 HydrophobicContact CD1-CG2 4.17Å; L218-I235 HydrophobicContact CB-CG2 4.31Å; L218-I235 HydrophobicContact CD2-CG2 3.96Å; L218-I235 HydrophobicContact CG-CG2 3.99Å; K219-I235 HydrophobicContact CB-CD1 4.12Å; K219-I235 HydrophobicContact CB-CG1 4.29Å; K219-I235 HydrophobicContact CB-CG2 4.09Å; K219-I235 HydrophobicContact CD-CD1 4.14Å; K219-I235 HydrophobicContact CG-CD1 4.23Å; K219-I235 HydrophobicContact CG-CG1 4.25Å; L230-I235 HydrophobicContact CB-CD1 4.41Å; L230-I235 HydrophobicContact CB-CG1 3.91Å; P231-I235 PolarHBondContact O-N 2.94Å; K232-I235 PolarHBondContact O-N 2.83Å; I235-A239 WeakPolarHBondContact O-CB 3.22Å; I235-A239 PolarHBondContact O-N 3.4Å; I235-A239 VanDerWaalsContact O-N 3.09Å |
| 236 | L | 98.5 | Very high | 96.7 | Very high | 82 Ų | 82 | 87 Ų | 87 | 43% | 0.429 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -68.9 | -40.5 | 176.9 | -63.6 | 173 | 0 | 0 | 0 | 112.3 | F215 L218 K232 V233 E234 A239 I240 | F215-L236 HydrophobicContact CE1-CD2 4.11Å; F215-L236 HydrophobicContact CE1-CG 4.11Å; F215-L236 HydrophobicContact CZ-CD1 4.48Å; F215-L236 HydrophobicContact CZ-CD2 4.25Å; F215-L236 HydrophobicContact CZ-CG 4.42Å; L218-L236 HydrophobicContact CD2-CD2 4.28Å; K232-L236 WeakPolarHBondContact O-CG 3.26Å; K232-L236 PolarHBondContact O-N 3.02Å; V233-L236 WeakPolarHBondContact O-CB 3.34Å; V233-L236 PolarHBondContact O-N 2.88Å; E234-L236 PolarHBondContact O-N 3.49Å; L236-A239 PolarHBondContact O-N 2.88Å; L236-I240 WeakPolarHBondContact O-CG1 3.39Å; L236-I240 PolarHBondContact O-N 3.24Å; L236-I240 VanDerWaalsContact O-N 3.11Å |
| 237 | R | 98 | Very high | 96.9 | Very high | 141 Ų | 141 | 89.4 Ų | 89.4 | 53% | 0.532 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -61.8 | -50.4 | 175.8 | -69.3 | -179 | -172.2 | -74.7 | -0.1 | 111.6 | V233 E234 A239 I240 E241 | V233-R237 WeakPolarHBondContact O-CG 3.3Å; V233-R237 PolarHBondContact O-N 3.46Å; V233-R237 VanDerWaalsContact O-N 3.11Å; E234-R237 PolarHBondContact O-N 3.07Å; E234-R237 VanDerWaalsContact O-N 3.13Å; R237-A239 PolarHBondContact O-N 3.31Å; R237-I240 PolarHBondContact O-N 2.9Å; R237-I240 VanDerWaalsContact O-N 3.07Å; R237-E241 PolarHBondContact O-N 3.38Å |
| 238 | N | 97.7 | Very high | 97 | Very high | 37 Ų | 37 | 89 Ų | 89 | 20% | 0.198 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -57.4 | -36.2 | 176.1 | -74.8 | -82.7 | 0 | 0 | 0 | 112.2 | E234 Y242 | E234-N238 PolarHBondContact O-N 3.41Å; E234-N238 PolarHBondContact O-ND2 3.04Å; E234-N238 PolarHBondContact OE1-ND2 2.89Å; N238-Y242 VanDerWaalsContact O-CB 3.23Å; N238-Y242 WeakPolarHBondContact O-CB 3.43Å; N238-Y242 PolarHBondContact O-N 3.08Å |
| 239 | A | 98.5 | Very high | 97.1 | Very high | 9 Ų | 9 | 90 Ų | 90 | 7% | 0.074 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -67 | -40.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | L218 T222 I235 L236 R237 I243 | L218-A239 HydrophobicContact CD1-CB 3.85Å; L218-A239 HydrophobicContact CD2-CB 4.06Å; L218-A239 HydrophobicContact CG-CB 4.15Å; T222-A239 HydrophobicContact CG2-CB 3.79Å; I235-A239 WeakPolarHBondContact O-CB 3.22Å; I235-A239 PolarHBondContact O-N 3.4Å; I235-A239 VanDerWaalsContact O-N 3.09Å; L236-A239 PolarHBondContact O-N 2.88Å; R237-A239 PolarHBondContact O-N 3.31Å; A239-I243 WeakPolarHBondContact O-CD1 3.37Å; A239-I243 VanDerWaalsContact O-CG1 3.27Å; A239-I243 WeakPolarHBondContact O-CG1 3.32Å; A239-I243 PolarHBondContact O-N 3.13Å; A239-I243 VanDerWaalsContact O-N 3.07Å |
| 240 | I | 98.2 | Very high | 97 | Very high | 95 Ų | 95 | 85.1 Ų | 85.1 | 49% | 0.487 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -63.7 | -51.6 | 176.2 | -66.4 | 163 | 0 | 0 | 0 | 109.4 | L236 R237 Y242 I243 E244 | L236-I240 WeakPolarHBondContact O-CG1 3.39Å; L236-I240 PolarHBondContact O-N 3.24Å; L236-I240 VanDerWaalsContact O-N 3.11Å; R237-I240 PolarHBondContact O-N 2.9Å; R237-I240 VanDerWaalsContact O-N 3.07Å; I240-Y242 VanDerWaalsContact C-N 3.28Å; I240-Y242 PolarHBondContact O-N 3.49Å; I240-I243 PolarHBondContact O-N 3.04Å; I240-I243 VanDerWaalsContact O-N 3.13Å; I240-E244 HydrophobicContact CG2-CG 4.39Å; I240-E244 WeakPolarHBondContact O-CG 3.13Å; I240-E244 PolarHBondContact O-N 2.89Å |
| 241 | E | 97.8 | Very high | 96.9 | Very high | 109 Ų | 109 | 89.2 Ų | 89.2 | 51% | 0.509 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -58.1 | -40.7 | 178.6 | -68.9 | 169.5 | -159.9 | 0 | 0 | 112 | R237 E244 S245 | R237-E241 PolarHBondContact O-N 3.38Å; E241-E244 PolarHBondContact O-N 3.44Å; E241-S245 WeakPolarHBondContact O-CB 3.15Å; E241-S245 PolarHBondContact O-N 3.45Å; E241-S245 PolarHBondContact O-OG 3.22Å |
| 242 | Y | 98.2 | Very high | 96 | Very high | 104 Ų | 104 | 87.1 Ų | 87.1 | 41% | 0.408 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -63.1 | -45.4 | 176.9 | -176.3 | -110.6 | 0 | 0 | 0 | 111.9 | T222 N238 I240 S245 L246 | T222-Y242 HydrophobicContact CG2-CD1 4Å; T222-Y242 HydrophobicContact CG2-CG 4.32Å; N238-Y242 VanDerWaalsContact O-CB 3.23Å; N238-Y242 WeakPolarHBondContact O-CB 3.43Å; N238-Y242 PolarHBondContact O-N 3.08Å; I240-Y242 VanDerWaalsContact C-N 3.28Å; I240-Y242 PolarHBondContact O-N 3.49Å; Y242-S245 PolarHBondContact O-N 3.21Å; Y242-S245 PolarHBondContact O-OG 3.3Å; Y242-L246 HydrophobicContact CD1-CD1 3.89Å; Y242-L246 HydrophobicContact CE1-CD1 3.38Å; Y242-L246 HydrophobicContact CE1-CG 4.26Å; Y242-L246 HydrophobicContact CE2-CD1 4.28Å; Y242-L246 HydrophobicContact CE2-CD2 4.48Å; Y242-L246 HydrophobicContact CE2-CG 4.34Å; Y242-L246 WeakPolarHBondContact O-CG 3.17Å; Y242-L246 PolarHBondContact O-N 2.76Å; Y242-L246 VanDerWaalsContact O-N 3.1Å |
| 243 | I | 97.7 | Very high | 94.4 | Very high | 91 Ų | 91 | 85.6 Ų | 85.6 | 47% | 0.467 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.8 | -48.4 | 176.7 | -68.3 | 164.6 | 0 | 0 | 0 | 110.4 | A239 I240 S245 L246 E247 | A239-I243 WeakPolarHBondContact O-CD1 3.37Å; A239-I243 VanDerWaalsContact O-CG1 3.27Å; A239-I243 WeakPolarHBondContact O-CG1 3.32Å; A239-I243 PolarHBondContact O-N 3.13Å; A239-I243 VanDerWaalsContact O-N 3.07Å; I240-I243 PolarHBondContact O-N 3.04Å; I240-I243 VanDerWaalsContact O-N 3.13Å; I243-S245 VanDerWaalsContact C-N 3.33Å; I243-S245 PolarHBondContact O-N 3.45Å; I243-L246 PolarHBondContact O-N 2.84Å; I243-E247 HydrophobicContact CG2-CG 4.31Å; I243-E247 WeakPolarHBondContact O-CG 3.38Å; I243-E247 PolarHBondContact O-N 2.77Å |
| 244 | E | 97.7 | Very high | 92.5 | Very high | 114 Ų | 114 | 82.9 Ų | 82.9 | 53% | 0.533 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -58.6 | -43 | 179.3 | -70.3 | 174.6 | 167.9 | 0 | 0 | 111.7 | I240 E241 L246 E247 E248 | I240-E244 HydrophobicContact CG2-CG 4.39Å; I240-E244 WeakPolarHBondContact O-CG 3.13Å; I240-E244 PolarHBondContact O-N 2.89Å; E241-E244 PolarHBondContact O-N 3.44Å; E244-L246 PolarHBondContact O-N 2.7Å; E244-E247 PolarHBondContact O-N 3.42Å; E244-E248 PolarHBondContact O-N 2.8Å |
