| 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 | 38.8 | Very low | 39.6 | Very low | 232 Ų | 232 | 168.6 Ų | 168.6 | 100% | 1.143 | 85% | 0.85 | S | S | * | * | 0 | 116 | 0 | -76.7 | 166.1 | 162.4 | 0 | 0 | 109.1 | |||||
| 2 | N | 41.3 | Very low | 39.3 | Very low | 153 Ų | 153 | 172.1 Ų | 172.1 | 82% | 0.818 | 85% | 0.845 | S | S | * | * | trans | 51 | 92.1 | 151.5 | -49.7 | -19.3 | 0 | 0 | 0 | 118.4 | ||||
| 3 | R | 41.8 | Very low | 38.9 | Very low | 241 Ų | 241 | 169.3 Ų | 169.3 | 91% | 0.909 | 83% | 0.829 | S | S | * | * | 45.8 | 111.7 | 83.5 | -84.7 | -178.1 | 176.7 | 154 | -0.4 | 114.4 | |||||
| 4 | S | 42.8 | Very low | 39.3 | Very low | 123 Ų | 123 | 170.9 Ų | 170.9 | 86% | 0.86 | 83% | 0.83 | S | S | * | * | -163.1 | 104.8 | 129.5 | -76 | 0 | 0 | 0 | 0 | 111 | |||||
| 5 | R | 42.5 | Very low | 39 | Very low | 237 Ų | 237 | 169.1 Ų | 169.1 | 89% | 0.894 | 83% | 0.833 | S | S | * | * | trans | -78.5 | 139.9 | 162 | -77.4 | 163.9 | 167.6 | 157.6 | -4.2 | 107.4 | ||||
| 6 | S | 43.6 | Very low | 39 | Very low | 129 Ų | 129 | 166.1 Ų | 166.1 | 90% | 0.902 | 83% | 0.828 | S | S | * | * | trans | -118.5 | 106.5 | 159 | -63.5 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 7 | S | 40 | Very low | 38.8 | Very low | 91 Ų | 91 | 165.1 Ų | 165.1 | 64% | 0.636 | 82% | 0.82 | S | S | * | * | trans | -97.4 | 155.8 | 178 | 44.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 8 | E | 35.4 | Very low | 38.7 | Very low | 170 Ų | 170 | 165.1 Ų | 165.1 | 79% | 0.794 | 81% | 0.814 | S | S | * | * | trans | 79.2 | 110.9 | 152.2 | -71.4 | 171.1 | 177.8 | 0 | 0 | 118.2 | ||||
| 9 | R | 38.1 | Very low | 38.5 | Very low | 226 Ų | 226 | 167.7 Ų | 167.7 | 85% | 0.853 | 82% | 0.82 | S | S | * | * | 65.5 | 103.1 | 88 | -86.8 | -170.7 | -169.7 | -164.8 | 4.3 | 112.8 | |||||
| 10 | V | 36.8 | Very low | 38.7 | Very low | 146 Ų | 146 | 169.2 Ų | 169.2 | 89% | 0.885 | 82% | 0.822 | S | S | * | * | trans | -118.7 | 105.2 | 146.9 | -178.5 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 11 | T | 35.1 | Very low | 38.8 | Very low | 107 Ų | 107 | 172.8 Ų | 172.8 | 66% | 0.656 | 83% | 0.827 | S | S | * | * | trans | -68 | 146.6 | 159.1 | 48.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 12 | R | 36.2 | Very low | 38.7 | Very low | 210 Ų | 210 | 173.3 Ų | 173.3 | 79% | 0.792 | 82% | 0.816 | S | S | * | * | 147.4 | 119 | 114.9 | -165.4 | 168.5 | -177.6 | 171.6 | 1.1 | 114.4 | |||||
| 13 | E | 33.7 | Very low | 38.6 | Very low | 136 Ų | 136 | 178 Ų | 178 | 64% | 0.636 | 82% | 0.822 | S | S | * | * | trans | 55.5 | 121.6 | 144.1 | -63.9 | -176.6 | 133.9 | 0 | 0 | 124.4 | ||||
| 14 | K | 44.5 | Very low | 38.3 | Very low | 192 Ų | 192 | 172.2 Ų | 172.2 | 84% | 0.835 | 82% | 0.819 | S | S | * | * | 19.6 | 117.3 | 126.6 | -66.2 | 174.6 | 178.8 | 174.3 | 0 | 116.9 | |||||
| 15 | T | 34.2 | Very low | 37.7 | Very low | 144 Ų | 144 | 172.1 Ų | 172.1 | 88% | 0.883 | 82% | 0.819 | S | S | * | * | trans | -157.2 | 155.4 | 130.1 | 35.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 16 | T | 39.4 | Very low | 37.3 | Very low | 121 Ų | 121 | 166.1 Ų | 166.1 | 74% | 0.742 | 81% | 0.813 | S | S | * | * | trans | -66.4 | 160.5 | -170.7 | 44.5 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 17 | E | 35.6 | Very low | 36.8 | Very low | 149 Ų | 149 | 165 Ų | 165 | 70% | 0.696 | 81% | 0.805 | S | S | * | * | trans | 89.7 | 115.9 | 145.6 | -80.2 | -169.5 | 136.8 | 0 | 0 | 122.5 | ||||
| 18 | K | 37.1 | Very low | 36.5 | Very low | 164 Ų | 164 | 165.6 Ų | 165.6 | 71% | 0.713 | 81% | 0.809 | S | S | * | * | 45.7 | 96.8 | 129.8 | -63.2 | 172.2 | -172.1 | 148.2 | 0 | 117.5 | K20 | K18-K20 PolarHBondContact O-N 2.94Š| |||
| 19 | K | 35.9 | Very low | 36.3 | Very low | 216 Ų | 216 | 162.4 Ų | 162.4 | 94% | 0.939 | 81% | 0.805 | S | S | * | * | trans | -62.9 | 102.4 | 156.1 | -80 | 179 | 174.9 | 174.7 | 0 | 110.7 | ||||
| 20 | K | 41.1 | Very low | 36.2 | Very low | 196 Ų | 196 | 156.7 Ų | 156.7 | 85% | 0.852 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -102.3 | 128.6 | 155.1 | -79.4 | -172.8 | 178.5 | 179.5 | 0 | 109.4 | K18 | K18-K20 PolarHBondContact O-N 2.94Š|
| 21 | R | 41.8 | Very low | 35.9 | Very low | 246 Ų | 246 | 154.7 Ų | 154.7 | 93% | 0.928 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 138.3 | -178.4 | -63.7 | 171.5 | 84.2 | 172.7 | 4.9 | 110.1 | ||
| 22 | R | 36.6 | Very low | 35.8 | Very low | 243 Ų | 243 | 154.6 Ų | 154.6 | 92% | 0.917 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 133.8 | 177.6 | -51.9 | 177.8 | 100.5 | 179.3 | 5.8 | 111 | ||
| 23 | R | 37.8 | Very low | 35.6 | Very low | 250 Ų | 250 | 149.4 Ų | 149.4 | 94% | 0.943 | 79% | 0.793 | S | S | * | * | trans | -146.1 | 128.3 | 140.3 | -77.4 | -162.2 | 171.5 | 154 | -4 | 109.1 | ||||
| 24 | S | 35.7 | Very low | 35.6 | Very low | 120 Ų | 120 | 148.3 Ų | 148.3 | 84% | 0.839 | 80% | 0.8 | S | S | * | * | trans | -68.3 | 145.6 | -179.4 | 43.2 | 0 | 0 | 0 | 0 | 113 | ||||
| 25 | S | 31.9 | Very low | 35.1 | Very low | 122 Ų | 122 | 145.2 Ų | 145.2 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | trans | -158.1 | 110.8 | 149.5 | 56.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 26 | S | 33 | Very low | 35.1 | Very low | 110 Ų | 110 | 142.7 Ų | 142.7 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | trans | -88.7 | 155.4 | 159.8 | 49.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 27 | S | 33.2 | Very low | 34.8 | Very low | 106 Ų | 106 | 148 Ų | 148 | 74% | 0.741 | 80% | 0.797 | S | S | * | * | trans | 75.2 | 118 | 157.9 | 59.7 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 28 | S | 32.9 | Very low | 34.7 | Very low | 104 Ų | 104 | 145.1 Ų | 145.1 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | 86.7 | 105.5 | 126.9 | 63.6 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 29 | S | 32.9 | Very low | 34.6 | Very low | 102 Ų | 102 | 148.5 Ų | 148.5 | 71% | 0.713 | 80% | 0.802 | S | S | * | * | 54.6 | 113.9 | 123.1 | 64.8 | 0 | 0 | 0 | 0 | 122 | |||||