| 245 | S | 96.4 | Very high | 90.6 | Very high | 56 Ų | 56 | 87.2 Ų | 87.2 | 39% | 0.392 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -65 | -37.5 | 177.8 | 75 | 0 | 0 | 0 | 0 | 113.3 | E241 Y242 I243 M249 | E241-S245 WeakPolarHBondContact O-CB 3.15Å; E241-S245 PolarHBondContact O-N 3.45Å; E241-S245 PolarHBondContact O-OG 3.22Å; Y242-S245 PolarHBondContact O-N 3.21Å; Y242-S245 PolarHBondContact O-OG 3.3Å; I243-S245 VanDerWaalsContact C-N 3.33Å; I243-S245 PolarHBondContact O-N 3.45Å; S245-M249 PolarHBondContact O-N 3.22Å; S245-M249 VanDerWaalsContact O-N 3.1Å |
| 246 | L | 96.8 | Very high | 88.7 | Confident | 61 Ų | 61 | 93.7 Ų | 93.7 | 32% | 0.319 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -70.1 | -41.4 | 176.4 | -71.8 | 179.3 | 0 | 0 | 0 | 111.1 | Y242 I243 E244 E248 M249 M250 | Y242-L246 HydrophobicContact CD1-CD1 3.89Å; Y242-L246 HydrophobicContact CE1-CD1 3.38Å; Y242-L246 HydrophobicContact CE1-CG 4.26Å; Y242-L246 HydrophobicContact CE2-CD1 4.28Å; Y242-L246 HydrophobicContact CE2-CD2 4.48Å; Y242-L246 HydrophobicContact CE2-CG 4.34Å; Y242-L246 WeakPolarHBondContact O-CG 3.17Å; Y242-L246 PolarHBondContact O-N 2.76Å; Y242-L246 VanDerWaalsContact O-N 3.1Å; I243-L246 PolarHBondContact O-N 2.84Å; E244-L246 PolarHBondContact O-N 2.7Å; L246-E248 VanDerWaalsContact C-N 3.35Å; L246-M249 PolarHBondContact O-N 3.46Å; L246-M250 WeakPolarHBondContact O-CB 3.4Å; L246-M250 VanDerWaalsContact O-CG 3.28Å; L246-M250 WeakPolarHBondContact O-CG 3.32Å; L246-M250 PolarHBondContact O-N 3.06Å |
| 247 | E | 95.6 | Very high | 86.7 | Confident | 100 Ų | 100 | 94.3 Ų | 94.3 | 47% | 0.467 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.1 | -42.9 | 174.9 | -72.7 | 178.6 | 170.3 | 0 | 0 | 111.3 | I243 E244 M250 H251 | I243-E247 HydrophobicContact CG2-CG 4.31Å; I243-E247 WeakPolarHBondContact O-CG 3.38Å; I243-E247 PolarHBondContact O-N 2.77Å; E244-E247 PolarHBondContact O-N 3.42Å; E247-M250 PolarHBondContact O-N 3.44Å; E247-H251 WeakPolarHBondContact O-CB 3.19Å; E247-H251 PolarHBondContact O-N 3.39Å; E247-H251 PolarHBondContact O-ND1 3.35Å |
| 248 | E | 95.1 | Very high | 84.6 | Confident | 153 Ų | 153 | 95.3 Ų | 95.3 | 72% | 0.715 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.3 | -44.8 | 175.3 | -173.7 | 176.2 | -169.2 | 0 | 0 | 111.7 | E244 L246 H251 G252 | E244-E248 PolarHBondContact O-N 2.8Å; L246-E248 VanDerWaalsContact C-N 3.35Å; E248-H251 PolarHBondContact O-N 2.84Å; E248-G252 PolarHBondContact O-N 3.35Å |
| 249 | M | 95 | Very high | 82.5 | Confident | 126 Ų | 126 | 97.3 Ų | 97.3 | 62% | 0.621 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.3 | -41.4 | 178.2 | -170.7 | -177.4 | -57.1 | 0 | 0 | 112.3 | S245 L246 S253 | S245-M249 PolarHBondContact O-N 3.22Å; S245-M249 VanDerWaalsContact O-N 3.1Å; L246-M249 PolarHBondContact O-N 3.46Å; M249-S253 VanDerWaalsContact O-CB 3.31Å; M249-S253 WeakPolarHBondContact O-CB 3.49Å; M249-S253 PolarHBondContact O-N 2.98Å; M249-S253 PolarHBondContact O-OG 2.79Å |
| 250 | M | 93.8 | Very high | 80.3 | Confident | 135 Ų | 135 | 102.2 Ų | 102.2 | 67% | 0.665 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -66.8 | -44.3 | 177.2 | -74.8 | 179.1 | 56.3 | 0 | 0 | 111.8 | L246 E247 G254 | L246-M250 WeakPolarHBondContact O-CB 3.4Å; L246-M250 VanDerWaalsContact O-CG 3.28Å; L246-M250 WeakPolarHBondContact O-CG 3.32Å; L246-M250 PolarHBondContact O-N 3.06Å; E247-M250 PolarHBondContact O-N 3.44Å; M250-G254 PolarHBondContact O-N 2.7Å |
| 251 | H | 90.8 | Very high | 78.1 | Confident | 125 Ų | 125 | 101.6 Ų | 101.6 | 58% | 0.579 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -75 | -31.1 | 179.2 | -64.1 | 136.4 | 0 | 0 | 0 | 113.1 | E247 E248 K255 | E247-H251 WeakPolarHBondContact O-CB 3.19Å; E247-H251 PolarHBondContact O-N 3.39Å; E247-H251 PolarHBondContact O-ND1 3.35Å; E248-H251 PolarHBondContact O-N 2.84Å; H251-K255 PolarHBondContact O-N 3.13Å |
| 252 | G | 79.1 | Confident | 76 | Confident | 39 Ų | 39 | 102.4 Ų | 102.4 | 40% | 0.402 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -66.4 | -42.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | E248 K255 | E248-G252 PolarHBondContact O-N 3.35Å; G252-K255 PolarHBondContact O-N 3.42Å |
| 253 | S | 65.1 | Low | 73.2 | Confident | 65 Ų | 65 | 101.2 Ų | 101.2 | 46% | 0.455 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -70.9 | -31.7 | 176.5 | -56.9 | 0 | 0 | 0 | 0 | 112.5 | M249 K255 L256 T257 | M249-S253 VanDerWaalsContact O-CB 3.31Å; M249-S253 WeakPolarHBondContact O-CB 3.49Å; M249-S253 PolarHBondContact O-N 2.98Å; M249-S253 PolarHBondContact O-OG 2.79Å; S253-K255 VanDerWaalsContact C-N 3.26Å; S253-K255 PolarHBondContact O-N 3.23Å; S253-L256 PolarHBondContact O-N 2.91Å; S253-T257 PolarHBondContact O-N 3.03Å; S253-T257 VanDerWaalsContact O-N 3.15Å; S253-T257 PolarHBondContact O-OG1 3.18Å |
| 254 | G | 58 | Low | 70.4 | Confident | 28 Ų | 28 | 100.5 Ų | 100.5 | 29% | 0.289 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -65.1 | -24.3 | 175 | 0 | 0 | 0 | 0 | 0 | 114.5 | M250 K258 | M250-G254 PolarHBondContact O-N 2.7Å; G254-K258 WeakPolarHBondContact O-CB 3.18Å; G254-K258 PolarHBondContact O-N 3.3Å |
| 255 | K | 57.8 | Low | 67.9 | Low | 158 Ų | 158 | 100 Ų | 100 | 69% | 0.687 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -74.6 | -33.2 | 174.6 | -65.6 | 173.6 | -170.9 | -179.3 | 0 | 111.8 | H251 G252 S253 A259 | H251-K255 PolarHBondContact O-N 3.13Å; G252-K255 PolarHBondContact O-N 3.42Å; S253-K255 VanDerWaalsContact C-N 3.26Å; S253-K255 PolarHBondContact O-N 3.23Å; K255-A259 WeakPolarHBondContact O-CB 3.43Å; K255-A259 PolarHBondContact O-N 2.74Å |
| 256 | L | 56.9 | Low | 65.9 | Low | 139 Ų | 139 | 105.6 Ų | 105.6 | 73% | 0.728 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -77.6 | -31.5 | 177 | -67.9 | 171.2 | 0 | 0 | 0 | 112.3 | S253 | S253-L256 PolarHBondContact O-N 2.91Å |
| 257 | T | 56.7 | Low | 63.3 | Low | 96 Ų | 96 | 108.1 Ų | 108.1 | 59% | 0.589 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -87.5 | -30.2 | 179.8 | 57.8 | 0 | 0 | 0 | 0 | 113.5 | S253 | S253-T257 PolarHBondContact O-N 3.03Å; S253-T257 VanDerWaalsContact O-N 3.15Å; S253-T257 PolarHBondContact O-OG1 3.18Å |
| 258 | K | 55 | Low | 61 | Low | 162 Ų | 162 | 107.9 Ų | 107.9 | 70% | 0.704 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -81.3 | -23.8 | 177.9 | -163.6 | 164.6 | -177.7 | 168.8 | 0 | 113.7 | G254 S260 | G254-K258 WeakPolarHBondContact O-CB 3.18Å; G254-K258 PolarHBondContact O-N 3.3Å; K258-S260 VanDerWaalsContact C-N 3.28Å |
| 259 | A | 53.1 | Low | 58.8 | Low | 79 Ų | 79 | 105.8 Ų | 105.8 | 65% | 0.653 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.4 | -18.9 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | K255 | K255-A259 WeakPolarHBondContact O-CB 3.43Å; K255-A259 PolarHBondContact O-N 2.74Å |
| 260 | S | 51.5 | Low | 56.6 | Low | 112 Ų | 112 | 106 Ų | 106 | 78% | 0.783 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.9 | -6.2 | 175.8 | -87.8 | 0 | 0 | 0 | 0 | 114.9 | K258 | K258-S260 VanDerWaalsContact C-N 3.28Š|
| 261 | A | 52.8 | Low | 54.4 | Low | 81 Ų | 81 | 107.4 Ų | 107.4 | 67% | 0.669 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.8 | -6.9 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 262 | V | 52.5 | Low | 52 | Low | 126 Ų | 126 | 105.7 Ų | 105.7 | 76% | 0.764 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -137.6 | 81 | 179.6 | -178.9 | 0 | 0 | 0 | 0 | 109.4 | ||
| 263 | G | 40.3 | Very low | 50.5 | Low | 79 Ų | 79 | 109.9 Ų | 109.9 | 81% | 0.814 | 72% | 0.72 | S | S | * | * | trans | 151.1 | 91.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 264 | G | 39.2 | Very low | 49.6 | Very low | 76 Ų | 76 | 115.5 Ų | 115.5 | 78% | 0.784 | 74% | 0.739 | S | S | * | * | trans | 164.8 | 50.6 | 174 | 0 | 0 | 0 | 0 | 0 | 116.3 | Q266 | G264-Q266 VanDerWaalsContact C-N 3.35Å; G264-Q266 PolarHBondContact O-N 3.06Å | ||
| 265 | A | 44.2 | Very low | 48.9 | Very low | 104 Ų | 104 | 121.7 Ų | 121.7 | 86% | 0.86 | 77% | 0.766 | S | S | * | * | trans | -80.4 | 82.7 | 160.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 266 | Q | 53.8 | Low | 48.1 | Very low | 173 Ų | 173 | 123 Ų | 123 | 81% | 0.808 | 77% | 0.774 | S | S | * | * | trans | -155.4 | 126.4 | 163.3 | -86.5 | -69.6 | -5.2 | 0 | 0 | 108.5 | G264 | G264-Q266 VanDerWaalsContact C-N 3.35Å; G264-Q266 PolarHBondContact O-N 3.06Å | ||
| 267 | P | 42.8 | Very low | 47.5 | Very low | 115 Ų | 115 | 119.7 Ų | 119.7 | 75% | 0.747 | 77% | 0.774 | S | S | * | * | trans | -97.6 | 143.5 | -175.3 | 35.4 | -29.9 | 0 | 0 | 0 | 114.3 | ||||
| 268 | A | 47.6 | Very low | 46.7 | Very low | 94 Ų | 94 | 121.1 Ų | 121.1 | 78% | 0.777 | 79% | 0.788 | S | S | * | * | trans | 82.8 | 164.4 | 143.5 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 269 | P | 48.7 | Very low | 46.5 | Very low | 110 Ų | 110 | 118 Ų | 118 | 71% | 0.714 | 79% | 0.793 | S | S | * | * | -134.5 | -170.7 | -78.4 | 36.3 | -17.4 | 0 | 0 | 0 | 112.7 | |||||
| 270 | V | 49.6 | Very low | 45.9 | Very low | 130 Ų | 130 | 121.9 Ų | 121.9 | 79% | 0.788 | 80% | 0.797 | S | S | * | * | trans | 96.5 | 102 | 164.6 | -40.7 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 271 | N | 46.4 | Very low | 45.7 | Very low | 164 Ų | 164 | 125.4 Ų | 125.4 | 88% | 0.877 | 80% | 0.798 | S | S | * | * | -172 | 139.1 | 99.8 | -127.9 | -22.6 | 0 | 0 | 0 | 111.9 | |||||
| 272 | A | 40.5 | Very low | 45.7 | Very low | 89 Ų | 89 | 127.6 Ų | 127.6 | 74% | 0.736 | 80% | 0.797 | S | S | * | * | trans | -79.7 | 139.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 273 | S | 48.7 | Very low | 45.4 | Very low | 128 Ų | 128 | 125.7 Ų | 125.7 | 90% | 0.895 | 79% | 0.794 | S | S | * | * | trans | -158.4 | 129.4 | 138.1 | -144.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 274 | Q | 45.5 | Very low | 45.9 | Very low | 183 Ų | 183 | 127.4 Ų | 127.4 | 86% | 0.855 | 79% | 0.788 | S | S | * | * | trans | -78.3 | 136.2 | -171.8 | -62.5 | 159.1 | -17.5 | 0 | 0 | 110.1 | ||||
| 275 | N | 43.2 | Very low | 46.2 | Very low | 158 Ų | 158 | 131.3 Ų | 131.3 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | trans | -153.5 | 103.2 | 144.9 | -166.7 | 6 | 0 | 0 | 0 | 109.8 | ||||
| 276 | E | 41.8 | Very low | 46 | Very low | 184 Ų | 184 | 130.1 Ų | 130.1 | 86% | 0.86 | 79% | 0.789 | S | S | * | * | trans | -72.8 | 118.7 | 174.1 | -63.1 | -83.5 | 142.2 | 0 | 0 | 109 | ||||
| 277 | G | 43.6 | Very low | 45.1 | Very low | 71 Ų | 71 | 125.6 Ų | 125.6 | 73% | 0.732 | 79% | 0.789 | S | S | * | * | trans | -142.5 | 79.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | A279 | G277-A279 PolarHBondContact O-N 2.95Å; G277-A279 VanDerWaalsContact O-N 3.13Å | ||
| 278 | S | 40.6 | Very low | 44.7 | Very low | 125 Ų | 125 | 125.8 Ų | 125.8 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | trans | -57.7 | 104.7 | 177.1 | 53.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 279 | A | 49.4 | Very low | 44.5 | Very low | 98 Ų | 98 | 129.8 Ų | 129.8 | 81% | 0.81 | 79% | 0.793 | S | S | * | * | trans | -104.6 | 95.3 | 166.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | G277 F281 | G277-A279 PolarHBondContact O-N 2.95Å; G277-A279 VanDerWaalsContact O-N 3.13Å; A279-F281 PolarHBondContact O-N 3.4Å; A279-F281 VanDerWaalsContact O-N 3.17Å | ||
| 280 | E | 41.2 | Very low | 44.1 | Very low | 159 Ų | 159 | 135.4 Ų | 135.4 | 74% | 0.743 | 80% | 0.802 | S | S | * | * | trans | -58.6 | 100.3 | 170.7 | -174.4 | 177.3 | 156.8 | 0 | 0 | 110.5 | M282 | E280-M282 HydrophobicContact CG-CG 4.41Å; E280-M282 PolarHBondContact O-N 3.12Å; E280-M282 WeakPolarHBondContact OE1-CE 3.43Å | ||
| 281 | F | 46.7 | Very low | 43.7 | Very low | 186 Ų | 186 | 138.1 Ų | 138.1 | 82% | 0.816 | 81% | 0.806 | S | S | * | * | trans | -78.5 | 97.6 | 169 | 173 | -100.8 | 0 | 0 | 0 | 108.8 | A279 A283 | A279-F281 PolarHBondContact O-N 3.4Å; A279-F281 VanDerWaalsContact O-N 3.17Å; F281-A283 HydrophobicContact CE1-CB 4.1Å; F281-A283 PolarHBondContact O-N 3.34Å; F281-A283 VanDerWaalsContact O-N 3.1Å | ||
| 282 | M | 53.2 | Low | 43.1 | Very low | 128 Ų | 128 | 136 Ų | 136 | 63% | 0.631 | 80% | 0.804 | S | S | * | * | trans | -67.8 | 102.4 | 169.6 | -70 | -167.2 | -180 | 0 | 0 | 110 | E280 V284 | E280-M282 HydrophobicContact CG-CG 4.41Å; E280-M282 PolarHBondContact O-N 3.12Å; E280-M282 WeakPolarHBondContact OE1-CE 3.43Å; M282-V284 VanDerWaalsContact C-N 3.33Å; M282-V284 PolarHBondContact O-N 3.44Å | ||
| 283 | A | 47.3 | Very low | 43.1 | Very low | 86 Ų | 86 | 137.1 Ų | 137.1 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | trans | -69.7 | 88.5 | 163.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | F281 | F281-A283 HydrophobicContact CE1-CB 4.1Å; F281-A283 PolarHBondContact O-N 3.34Å; F281-A283 VanDerWaalsContact O-N 3.1Å | ||
| 284 | V | 49.4 | Very low | 42.7 | Very low | 115 Ų | 115 | 140 Ų | 140 | 70% | 0.697 | 81% | 0.806 | S | S | * | * | trans | -97.4 | 126 | 170.2 | -96.6 | 0 | 0 | 0 | 0 | 110.1 | M282 | M282-V284 VanDerWaalsContact C-N 3.33Å; M282-V284 PolarHBondContact O-N 3.44Å | ||
| 285 | N | 46.6 | Very low | 42.5 | Very low | 157 Ų | 157 | 140.1 Ų | 140.1 | 84% | 0.84 | 81% | 0.807 | S | S | * | * | trans | 89.9 | 49.2 | 168.9 | -60.4 | -52.4 | 0 | 0 | 0 | 119.2 | ||||
| 286 | G | 39 | Very low | 42.6 | Very low | 80 Ų | 80 | 142.6 Ų | 142.6 | 83% | 0.825 | 81% | 0.81 | S | S | * | * | trans | -103.1 | 74.2 | 153.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | S288 | G286-S288 PolarHBondContact O-N 3.49Š| ||
| 287 | G | 35.3 | Very low | 42.3 | Very low | 78 Ų | 78 | 141 Ų | 141 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | trans | -61 | 119.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | F289 | G287-F289 PolarHBondContact O-N 3.12Š| ||
| 288 | S | 35.4 | Very low | 42.2 | Very low | 118 Ų | 118 | 145 Ų | 145 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | trans | -58.8 | 112.1 | 175 | -178 | 0 | 0 | 0 | 0 | 112.1 | G286 | G286-S288 PolarHBondContact O-N 3.49Š| ||
| 289 | F | 42.9 | Very low | 42 | Very low | 179 Ų | 179 | 143.5 Ų | 143.5 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | trans | -152.5 | 59.4 | 156.2 | -171.7 | -98.9 | 0 | 0 | 0 | 109.1 | G287 | G287-F289 PolarHBondContact O-N 3.12Š| ||