| 30 | S | 34.1 | Very low | 34.7 | Very low | 107 Ų | 107 | 144.2 Ų | 144.2 | 75% | 0.748 | 80% | 0.799 | S | S | * | * | trans | 51.4 | 133.1 | 130.1 | 63.1 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 31 | S | 31.6 | Very low | 34.5 | Very low | 104 Ų | 104 | 139.2 Ų | 139.2 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | trans | 104.5 | 116.4 | 136.6 | 74.6 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 32 | S | 32.6 | Very low | 34.3 | Very low | 104 Ų | 104 | 137.7 Ų | 137.7 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | trans | 67.3 | 142.2 | 136.3 | 57 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 33 | S | 32.1 | Very low | 34.4 | Very low | 102 Ų | 102 | 136.1 Ų | 136.1 | 71% | 0.713 | 79% | 0.794 | S | S | * | * | trans | 81.9 | 108.5 | 144.2 | 62 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 34 | S | 33.9 | Very low | 34.5 | Very low | 112 Ų | 112 | 132 Ų | 132 | 78% | 0.783 | 79% | 0.789 | S | S | * | * | trans | 47.2 | 119.4 | 131.6 | 63.9 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 35 | S | 33.4 | Very low | 34.5 | Very low | 127 Ų | 127 | 131.5 Ų | 131.5 | 89% | 0.888 | 79% | 0.786 | S | S | * | * | -170.5 | 167 | 116 | 59 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 36 | S | 33.8 | Very low | 34.7 | Very low | 91 Ų | 91 | 131.1 Ų | 131.1 | 64% | 0.636 | 78% | 0.783 | S | S | * | * | trans | -98.1 | 174.7 | -153 | 47.9 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 37 | R | 34.6 | Very low | 34.9 | Very low | 233 Ų | 233 | 135.8 Ų | 135.8 | 88% | 0.879 | 79% | 0.79 | S | S | * | * | trans | 90.5 | 138.5 | 163.1 | -52.1 | 160.2 | 176.3 | -174.9 | -1.7 | 113.9 | ||||
| 38 | S | 33.9 | Very low | 35 | Very low | 89 Ų | 89 | 140.4 Ų | 140.4 | 62% | 0.622 | 80% | 0.796 | S | S | * | * | cis | -178.9 | 155.9 | -17 | 55.3 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 39 | R | 34.1 | Very low | 35 | Very low | 235 Ų | 235 | 145.5 Ų | 145.5 | 89% | 0.887 | 81% | 0.805 | S | S | * | * | trans | 75.6 | 106.8 | 159.9 | -55.1 | 170.1 | -178.2 | 171.6 | 0.1 | 117.5 | ||||
| 40 | S | 37.6 | Very low | 34.9 | Very low | 125 Ų | 125 | 146.5 Ų | 146.5 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | -174.9 | 137.9 | 97.4 | 50.3 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 41 | A | 38 | Very low | 35 | Very low | 92 Ų | 92 | 146.9 Ų | 146.9 | 76% | 0.76 | 82% | 0.815 | S | S | * | * | trans | -87 | 136.8 | -170.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 42 | K | 37.6 | Very low | 35.1 | Very low | 214 Ų | 214 | 150.1 Ų | 150.1 | 93% | 0.93 | 82% | 0.824 | S | S | * | * | trans | -137.9 | 101.6 | 149.4 | -75.9 | -169.3 | 177.9 | -179.6 | 0 | 108.9 | ||||
| 43 | K | 36.9 | Very low | 35.1 | Very low | 209 Ų | 209 | 148.8 Ų | 148.8 | 91% | 0.909 | 83% | 0.827 | S | S | * | * | trans | -88.3 | 118.2 | 169.9 | -75.6 | -162 | 178.8 | -169.1 | 0 | 108.8 | ||||
| 44 | I | 40.8 | Very low | 35.2 | Very low | 163 Ų | 163 | 153.2 Ų | 153.2 | 84% | 0.836 | 83% | 0.833 | S | S | * | * | trans | -80 | 126.5 | 165.6 | -66.1 | 167.7 | 0 | 0 | 0 | 107.5 | S46 | I44-S46 PolarHBondContact O-N 3.31Š| ||