| 290 | Y | 39.2 | Very low | 41.9 | Very low | 228 Ų | 228 | 145.3 Ų | 145.3 | 89% | 0.894 | 81% | 0.806 | S | S | * | * | trans | -155.9 | 95.4 | 159.6 | -90.6 | -73.8 | 0 | 0 | 0 | 107.5 | ||||
| 291 | Q | 40.8 | Very low | 41.8 | Very low | 186 Ų | 186 | 149.4 Ų | 149.4 | 87% | 0.869 | 82% | 0.817 | S | S | * | * | trans | -136.3 | 125.3 | 165.1 | -159.8 | 173.5 | 39.5 | 0 | 0 | 108.3 | ||||
| 292 | S | 34.8 | Very low | 41.5 | Very low | 121 Ų | 121 | 143.6 Ų | 143.6 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | trans | 71.2 | 121 | 171.1 | -117.8 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 293 | S | 41.3 | Very low | 40.6 | Very low | 112 Ų | 112 | 145.7 Ų | 145.7 | 78% | 0.783 | 82% | 0.823 | S | S | * | * | cis | -147 | 139.8 | 37.3 | 49.5 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 294 | E | 39.3 | Very low | 40.6 | Very low | 187 Ų | 187 | 147.8 Ų | 147.8 | 87% | 0.874 | 83% | 0.826 | S | S | * | * | trans | -67.4 | 174.9 | -179.5 | -58.9 | 177.2 | 134.6 | 0 | 0 | 112.8 | ||||
| 295 | E | 41 | Very low | 40.3 | Very low | 187 Ų | 187 | 151.3 Ų | 151.3 | 87% | 0.874 | 84% | 0.835 | S | S | * | * | trans | 87.8 | 58.4 | 174.4 | -53.1 | -164.1 | 133.6 | 0 | 0 | 118.3 | ||||
| 296 | K | 44.9 | Very low | 40.2 | Very low | 209 Ų | 209 | 150.2 Ų | 150.2 | 91% | 0.909 | 83% | 0.834 | S | S | * | * | trans | -167.9 | 27.4 | 143.8 | -115.2 | 176.1 | -168.9 | -164.7 | 0 | 117.5 | L298 | K296-L298 PolarHBondContact O-N 2.98Š| ||
| 297 | V | 37.2 | Very low | 40.7 | Very low | 152 Ų | 152 | 151.5 Ų | 151.5 | 92% | 0.921 | 83% | 0.828 | S | S | * | * | trans | -90.4 | 84.8 | 172.6 | -172.1 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 298 | L | 40.4 | Very low | 41 | Very low | 154 Ų | 154 | 154.9 Ų | 154.9 | 81% | 0.806 | 83% | 0.833 | S | S | * | * | trans | -117.4 | 98.8 | 162.6 | -163.8 | 68.8 | 0 | 0 | 0 | 108.7 | K296 | K296-L298 PolarHBondContact O-N 2.98Š| ||
| 299 | S | 37.1 | Very low | 41.4 | Very low | 93 Ų | 93 | 154.1 Ų | 154.1 | 65% | 0.65 | 83% | 0.827 | S | S | * | * | trans | 17.8 | 110.8 | 150.6 | 60.4 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 300 | V | 46.8 | Very low | 41.5 | Very low | 136 Ų | 136 | 152.8 Ų | 152.8 | 82% | 0.824 | 83% | 0.834 | S | S | * | * | trans | -142.3 | 80.3 | 146.7 | -171.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 301 | Y | 38.6 | Very low | 41.7 | Very low | 246 Ų | 246 | 151 Ų | 151 | 97% | 0.965 | 83% | 0.833 | S | S | * | * | trans | -130.4 | 113.9 | 145.9 | -92.1 | -84.1 | 0 | 0 | 0 | 104.7 | ||||
| 302 | G | 41.8 | Very low | 42 | Very low | 64 Ų | 64 | 149.2 Ų | 149.2 | 66% | 0.66 | 83% | 0.825 | S | S | * | * | S | Bend | trans | 148.1 | 106.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | V304 | G302-V304 PolarHBondContact O-N 2.93Š|
| 303 | D | 34.4 | Very low | 42.6 | Very low | 171 Ų | 171 | 152.4 Ų | 152.4 | 91% | 0.914 | 83% | 0.826 | S | S | * | * | trans | -44.2 | 118.9 | 174 | -64 | -70.6 | 0 | 0 | 0 | 113.6 | ||||
| 304 | V | 46.3 | Very low | 42.8 | Very low | 130 Ų | 130 | 156.1 Ų | 156.1 | 79% | 0.788 | 83% | 0.831 | S | S | * | * | trans | -146.4 | 125.9 | 156.7 | -174.2 | 0 | 0 | 0 | 0 | 109 | G302 V306 | G302-V304 PolarHBondContact O-N 2.93Å; V304-V306 PolarHBondContact O-N 3.05Å | ||
| 305 | E | 42.3 | Very low | 43.1 | Very low | 189 Ų | 189 | 151 Ų | 151 | 88% | 0.883 | 82% | 0.821 | S | S | * | * | trans | -48.4 | 125.4 | 178.4 | -57.4 | 169.3 | 134.9 | 0 | 0 | 112.1 | P307 | E305-P307 WeakPolarHBondContact O-CD 3.25Š| ||
| 306 | V | 45.9 | Very low | 43.4 | Very low | 135 Ų | 135 | 149.4 Ų | 149.4 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | -91.6 | 115.9 | 179.3 | -178.5 | 0 | 0 | 0 | 0 | 109.6 | V304 | V304-V306 PolarHBondContact O-N 3.05Š| ||
| 307 | P | 48 | Very low | 43.7 | Very low | 107 Ų | 107 | 148.6 Ų | 148.6 | 70% | 0.695 | 81% | 0.813 | S | S | * | * | trans | -74.4 | 132.4 | 177.5 | 28.9 | -30.9 | 0 | 0 | 0 | 111.3 | E305 S309 | E305-P307 WeakPolarHBondContact O-CD 3.25Å; P307-S309 PolarHBondContact O-N 2.92Å | ||
| 308 | V | 42.2 | Very low | 44.2 | Very low | 149 Ų | 149 | 150.2 Ų | 150.2 | 90% | 0.903 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -65 | 99.8 | 172 | 171.9 | 0 | 0 | 0 | 0 | 109.5 | ||
| 309 | S | 43.5 | Very low | 44.8 | Very low | 102 Ų | 102 | 151 Ų | 151 | 71% | 0.713 | 81% | 0.81 | S | S | * | * | trans | -173 | 46.3 | 162.9 | 57 | 0 | 0 | 0 | 0 | 115.6 | P307 | P307-S309 PolarHBondContact O-N 2.92Š| ||
| 310 | V | 46.2 | Very low | 45.4 | Very low | 151 Ų | 151 | 155.1 Ų | 155.1 | 92% | 0.915 | 82% | 0.819 | S | S | * | * | S | Bend | trans | -147.7 | 52.6 | 159.7 | -161.3 | 0 | 0 | 0 | 0 | 110.5 | ||
| 311 | Q | 43.6 | Very low | 45.5 | Very low | 190 Ų | 190 | 157.1 Ų | 157.1 | 89% | 0.888 | 82% | 0.82 | S | S | * | * | trans | -131.1 | 46.2 | 176.3 | -163.4 | 161.8 | 11.8 | 0 | 0 | 111.3 | ||||
| 312 | Q | 46.9 | Very low | 45.8 | Very low | 149 Ų | 149 | 155.6 Ų | 155.6 | 70% | 0.696 | 82% | 0.818 | S | S | * | * | S | Bend | trans | -135.2 | -4.8 | -176.5 | -161.2 | 76.6 | 65.1 | 0 | 0 | 115.1 | ||
| 313 | Q | 46.6 | Very low | 45.6 | Very low | 187 Ų | 187 | 158.2 Ų | 158.2 | 87% | 0.874 | 83% | 0.826 | S | S | * | * | S | Bend | trans | -112.7 | -4.1 | -171.9 | -71.8 | -173.8 | -3.6 | 0 | 0 | 117.1 | ||
| 314 | H | 46.5 | Very low | 45.7 | Very low | 190 Ų | 190 | 153.7 Ų | 153.7 | 88% | 0.88 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -117.5 | 5.3 | 176.9 | -93 | -100.6 | 0 | 0 | 0 | 114.9 | ||
| 315 | A | 44.2 | Very low | 45.4 | Very low | 81 Ų | 81 | 151.9 Ų | 151.9 | 67% | 0.669 | 82% | 0.819 | S | S | * | * | S | Bend | trans | -104.4 | 3.3 | -177 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 316 | Q | 48.8 | Very low | 45.1 | Very low | 153 Ų | 153 | 154.8 Ų | 154.8 | 72% | 0.715 | 82% | 0.822 | S | S | * | * | S | Bend | trans | -106.2 | 0.8 | -174.6 | -120.5 | 170.9 | 23.5 | 0 | 0 | 115.5 | ||
| 317 | Q | 49.6 | Very low | 45.2 | Very low | 191 Ų | 191 | 159.2 Ų | 159.2 | 89% | 0.893 | 82% | 0.824 | S | S | * | * | S | Bend | trans | -106.1 | 1.5 | -177.2 | -153.1 | 166.6 | 43.7 | 0 | 0 | 115.1 | ||
| 318 | Q | 49.1 | Very low | 44.9 | Very low | 186 Ų | 186 | 160.2 Ų | 160.2 | 87% | 0.869 | 83% | 0.833 | S | S | * | * | S | Bend | trans | -109.9 | 7.9 | -179.7 | -76.8 | -175.6 | 22.4 | 0 | 0 | 115.1 | ||
| 319 | Q | 51.8 | Low | 44.6 | Very low | 172 Ų | 172 | 157.1 Ų | 157.1 | 80% | 0.804 | 83% | 0.831 | S | S | * | * | S | Bend | trans | -107.6 | 14 | -171.2 | -146.6 | 163.3 | 21.2 | 0 | 0 | 115.8 | ||
| 320 | Q | 50.2 | Low | 44.4 | Very low | 179 Ų | 179 | 155.9 Ų | 155.9 | 84% | 0.836 | 84% | 0.835 | S | S | * | * | S | Bend | trans | -115.6 | 12.9 | -175.3 | -71.4 | -170.4 | 39.8 | 0 | 0 | 116.8 | ||
| 321 | Q | 49.7 | Very low | 43.9 | Very low | 178 Ų | 178 | 157.1 Ų | 157.1 | 83% | 0.832 | 84% | 0.836 | S | S | * | * | S | Bend | trans | -129.8 | 8.4 | -175.9 | -64.3 | -168.7 | 18.6 | 0 | 0 | 117.3 | ||
| 322 | F | 43.6 | Very low | 43.9 | Very low | 214 Ų | 214 | 151.7 Ų | 151.7 | 94% | 0.939 | 83% | 0.832 | S | S | * | * | trans | -116.1 | 63.3 | 176.5 | -78.7 | -79.8 | 0 | 0 | 0 | 112.5 | ||||
| 323 | S | 38.1 | Very low | 43.7 | Very low | 118 Ų | 118 | 153.8 Ų | 153.8 | 83% | 0.825 | 84% | 0.844 | S | S | * | * | trans | -142 | 90.6 | 165.2 | 55.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 324 | G | 36.4 | Very low | 43.3 | Very low | 76 Ų | 76 | 152.7 Ų | 152.7 | 78% | 0.784 | 84% | 0.837 | S | S | * | * | trans | 171 | 108.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 325 | A | 39.3 | Very low | 42.9 | Very low | 93 Ų | 93 | 151.1 Ų | 151.1 | 77% | 0.769 | 83% | 0.829 | S | S | * | * | trans | 73.8 | 75.1 | 153.2 | 0 | 0 | 0 | 0 | 0 | 118.6 | R327 | A325-R327 PolarHBondContact O-N 3.06Š| ||
| 326 | R | 36.6 | Very low | 42.6 | Very low | 249 Ų | 249 | 156.3 Ų | 156.3 | 94% | 0.94 | 84% | 0.84 | S | S | * | * | trans | -63.1 | 113.1 | 137.8 | -65.9 | -170.4 | 178.6 | -145.7 | 1.6 | 109 | ||||
| 327 | R | 47.9 | Very low | 42.2 | Very low | 229 Ų | 229 | 153.7 Ų | 153.7 | 86% | 0.864 | 85% | 0.845 | S | S | * | * | trans | -149.2 | 98.3 | 158.4 | -64.9 | -167.2 | 178.7 | -131.6 | -0.8 | 106 | A325 | A325-R327 PolarHBondContact O-N 3.06Š| ||
| 328 | S | 43 | Very low | 41.6 | Very low | 127 Ų | 127 | 151.8 Ų | 151.8 | 89% | 0.888 | 84% | 0.84 | S | S | * | * | 59.2 | 120 | 88.2 | -154.3 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 329 | G | 34.9 | Very low | 41.3 | Very low | 84 Ų | 84 | 148.1 Ų | 148.1 | 87% | 0.866 | 84% | 0.835 | S | S | * | * | trans | -65.8 | 174 | -165 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 330 | G | 39 | Very low | 40.6 | Very low | 77 Ų | 77 | 147.7 Ų | 147.7 | 79% | 0.794 | 84% | 0.839 | S | S | * | * | trans | 162.5 | 101.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 331 | D | 36.9 | Very low | 39.8 | Very low | 176 Ų | 176 | 142.4 Ų | 142.4 | 94% | 0.941 | 83% | 0.832 | S | S | * | * | trans | -55.9 | 139.1 | 165.2 | -61.1 | -63.3 | 0 | 0 | 0 | 110.7 | ||||
| 332 | G | 42.8 | Very low | 39.1 | Very low | 77 Ų | 77 | 144 Ų | 144 | 79% | 0.794 | 84% | 0.84 | S | S | * | * | trans | -170.7 | 109 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 333 | M | 42.8 | Very low | 38.6 | Very low | 192 Ų | 192 | 136.9 Ų | 136.9 | 95% | 0.946 | 83% | 0.826 | S | S | * | * | trans | -59.5 | 167.1 | 173.7 | -64.8 | 174.5 | 83.7 | 0 | 0 | 112.9 | ||||
| 334 | F | 38.6 | Very low | 38.7 | Very low | 165 Ų | 165 | 135.4 Ų | 135.4 | 72% | 0.724 | 83% | 0.83 | S | S | * | * | trans | 101.5 | 99.7 | 144.4 | -166 | -96.7 | 0 | 0 | 0 | 118.2 | ||||
| 335 | E | 38.6 | Very low | 39.4 | Very low | 156 Ų | 156 | 136 Ų | 136 | 73% | 0.729 | 83% | 0.828 | S | S | * | * | 82.4 | 147.2 | 123.2 | -144.6 | 153.3 | 115.9 | 0 | 0 | 121.3 | |||||
| 336 | Q | 36.7 | Very low | 40.2 | Very low | 190 Ų | 190 | 136.3 Ų | 136.3 | 89% | 0.888 | 83% | 0.83 | S | S | * | * | trans | -82.6 | 128.4 | -162 | 176.5 | 176.7 | 62.1 | 0 | 0 | 111 | ||||
| 337 | A | 40.9 | Very low | 41.6 | Very low | 99 Ų | 99 | 129.3 Ų | 129.3 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | trans | -155.7 | 130 | 153.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 338 | N | 37.8 | Very low | 43 | Very low | 150 Ų | 150 | 121.1 Ų | 121.1 | 80% | 0.802 | 79% | 0.793 | S | S | * | * | trans | -70.2 | 131 | -179.4 | -174.4 | 5.5 | 0 | 0 | 0 | 111.4 | ||||
| 339 | S | 42.7 | Very low | 44.9 | Very low | 109 Ų | 109 | 119.7 Ų | 119.7 | 76% | 0.762 | 78% | 0.782 | S | S | * | * | trans | -157 | 122 | 154.4 | 61.7 | 0 | 0 | 0 | 0 | 111.2 | G341 | S339-G341 PolarHBondContact O-N 3.43Š| ||
| 340 | N | 35.6 | Very low | 47.4 | Very low | 164 Ų | 164 | 121.4 Ų | 121.4 | 88% | 0.877 | 77% | 0.771 | S | S | * | * | trans | -43.4 | 123.1 | 170.2 | -59 | -48.2 | 0 | 0 | 0 | 112 | ||||
| 341 | G | 33.4 | Very low | 49.6 | Very low | 68 Ų | 68 | 122.2 Ų | 122.2 | 70% | 0.701 | 76% | 0.757 | S | S | * | * | trans | -156.9 | 110.2 | 171.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | S339 G343 | S339-G341 PolarHBondContact O-N 3.43Å; G341-G343 PolarHBondContact O-N 3.29Å | ||
| 342 | E | 36.1 | Very low | 51.8 | Low | 212 Ų | 212 | 116.7 Ų | 116.7 | 99% | 0.991 | 73% | 0.732 | S | S | * | * | trans | -50.6 | 107.8 | 175.3 | -68.6 | 165.9 | 108.7 | 0 | 0 | 110.4 | ||||
| 343 | G | 33.6 | Very low | 53.9 | Low | 63 Ų | 63 | 117.9 Ų | 117.9 | 65% | 0.649 | 72% | 0.719 | S | S | * | * | trans | -159 | 115.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | G341 A345 | G341-G343 PolarHBondContact O-N 3.29Å; G343-A345 PolarHBondContact O-N 2.93Å | ||
| 344 | G | 40.2 | Very low | 56 | Low | 87 Ų | 87 | 111.7 Ų | 111.7 | 90% | 0.897 | 70% | 0.695 | S | S | * | * | trans | -46.9 | 105.9 | -174.2 | 0 | 0 | 0 | 0 | 0 | 112 | A346 | G344-A346 PolarHBondContact O-N 3.06Š| ||
| 345 | A | 50.4 | Low | 58.2 | Low | 90 Ų | 90 | 110.2 Ų | 110.2 | 74% | 0.744 | 69% | 0.69 | S | S | * | * | trans | -64.7 | 110.6 | -178.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | G343 V347 | G343-A345 PolarHBondContact O-N 2.93Å; A345-V347 PolarHBondContact O-N 3.36Å | ||
| 346 | A | 55.7 | Low | 60.5 | Low | 98 Ų | 98 | 106.7 Ų | 106.7 | 81% | 0.81 | 68% | 0.676 | S | S | * | * | trans | -55 | 108.5 | 164.8 | 0 | 0 | 0 | 0 | 0 | 107 | G344 S348 | G344-A346 PolarHBondContact O-N 3.06Å; A346-S348 PolarHBondContact O-N 2.81Å | ||
| 347 | V | 66.2 | Low | 62.8 | Low | 103 Ų | 103 | 102 Ų | 102 | 62% | 0.624 | 66% | 0.66 | S | S | * | * | trans | -52.5 | 114.4 | -178.7 | -171.1 | 0 | 0 | 0 | 0 | 107.1 | A345 S349 D351 | A345-V347 PolarHBondContact O-N 3.36Å; V347-S349 PolarHBondContact O-N 3.29Å; V347-D351 HydrophobicContact CG1-CB 3.84Å | ||
| 348 | S | 76.9 | Confident | 64.9 | Low | 57 Ų | 57 | 103.7 Ų | 103.7 | 40% | 0.399 | 65% | 0.651 | S | S | . | * | trans | -57.7 | 140.6 | 179.9 | 178.8 | 0 | 0 | 0 | 0 | 107.9 | A346 L350 D351 C352 | A346-S348 PolarHBondContact O-N 2.81Å; S348-L350 PolarHBondContact O-N 3.02Å; S348-L350 PolarHBondContact OG-N 3.25Å; S348-D351 PolarHBondContact O-N 3.03Å; S348-C352 PolarHBondContact O-N 2.83Å | ||
| 349 | S | 83 | Confident | 67.1 | Low | 96 Ų | 96 | 99.2 Ų | 99.2 | 67% | 0.671 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -52.7 | -25.1 | 173.6 | 52.8 | 0 | 0 | 0 | 0 | 111.7 | V347 L353 | V347-S349 PolarHBondContact O-N 3.29Å; S349-L353 WeakPolarHBondContact O-CB 3.47Å; S349-L353 WeakPolarHBondContact O-CD1 3.35Å; S349-L353 WeakPolarHBondContact O-CG 3.44Å; S349-L353 PolarHBondContact O-N 2.99Å; S349-L353 VanDerWaalsContact O-N 3.12Å |
| 350 | L | 86.8 | Confident | 68.8 | Low | 121 Ų | 121 | 98.7 Ų | 98.7 | 63% | 0.634 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -69.1 | -42.7 | 172.8 | -160.8 | 79.2 | 0 | 0 | 0 | 112.9 | S348 L353 S354 | S348-L350 PolarHBondContact O-N 3.02Å; S348-L350 PolarHBondContact OG-N 3.25Å; L350-L353 PolarHBondContact O-N 3.39Å; L350-S354 PolarHBondContact O-N 3.49Å; L350-S354 PolarHBondContact O-OG 3.48Å |