| 45 | S | 35.9 | Very low | 35.3 | Very low | 111 Ų | 111 | 155.5 Ų | 155.5 | 78% | 0.776 | 83% | 0.832 | S | S | * | * | trans | -75 | 110.5 | 179.9 | 56.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 46 | S | 36.3 | Very low | 35.5 | Very low | 114 Ų | 114 | 156.5 Ų | 156.5 | 80% | 0.797 | 82% | 0.822 | S | S | * | * | trans | -98.6 | 111.9 | 164.9 | 52.3 | 0 | 0 | 0 | 0 | 110.2 | I44 | I44-S46 PolarHBondContact O-N 3.31Š| ||
| 47 | K | 37.7 | Very low | 35.8 | Very low | 208 Ų | 208 | 161.6 Ų | 161.6 | 90% | 0.904 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 128.6 | 173 | -79.5 | 176.1 | 176.4 | 173.2 | 0 | 109.6 | ||
| 48 | K | 35.1 | Very low | 35.9 | Very low | 202 Ų | 202 | 159.6 Ų | 159.6 | 88% | 0.878 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 134.7 | 177.5 | -68 | -170.4 | 174.8 | -170.1 | 0 | 111.9 | ||
| 49 | K | 31.7 | Very low | 36.2 | Very low | 212 Ų | 212 | 165.7 Ų | 165.7 | 92% | 0.922 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 132.3 | 148.5 | -82.1 | -180 | 174.2 | 177.2 | 0 | 108.1 | ||
| 50 | S | 31.7 | Very low | 36.5 | Very low | 123 Ų | 123 | 166.3 Ų | 166.3 | 86% | 0.86 | 85% | 0.845 | S | S | * | * | trans | -111 | 112.7 | 170.4 | 57.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 51 | S | 35.2 | Very low | 36.5 | Very low | 115 Ų | 115 | 170.8 Ų | 170.8 | 80% | 0.804 | 84% | 0.843 | S | S | * | * | trans | -113.1 | 144.7 | 158.4 | 53.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 52 | D | 34 | Very low | 36.4 | Very low | 171 Ų | 171 | 172.6 Ų | 172.6 | 91% | 0.914 | 85% | 0.845 | S | S | * | * | trans | -24.9 | 134.4 | 179.8 | -84.3 | -73.9 | 0 | 0 | 0 | 118.3 | ||||
| 53 | G | 32.9 | Very low | 36.1 | Very low | 77 Ų | 77 | 174.6 Ų | 174.6 | 79% | 0.794 | 85% | 0.846 | S | S | * | * | trans | -174.8 | 103.9 | 166.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 54 | K | 33.9 | Very low | 36 | Very low | 194 Ų | 194 | 170 Ų | 170 | 84% | 0.843 | 84% | 0.841 | S | S | * | * | trans | -63.5 | 153.8 | 178.9 | -69.8 | 170.7 | 174.4 | 171.1 | 0 | 112 | ||||
| 55 | E | 36.1 | Very low | 35.8 | Very low | 160 Ų | 160 | 167.5 Ų | 167.5 | 75% | 0.748 | 84% | 0.838 | S | S | * | * | trans | 72.9 | 101 | 143.9 | -110.1 | 173.8 | 155.8 | 0 | 0 | 118.8 | ||||
| 56 | Q | 38.2 | Very low | 35.7 | Very low | 149 Ų | 149 | 167.7 Ų | 167.7 | 70% | 0.696 | 84% | 0.839 | S | S | * | * | 159.2 | 127.1 | 97.8 | -81.4 | -165 | -1.9 | 0 | 0 | 110 | K58 | Q56-K58 PolarHBondContact O-N 2.92Š| |||
| 57 | Q | 40.1 | Very low | 35.5 | Very low | 197 Ų | 197 | 167.3 Ų | 167.3 | 92% | 0.921 | 84% | 0.836 | S | S | * | * | trans | -58.8 | 117.2 | 171.1 | -71.1 | -172.6 | -8 | 0 | 0 | 109.9 | ||||
| 58 | K | 36.4 | Very low | 35.4 | Very low | 192 Ų | 192 | 162.4 Ų | 162.4 | 84% | 0.835 | 83% | 0.828 | S | S | * | * | trans | -111.7 | 115.1 | 165 | -76.5 | -170.9 | 178.1 | -178.2 | 0 | 110.4 | Q56 | Q56-K58 PolarHBondContact O-N 2.92Š| ||