| 351 | D | 85 | Confident | 70.8 | Confident | 93 Ų | 93 | 94.4 Ų | 94.4 | 50% | 0.497 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -69.2 | -37.2 | 177.2 | -72 | -45.7 | 0 | 0 | 0 | 111.9 | V347 S348 L353 S354 Q355 | V347-D351 HydrophobicContact CG1-CB 3.84Å; S348-D351 PolarHBondContact O-N 3.03Å; D351-L353 VanDerWaalsContact C-N 3.35Å; D351-S354 PolarHBondContact O-N 3.34Å; D351-Q355 PolarHBondContact O-N 2.95Å |
| 352 | C | 85.2 | Confident | 72.3 | Confident | 60 Ų | 60 | 95.2 Ų | 95.2 | 41% | 0.405 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -61.6 | -43.4 | 172.4 | -178.7 | 0 | 0 | 0 | 0 | 111.3 | S348 Q355 I356 | S348-C352 PolarHBondContact O-N 2.83Å; C352-Q355 PolarHBondContact O-N 3.18Å; C352-I356 WeakPolarHBondContact O-CD1 3.17Å; C352-I356 VanDerWaalsContact O-CG1 3.25Å; C352-I356 WeakPolarHBondContact O-CG1 3.4Å; C352-I356 PolarHBondContact O-N 2.88Å; C352-I356 VanDerWaalsContact O-N 3.12Å |
| 353 | L | 85.3 | Confident | 73.3 | Confident | 103 Ų | 103 | 90.7 Ų | 90.7 | 54% | 0.539 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -67.7 | -38.8 | 175.9 | -72 | 170.4 | 0 | 0 | 0 | 112.4 | S349 L350 D351 I356 V357 | S349-L353 WeakPolarHBondContact O-CB 3.47Å; S349-L353 WeakPolarHBondContact O-CD1 3.35Å; S349-L353 WeakPolarHBondContact O-CG 3.44Å; S349-L353 PolarHBondContact O-N 2.99Å; S349-L353 VanDerWaalsContact O-N 3.12Å; L350-L353 PolarHBondContact O-N 3.39Å; D351-L353 VanDerWaalsContact C-N 3.35Å; L353-I356 PolarHBondContact O-N 2.93Å; L353-V357 WeakPolarHBondContact O-CG2 3.32Å; L353-V357 PolarHBondContact O-N 2.93Å |
| 354 | S | 87.4 | Confident | 74.4 | Confident | 61 Ų | 61 | 95.2 Ų | 95.2 | 43% | 0.427 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62 | -44.6 | 174.5 | -70 | 0 | 0 | 0 | 0 | 111.9 | L350 D351 I356 V357 E358 | L350-S354 PolarHBondContact O-N 3.49Å; L350-S354 PolarHBondContact O-OG 3.48Å; D351-S354 PolarHBondContact O-N 3.34Å; S354-I356 VanDerWaalsContact C-N 3.32Å; S354-I356 PolarHBondContact O-N 3.38Å; S354-V357 PolarHBondContact O-N 3.13Å; S354-E358 WeakPolarHBondContact O-CB 3.34Å; S354-E358 PolarHBondContact O-N 2.64Å |
| 355 | Q | 85.7 | Confident | 75 | Confident | 135 Ų | 135 | 98.9 Ų | 98.9 | 63% | 0.631 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -59.9 | -39.6 | 174.2 | -95.3 | 179.4 | 3.1 | 0 | 0 | 112.7 | D351 C352 S359 | D351-Q355 PolarHBondContact O-N 2.95Å; C352-Q355 PolarHBondContact O-N 3.18Å; Q355-S359 WeakPolarHBondContact O-CB 3.33Å; Q355-S359 PolarHBondContact O-N 3.1Å; Q355-S359 PolarHBondContact O-OG 3.48Å |
| 356 | I | 85.9 | Confident | 75.1 | Confident | 82 Ų | 82 | 98.4 Ų | 98.4 | 42% | 0.421 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65.9 | -44.3 | 176.9 | -67.4 | 163.5 | 0 | 0 | 0 | 110.7 | C352 L353 S354 E358 S359 I360 | C352-I356 WeakPolarHBondContact O-CD1 3.17Å; C352-I356 VanDerWaalsContact O-CG1 3.25Å; C352-I356 WeakPolarHBondContact O-CG1 3.4Å; C352-I356 PolarHBondContact O-N 2.88Å; C352-I356 VanDerWaalsContact O-N 3.12Å; L353-I356 PolarHBondContact O-N 2.93Å; S354-I356 VanDerWaalsContact C-N 3.32Å; S354-I356 PolarHBondContact O-N 3.38Å; I356-E358 PolarHBondContact O-N 2.82Å; I356-S359 WeakPolarHBondContact CA-OG 3.23Å; I356-S359 PolarHBondContact O-N 2.67Å; I356-S359 PolarHBondContact O-OG 3.45Å; I356-I360 HydrophobicContact CG2-CD1 3.74Å; I356-I360 WeakPolarHBondContact O-CD1 3.46Å; I356-I360 WeakPolarHBondContact O-CG1 3.1Å; I356-I360 PolarHBondContact O-N 2.93Å |
| 357 | V | 85.8 | Confident | 74.8 | Confident | 92 Ų | 92 | 99.9 Ų | 99.9 | 56% | 0.558 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -66.7 | -37.5 | 179.4 | 173.5 | 0 | 0 | 0 | 0 | 111.9 | L353 S354 S361 | L353-V357 WeakPolarHBondContact O-CG2 3.32Å; L353-V357 PolarHBondContact O-N 2.93Å; S354-V357 PolarHBondContact O-N 3.13Å; V357-S361 WeakPolarHBondContact O-CB 3.36Å; V357-S361 PolarHBondContact O-N 3.02Å; V357-S361 PolarHBondContact O-OG 3.49Å |
| 358 | E | 85 | Confident | 74.1 | Confident | 134 Ų | 134 | 100.4 Ų | 100.4 | 63% | 0.626 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -73.3 | -36.8 | 179.2 | -160.5 | 160.2 | -152.2 | 0 | 0 | 112.1 | S354 I356 S361 T362 | S354-E358 WeakPolarHBondContact O-CB 3.34Å; S354-E358 PolarHBondContact O-N 2.64Å; I356-E358 PolarHBondContact O-N 2.82Å; E358-S361 PolarHBondContact O-N 3.35Å; E358-T362 WeakPolarHBondContact O-CB 3.34Å; E358-T362 WeakPolarHBondContact O-CG2 3.37Å; E358-T362 PolarHBondContact O-N 2.88Å; E358-T362 PolarHBondContact O-OG1 3.26Å |
| 359 | S | 83.6 | Confident | 72.8 | Confident | 56 Ų | 56 | 104.8 Ų | 104.8 | 39% | 0.392 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -69 | -34.7 | 172.6 | 47.8 | 0 | 0 | 0 | 0 | 113.1 | Q355 I356 T362 Q363 | Q355-S359 WeakPolarHBondContact O-CB 3.33Å; Q355-S359 PolarHBondContact O-N 3.1Å; Q355-S359 PolarHBondContact O-OG 3.48Å; I356-S359 WeakPolarHBondContact CA-OG 3.23Å; I356-S359 PolarHBondContact O-N 2.67Å; I356-S359 PolarHBondContact O-OG 3.45Å; S359-T362 WeakPolarHBondContact CA-OG1 3.35Å; S359-T362 PolarHBondContact O-OG1 3.02Å; S359-T362 VanDerWaalsContact O-OG1 3.1Å; S359-Q363 WeakPolarHBondContact O-CB 3.44Å; S359-Q363 PolarHBondContact O-N 2.95Å |
| 360 | I | 79 | Confident | 70.8 | Confident | 97 Ų | 97 | 107 Ų | 107 | 50% | 0.497 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -68.1 | -39 | 171.9 | -65.5 | 162.8 | 0 | 0 | 0 | 111.1 | I356 K364 | I356-I360 HydrophobicContact CG2-CD1 3.74Å; I356-I360 WeakPolarHBondContact O-CD1 3.46Å; I356-I360 WeakPolarHBondContact O-CG1 3.1Å; I356-I360 PolarHBondContact O-N 2.93Å; I360-K364 WeakPolarHBondContact O-CB 3.34Å; I360-K364 PolarHBondContact O-N 2.84Å |
| 361 | S | 76.3 | Confident | 68.7 | Low | 75 Ų | 75 | 109.5 Ų | 109.5 | 52% | 0.524 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -69.2 | -35.3 | 178.6 | -62.7 | 0 | 0 | 0 | 0 | 112.5 | V357 E358 K365 | V357-S361 WeakPolarHBondContact O-CB 3.36Å; V357-S361 PolarHBondContact O-N 3.02Å; V357-S361 PolarHBondContact O-OG 3.49Å; E358-S361 PolarHBondContact O-N 3.35Å; S361-K365 PolarHBondContact O-N 2.97Å |
| 362 | T | 65.5 | Low | 66.5 | Low | 84 Ų | 84 | 113.3 Ų | 113.3 | 52% | 0.515 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -78.3 | -36.3 | 175.7 | 51.7 | 0 | 0 | 0 | 0 | 112.6 | E358 S359 K364 K365 S366 | E358-T362 WeakPolarHBondContact O-CB 3.34Å; E358-T362 WeakPolarHBondContact O-CG2 3.37Å; E358-T362 PolarHBondContact O-N 2.88Å; E358-T362 PolarHBondContact O-OG1 3.26Å; S359-T362 WeakPolarHBondContact CA-OG1 3.35Å; S359-T362 PolarHBondContact O-OG1 3.02Å; S359-T362 VanDerWaalsContact O-OG1 3.1Å; T362-K364 VanDerWaalsContact C-N 3.34Å; T362-K364 PolarHBondContact O-N 3.21Å; T362-K365 PolarHBondContact O-N 2.9Å; T362-K365 VanDerWaalsContact O-N 3.14Å; T362-S366 WeakPolarHBondContact O-CB 3.35Å; T362-S366 PolarHBondContact O-N 3.39Å |
| 363 | Q | 57.9 | Low | 64.2 | Low | 117 Ų | 117 | 114.4 Ų | 114.4 | 55% | 0.547 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -63.4 | -38.4 | 170 | -91 | -173.9 | -11.1 | 0 | 0 | 112 | S359 K365 S366 M367 | S359-Q363 WeakPolarHBondContact O-CB 3.44Å; S359-Q363 PolarHBondContact O-N 2.95Å; Q363-K365 VanDerWaalsContact C-N 3.26Å; Q363-K365 PolarHBondContact O-N 3.24Å; Q363-S366 PolarHBondContact O-N 2.89Å; Q363-M367 WeakPolarHBondContact O-CB 3.5Å; Q363-M367 WeakPolarHBondContact O-CG 3.46Å; Q363-M367 PolarHBondContact O-N 2.87Å |
| 364 | K | 55.4 | Low | 62 | Low | 158 Ų | 158 | 120.1 Ų | 120.1 | 69% | 0.687 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -66.7 | -28.1 | 174.1 | -167 | 172.6 | 179.3 | 175.6 | 0 | 112.3 | I360 T362 V368 | I360-K364 WeakPolarHBondContact O-CB 3.34Å; I360-K364 PolarHBondContact O-N 2.84Å; T362-K364 VanDerWaalsContact C-N 3.34Å; T362-K364 PolarHBondContact O-N 3.21Å; K364-V368 WeakPolarHBondContact O-CG2 3.02Å |
| 365 | K | 53.1 | Low | 59.5 | Low | 164 Ų | 164 | 120 Ų | 120 | 71% | 0.713 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -79.4 | -27.7 | 173.2 | -160.1 | 169.1 | -176.6 | 174.9 | 0 | 112.9 | S361 T362 Q363 | S361-K365 PolarHBondContact O-N 2.97Å; T362-K365 PolarHBondContact O-N 2.9Å; T362-K365 VanDerWaalsContact O-N 3.14Å; Q363-K365 VanDerWaalsContact C-N 3.26Å; Q363-K365 PolarHBondContact O-N 3.24Å |
| 366 | S | 51.6 | Low | 57.2 | Low | 81 Ų | 81 | 121.6 Ų | 121.6 | 57% | 0.566 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -80.9 | -34.5 | 176.1 | 166 | 0 | 0 | 0 | 0 | 113.3 | T362 Q363 | T362-S366 WeakPolarHBondContact O-CB 3.35Å; T362-S366 PolarHBondContact O-N 3.39Å; Q363-S366 PolarHBondContact O-N 2.89Å |
| 367 | M | 50.6 | Low | 54.8 | Low | 129 Ų | 129 | 121.2 Ų | 121.2 | 64% | 0.635 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -75.6 | -23.5 | 177.3 | -70.6 | -178.3 | 176.5 | 0 | 0 | 113 | Q363 L369 | Q363-M367 WeakPolarHBondContact O-CB 3.5Å; Q363-M367 WeakPolarHBondContact O-CG 3.46Å; Q363-M367 PolarHBondContact O-N 2.87Å; M367-L369 VanDerWaalsContact C-N 3.29Å; M367-L369 PolarHBondContact O-N 3.14Å |
| 368 | V | 51.9 | Low | 52.5 | Low | 113 Ų | 113 | 125.5 Ų | 125.5 | 69% | 0.685 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.9 | -3.1 | 179.1 | -178.7 | 0 | 0 | 0 | 0 | 112.4 | K364 | K364-V368 WeakPolarHBondContact O-CG2 3.02Š|
| 369 | L | 49.2 | Very low | 50.2 | Low | 149 Ų | 149 | 125.8 Ų | 125.8 | 78% | 0.78 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.7 | 6.4 | 175.7 | -71.1 | 175.7 | 0 | 0 | 0 | 114.2 | M367 | M367-L369 VanDerWaalsContact C-N 3.29Å; M367-L369 PolarHBondContact O-N 3.14Å |
| 370 | N | 40.7 | Very low | 48.1 | Very low | 142 Ų | 142 | 130 Ų | 130 | 76% | 0.759 | 72% | 0.717 | S | S | * | * | trans | -119 | 20.7 | -175.2 | -156.2 | 53.7 | 0 | 0 | 0 | 114.6 | ||||
| 371 | E | 42.6 | Very low | 46.2 | Very low | 175 Ų | 175 | 133 Ų | 133 | 82% | 0.818 | 73% | 0.728 | S | S | * | * | trans | -112 | 76.9 | 171.7 | -64.5 | -153.2 | 126.6 | 0 | 0 | 109.1 | ||||
| 372 | N | 38.7 | Very low | 44.5 | Very low | 173 Ų | 173 | 136.7 Ų | 136.7 | 93% | 0.925 | 74% | 0.741 | S | S | * | * | trans | -171 | 100.9 | 163.4 | -89.4 | -18.2 | 0 | 0 | 0 | 108.7 | ||||
| 373 | G | 37.1 | Very low | 43.4 | Very low | 82 Ų | 82 | 136.3 Ų | 136.3 | 85% | 0.845 | 75% | 0.753 | S | S | * | * | trans | 163 | 75.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 374 | F | 38.4 | Very low | 42.7 | Very low | 223 Ų | 223 | 136.4 Ų | 136.4 | 98% | 0.978 | 77% | 0.767 | S | S | * | * | trans | -65.9 | 147.3 | 162.5 | -93.3 | -105.9 | 0 | 0 | 0 | 111.8 | ||||
| 375 | G | 36 | Very low | 42.7 | Very low | 58 Ų | 58 | 134.5 Ų | 134.5 | 60% | 0.598 | 77% | 0.771 | S | S | * | * | trans | 108.2 | 116.1 | 134.9 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 376 | N | 38.1 | Very low | 42.4 | Very low | 170 Ų | 170 | 131.5 Ų | 131.5 | 91% | 0.909 | 77% | 0.77 | S | S | * | * | trans | 90.6 | 128.2 | 137.6 | -54.1 | -26.4 | 0 | 0 | 0 | 118 | ||||
| 377 | G | 34.7 | Very low | 42.1 | Very low | 73 Ų | 73 | 133.9 Ų | 133.9 | 75% | 0.753 | 78% | 0.782 | S | S | * | * | trans | -83.4 | -173.8 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 378 | Q | 37.2 | Very low | 42.3 | Very low | 182 Ų | 182 | 133.1 Ų | 133.1 | 85% | 0.85 | 79% | 0.789 | S | S | * | * | trans | 77.4 | 121.4 | 171.4 | -78.7 | -176.1 | -8.1 | 0 | 0 | 117.7 | ||||
| 379 | I | 37.5 | Very low | 41.8 | Very low | 140 Ų | 140 | 135.9 Ų | 135.9 | 72% | 0.718 | 80% | 0.8 | S | S | * | * | trans | 87.8 | 98 | 142.6 | -60.8 | 160.1 | 0 | 0 | 0 | 116.6 | ||||
| 380 | I | 39 | Very low | 41.6 | Very low | 145 Ų | 145 | 132.5 Ų | 132.5 | 74% | 0.744 | 80% | 0.801 | S | S | * | * | 34 | 130 | 121.5 | -56 | 175.2 | 0 | 0 | 0 | 118.5 | |||||
| 381 | E | 38.3 | Very low | 41.8 | Very low | 159 Ų | 159 | 130.3 Ų | 130.3 | 74% | 0.743 | 80% | 0.803 | S | S | * | * | trans | 89.6 | 110 | 153.9 | -84.7 | -169.2 | 159.3 | 0 | 0 | 121.4 | ||||
| 382 | I | 41.4 | Very low | 42 | Very low | 154 Ų | 154 | 128.6 Ų | 128.6 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | 58.8 | 115.8 | 127.5 | -53.3 | 164.6 | 0 | 0 | 0 | 118.2 | |||||
| 383 | G | 41.8 | Very low | 42.2 | Very low | 75 Ų | 75 | 127 Ų | 127 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | trans | 139.9 | 104.5 | 149.2 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 384 | S | 43.8 | Very low | 42.6 | Very low | 119 Ų | 119 | 126.9 Ų | 126.9 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | trans | -74.9 | -172.3 | 170.7 | -46.1 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 385 | P | 55.8 | Low | 42.7 | Very low | 118 Ų | 118 | 122.8 Ų | 122.8 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | -128.8 | -178.8 | -95.8 | 36.9 | -16.9 | 0 | 0 | 0 | 112.2 | |||||
| 386 | S | 45.2 | Very low | 43.2 | Very low | 101 Ų | 101 | 127.8 Ų | 127.8 | 71% | 0.706 | 81% | 0.805 | S | S | * | * | trans | 166.4 | 125.9 | 137.5 | 53.6 | 0 | 0 | 0 | 0 | 115 | ||||
| 387 | T | 45.9 | Very low | 43.6 | Very low | 132 Ų | 132 | 125.9 Ų | 125.9 | 81% | 0.81 | 80% | 0.799 | S | S | * | * | trans | 53.8 | 134.9 | 134.5 | 66.7 | 0 | 0 | 0 | 0 | 119 | ||||
| 388 | S | 55.3 | Low | 44.4 | Very low | 113 Ų | 113 | 128.5 Ų | 128.5 | 79% | 0.79 | 80% | 0.803 | S | S | * | * | cis | -173 | 158.8 | 46.5 | 50.4 | 0 | 0 | 0 | 0 | 112 | ||||
| 389 | D | 41.2 | Very low | 44.6 | Very low | 170 Ų | 170 | 128.3 Ų | 128.3 | 91% | 0.909 | 80% | 0.803 | S | S | * | * | trans | -56.8 | 159.4 | 178 | -62 | -70.1 | 0 | 0 | 0 | 117.4 | ||||