| 59 | R | 39.6 | Very low | 35.5 | Very low | 217 Ų | 217 | 157.6 Ų | 157.6 | 82% | 0.819 | 82% | 0.82 | S | S | * | * | trans | -54 | 133.4 | 173.7 | -66.6 | 174.5 | 167.2 | -175.6 | -6.5 | 109.9 | R61 | R59-R61 PolarHBondContact O-N 2.88Š| ||
| 60 | R | 40.2 | Very low | 35.6 | Very low | 247 Ų | 247 | 153.9 Ų | 153.9 | 93% | 0.932 | 82% | 0.815 | S | S | * | * | trans | -58.6 | 118.5 | 166.1 | -76.3 | 173.7 | 151.4 | 179.1 | -7.2 | 109 | ||||
| 61 | R | 38.4 | Very low | 35.9 | Very low | 220 Ų | 220 | 152.7 Ų | 152.7 | 83% | 0.83 | 81% | 0.807 | S | S | * | * | trans | -139.2 | 146.3 | 157.4 | -76.3 | -165.3 | 172.9 | 143.2 | -4.1 | 111.2 | R59 | R59-R61 PolarHBondContact O-N 2.88Š| ||
| 62 | T | 35 | Very low | 36 | Very low | 129 Ų | 129 | 151.8 Ų | 151.8 | 79% | 0.791 | 80% | 0.801 | S | S | * | * | trans | -59.4 | 153.5 | -168 | 41 | 0 | 0 | 0 | 0 | 113.9 | S64 | T62-S64 PolarHBondContact O-N 3.3Š| ||
| 63 | R | 32.4 | Very low | 36.2 | Very low | 256 Ų | 256 | 148.8 Ų | 148.8 | 97% | 0.966 | 79% | 0.793 | S | S | * | * | trans | -70.2 | 121.7 | 173.9 | -64.9 | 173.3 | 175.4 | 170.8 | -3.9 | 109.2 | ||||
| 64 | S | 35.4 | Very low | 36.5 | Very low | 112 Ų | 112 | 149.7 Ų | 149.7 | 78% | 0.783 | 79% | 0.788 | S | S | * | * | trans | -140.7 | 135.1 | 156.5 | 35.2 | 0 | 0 | 0 | 0 | 108.8 | T62 | T62-S64 PolarHBondContact O-N 3.3Š| ||
| 65 | S | 36 | Very low | 36.8 | Very low | 112 Ų | 112 | 145.5 Ų | 145.5 | 78% | 0.783 | 78% | 0.782 | S | S | * | * | trans | -63.8 | 138.7 | 179.1 | 45.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 66 | S | 32.7 | Very low | 36.8 | Very low | 115 Ų | 115 | 143.6 Ų | 143.6 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | 162.3 | 148.7 | 121.2 | 56.9 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 67 | S | 33.8 | Very low | 36.8 | Very low | 105 Ų | 105 | 142.1 Ų | 142.1 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | trans | -7.5 | 157.6 | 164.1 | 51.1 | 0 | 0 | 0 | 0 | 124.9 | ||||
| 68 | S | 35.2 | Very low | 36.8 | Very low | 105 Ų | 105 | 138.2 Ų | 138.2 | 73% | 0.734 | 79% | 0.787 | S | S | * | * | trans | 83.5 | 109.1 | 142.4 | 52 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 69 | S | 36.5 | Very low | 37 | Very low | 102 Ų | 102 | 134.9 Ų | 134.9 | 71% | 0.713 | 79% | 0.789 | S | S | * | * | trans | 23.3 | 150.9 | 131.2 | 57.7 | 0 | 0 | 0 | 0 | 125.2 | ||||
| 70 | T | 34.8 | Very low | 37.1 | Very low | 133 Ų | 133 | 129.5 Ų | 129.5 | 82% | 0.816 | 78% | 0.784 | S | S | * | * | trans | 72.7 | 148.5 | 159.2 | 70.6 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 71 | S | 36.3 | Very low | 37.4 | Very low | 99 Ų | 99 | 124.1 Ų | 124.1 | 69% | 0.692 | 78% | 0.784 | S | S | * | * | cis | -172.9 | 150 | -13.6 | 42.1 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 72 | S | 38.7 | Very low | 37.3 | Very low | 96 Ų | 96 | 117.9 Ų | 117.9 | 67% | 0.671 | 77% | 0.774 | S | S | * | * | trans | 43.8 | 140.5 | 145.9 | 57.3 | 0 | 0 | 0 | 0 | 124.9 | ||||