| 390 | G | 46 | Very low | 44.9 | Very low | 78 Ų | 78 | 125.9 Ų | 125.9 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | trans | -177.5 | 91.1 | 164.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 391 | A | 43.2 | Very low | 45 | Very low | 97 Ų | 97 | 126 Ų | 126 | 80% | 0.802 | 80% | 0.8 | S | S | * | * | trans | -62.4 | 151.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 392 | T | 48.5 | Very low | 45.4 | Very low | 138 Ų | 138 | 126 Ų | 126 | 85% | 0.847 | 80% | 0.804 | S | S | * | * | trans | -166.5 | 130.1 | 136.6 | -73.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 393 | T | 41.3 | Very low | 45.6 | Very low | 141 Ų | 141 | 124.5 Ų | 124.5 | 87% | 0.865 | 81% | 0.806 | S | S | * | * | trans | -66.2 | 142.3 | 175.7 | 40.5 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 394 | G | 45.5 | Very low | 46.4 | Very low | 78 Ų | 78 | 125.7 Ų | 125.7 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | trans | -159.6 | 98 | 168.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 395 | V | 40 | Very low | 46.5 | Very low | 137 Ų | 137 | 132.1 Ų | 132.1 | 83% | 0.83 | 81% | 0.807 | S | S | * | * | trans | -50.6 | 145 | 166.6 | 166.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 396 | L | 46.9 | Very low | 45.9 | Very low | 164 Ų | 164 | 129.6 Ų | 129.6 | 86% | 0.859 | 80% | 0.802 | S | S | * | * | trans | 178.5 | 114.4 | 137.6 | -90.7 | 177.9 | 0 | 0 | 0 | 110.3 | ||||
| 397 | T | 46.3 | Very low | 45.7 | Very low | 129 Ų | 129 | 132.2 Ų | 132.2 | 79% | 0.791 | 81% | 0.808 | S | S | * | * | trans | -74 | 160.5 | 162.1 | 43.3 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 398 | P | 52.4 | Low | 45.9 | Very low | 129 Ų | 129 | 133.9 Ų | 133.9 | 84% | 0.838 | 81% | 0.811 | S | S | * | * | trans | -138.2 | 153.6 | 130.1 | 31.5 | -15 | 0 | 0 | 0 | 115.3 | ||||
| 399 | Q | 40.9 | Very low | 45.4 | Very low | 178 Ų | 178 | 133 Ų | 133 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | trans | -77.1 | 160.5 | 179.1 | -78.4 | -177.3 | -22.8 | 0 | 0 | 114.4 | ||||
| 400 | S | 44.3 | Very low | 45.9 | Very low | 89 Ų | 89 | 132.8 Ų | 132.8 | 62% | 0.622 | 80% | 0.803 | S | S | * | * | 77 | 132.2 | 129.6 | 59.5 | 0 | 0 | 0 | 0 | 122.9 | |||||
| 401 | D | 40.1 | Very low | 46.1 | Very low | 147 Ų | 147 | 133.6 Ų | 133.6 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | trans | 78.9 | 123.3 | 143.6 | -63.9 | -33.3 | 0 | 0 | 0 | 119.6 | ||||
| 402 | I | 47.9 | Very low | 46.6 | Very low | 160 Ų | 160 | 138.2 Ų | 138.2 | 82% | 0.821 | 81% | 0.808 | S | S | * | * | -173.3 | 118.5 | 121.3 | -85.4 | 143.9 | 0 | 0 | 0 | 108.7 | |||||
| 403 | S | 45.4 | Very low | 46.6 | Very low | 121 Ų | 121 | 136.6 Ų | 136.6 | 85% | 0.846 | 80% | 0.802 | S | S | * | * | trans | -112.6 | 151.7 | 151.6 | -82.1 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 404 | P | 58.7 | Low | 47.5 | Very low | 100 Ų | 100 | 136.5 Ų | 136.5 | 65% | 0.649 | 80% | 0.802 | S | S | * | * | trans | -139.3 | 140.6 | 151.3 | 31.6 | -14.1 | 0 | 0 | 0 | 115.1 | ||||
| 405 | R | 44.7 | Very low | 47.8 | Very low | 255 Ų | 255 | 141.6 Ų | 141.6 | 96% | 0.962 | 80% | 0.804 | S | S | * | * | trans | 66.4 | 141.8 | 135.1 | -64.7 | 176.5 | 154 | -170 | -8.1 | 119.1 | ||||
| 406 | G | 43.7 | Very low | 48.5 | Very low | 64 Ų | 64 | 142.3 Ų | 142.3 | 66% | 0.66 | 80% | 0.804 | S | S | * | * | cis | 137.2 | 122.6 | 7.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 407 | N | 41.6 | Very low | 49.2 | Very low | 156 Ų | 156 | 139.6 Ų | 139.6 | 83% | 0.834 | 80% | 0.798 | S | S | * | * | trans | 61.6 | 135.5 | 151.3 | -53.6 | -9.8 | 0 | 0 | 0 | 122.2 | ||||
| 408 | L | 50.4 | Low | 49.8 | Very low | 168 Ų | 168 | 139.1 Ų | 139.1 | 88% | 0.88 | 80% | 0.797 | S | S | * | * | 171.3 | 157 | 102.8 | -92.8 | 155.3 | 0 | 0 | 0 | 112 | |||||
| 409 | S | 43.6 | Very low | 49.9 | Very low | 95 Ų | 95 | 144.5 Ų | 144.5 | 66% | 0.664 | 80% | 0.801 | S | S | * | * | trans | -131.9 | 139.5 | -162.1 | 46.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 410 | D | 53.2 | Low | 50.6 | Low | 164 Ų | 164 | 140.6 Ų | 140.6 | 88% | 0.877 | 80% | 0.799 | S | S | * | * | trans | -160.8 | 124.8 | 164 | -72.9 | -57.1 | 0 | 0 | 0 | 106.6 | ||||
| 411 | A | 49.9 | Very low | 51.3 | Low | 95 Ų | 95 | 141.7 Ų | 141.7 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | 96.8 | 146.7 | 50.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 412 | E | 53.8 | Low | 52.5 | Low | 194 Ų | 194 | 140.5 Ų | 140.5 | 91% | 0.907 | 81% | 0.807 | S | S | * | * | trans | 96.7 | 101.4 | 170.8 | -136.5 | 161.7 | 102.9 | 0 | 0 | 116.6 | ||||
| 413 | S | 49 | Very low | 53.3 | Low | 105 Ų | 105 | 138.1 Ų | 138.1 | 73% | 0.734 | 80% | 0.802 | S | S | * | * | 85 | 113.3 | 58.1 | -167.9 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 414 | T | 60.2 | Low | 53.7 | Low | 139 Ų | 139 | 139.9 Ų | 139.9 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | trans | -176.6 | 121.9 | 133.1 | -70 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 415 | Q | 51 | Low | 54.2 | Low | 184 Ų | 184 | 143.1 Ų | 143.1 | 86% | 0.86 | 81% | 0.808 | S | S | * | * | trans | -94.6 | 147.7 | 170 | -62.3 | 172.9 | -55.4 | 0 | 0 | 109.7 | ||||
| 416 | D | 54.5 | Low | 55 | Low | 153 Ų | 153 | 138.5 Ų | 138.5 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -176 | 97 | 143.2 | -134 | -93.4 | 0 | 0 | 0 | 107.8 | ||||
| 417 | S | 61.6 | Low | 55.9 | Low | 106 Ų | 106 | 143.6 Ų | 143.6 | 74% | 0.741 | 81% | 0.806 | S | S | * | * | 83 | 147.8 | 90.4 | -82.8 | 0 | 0 | 0 | 0 | 116 | |||||
| 418 | P | 59.1 | Low | 56.7 | Low | 119 Ų | 119 | 149.1 Ų | 149.1 | 77% | 0.773 | 83% | 0.827 | S | S | * | * | trans | -111.7 | -178.7 | -148.3 | 38.8 | -26.1 | 0 | 0 | 0 | 113 | ||||
| 419 | R | 53.5 | Low | 57.1 | Low | 243 Ų | 243 | 148.2 Ų | 148.2 | 92% | 0.917 | 82% | 0.824 | S | S | * | * | trans | 142.4 | 134.4 | 134.2 | -166.3 | 158.4 | -170.8 | -169.5 | 0.6 | 115 | ||||
| 420 | A | 55.6 | Low | 57.8 | Low | 95 Ų | 95 | 151 Ų | 151 | 79% | 0.785 | 83% | 0.833 | S | S | * | * | trans | 119.3 | 93 | 146.6 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 421 | S | 59.3 | Low | 58 | Low | 113 Ų | 113 | 150.3 Ų | 150.3 | 79% | 0.79 | 83% | 0.83 | S | S | * | * | trans | -73.2 | 163.2 | 138.4 | -46.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 422 | P | 66.5 | Low | 58.5 | Low | 121 Ų | 121 | 153.5 Ų | 153.5 | 79% | 0.786 | 83% | 0.833 | S | S | * | * | -155.2 | -150.6 | 65.8 | 37.3 | -10.3 | 0 | 0 | 0 | 113.2 | |||||
| 423 | P | 64.4 | Low | 58.8 | Low | 111 Ų | 111 | 151 Ų | 151 | 72% | 0.721 | 83% | 0.828 | S | S | * | * | -128.1 | -174.9 | -82.9 | 41.3 | -23.1 | 0 | 0 | 0 | 114.6 | |||||
| 424 | D | 53.8 | Low | 59.5 | Low | 158 Ų | 158 | 154.1 Ų | 154.1 | 85% | 0.845 | 83% | 0.834 | S | S | * | * | trans | -10.5 | 138.5 | 163.2 | -69.8 | -73.5 | 0 | 0 | 0 | 122.8 | ||||
| 425 | H | 68 | Low | 59.4 | Low | 168 Ų | 168 | 155.1 Ų | 155.1 | 78% | 0.778 | 83% | 0.833 | S | S | * | * | trans | -157.4 | 100.8 | 143.8 | -154.2 | 17.8 | 0 | 0 | 0 | 107.3 | ||||
| 426 | M | 62.8 | Low | 60 | Low | 158 Ų | 158 | 152.9 Ų | 152.9 | 78% | 0.778 | 83% | 0.831 | S | S | * | * | 63.7 | 129.9 | 74.4 | -135.3 | -175.4 | -177.9 | 0 | 0 | 115.3 | |||||
| 427 | Q | 62.7 | Low | 60.5 | Low | 170 Ų | 170 | 152.9 Ų | 152.9 | 79% | 0.794 | 83% | 0.832 | S | S | * | * | trans | 90.7 | 118.5 | 172.5 | -57.1 | 170.8 | -8.3 | 0 | 0 | 113.9 | ||||
| 428 | E | 58.8 | Low | 60.4 | Low | 273 Ų | 273 | 157.2 Ų | 157.2 | 100% | 1.276 | 84% | 0.84 | S | S | * | * | cis | -143.2 | 0 | 45 | -145.2 | 174.5 | 128.5 | 0 | 0 | 113.2 |
Retrieved 428 of 428 residues in 241.7 ms
(Link to these results)