| 73 | S | 38.2 | Very low | 38.2 | Very low | 107 Ų | 107 | 115.9 Ų | 115.9 | 75% | 0.748 | 77% | 0.765 | S | S | * | * | trans | 67.1 | 148.9 | 139.8 | 54.4 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 74 | S | 38.1 | Very low | 39.5 | Very low | 97 Ų | 97 | 108.5 Ų | 108.5 | 68% | 0.678 | 75% | 0.752 | S | S | * | * | cis | -176.2 | 155.6 | -0.6 | 37.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 75 | S | 40.2 | Very low | 40.7 | Very low | 105 Ų | 105 | 108 Ų | 108 | 73% | 0.734 | 74% | 0.741 | S | S | * | * | trans | 46.7 | 125.5 | 145.1 | 57.8 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 76 | S | 35.6 | Very low | 41.9 | Very low | 121 Ų | 121 | 107 Ų | 107 | 85% | 0.846 | 72% | 0.724 | S | S | * | * | trans | -153.8 | 131.6 | 133.1 | -14.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 77 | S | 40 | Very low | 43.3 | Very low | 118 Ų | 118 | 108.5 Ų | 108.5 | 83% | 0.825 | 71% | 0.712 | S | S | * | * | trans | -67 | 152.6 | 177.6 | 20.2 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 78 | S | 38.5 | Very low | 44.8 | Very low | 114 Ų | 114 | 112.7 Ų | 112.7 | 80% | 0.797 | 71% | 0.712 | S | S | * | * | trans | -146.7 | 111 | 154.8 | -13.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 79 | S | 40.4 | Very low | 46.3 | Very low | 123 Ų | 123 | 114.1 Ų | 114.1 | 86% | 0.86 | 70% | 0.704 | S | S | * | * | trans | -56.6 | 136.6 | 167.8 | 35.2 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 80 | S | 42.1 | Very low | 47.9 | Very low | 104 Ų | 104 | 116.5 Ų | 116.5 | 73% | 0.727 | 70% | 0.698 | S | S | * | * | trans | -142.5 | 103.3 | 162.2 | 50.9 | 0 | 0 | 0 | 0 | 110.5 | C82 | S80-C82 PolarHBondContact O-N 2.88Å; S80-C82 VanDerWaalsContact O-N 3.13Å | ||
| 81 | S | 47 | Very low | 49.7 | Very low | 133 Ų | 133 | 115.8 Ų | 115.8 | 93% | 0.93 | 68% | 0.683 | S | S | * | * | trans | -62.9 | 100.2 | 164.9 | 40.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 82 | C | 36.4 | Very low | 51.4 | Low | 90 Ų | 90 | 118 Ų | 118 | 61% | 0.608 | 68% | 0.681 | S | S | * | * | trans | -102.7 | 109.4 | 178.2 | 61.7 | 0 | 0 | 0 | 0 | 111.1 | S80 S84 | S80-C82 PolarHBondContact O-N 2.88Å; S80-C82 VanDerWaalsContact O-N 3.13Å; C82-S84 PolarHBondContact O-N 3.38Å | ||
| 83 | S | 54.2 | Low | 53.1 | Low | 87 Ų | 87 | 116.9 Ų | 116.9 | 61% | 0.608 | 67% | 0.672 | S | S | * | * | trans | -45.4 | 130.8 | 171.4 | 176.5 | 0 | 0 | 0 | 0 | 112 | D85 E86 | S83-D85 PolarHBondContact O-N 3.12Å; S83-D85 VanDerWaalsContact O-N 3.08Å; S83-E86 PolarHBondContact O-N 3.39Å | ||
| 84 | S | 59.3 | Low | 55 | Low | 100 Ų | 100 | 118.5 Ų | 118.5 | 70% | 0.699 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -56.3 | -25.8 | -171.3 | -73.3 | 0 | 0 | 0 | 0 | 114.4 | C82 R87 R88 | C82-S84 PolarHBondContact O-N 3.38Å; S84-R87 PolarHBondContact O-N 3.38Å; S84-R88 PolarHBondContact O-N 2.86Å |
| 85 | D | 61 | Low | 57 | Low | 103 Ų | 103 | 116.2 Ų | 116.2 | 55% | 0.551 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -69.6 | -40.9 | -179.8 | -106.1 | -66.3 | 0 | 0 | 0 | 113.5 | S83 R87 R88 K89 | S83-D85 PolarHBondContact O-N 3.12Å; S83-D85 VanDerWaalsContact O-N 3.08Å; D85-R87 VanDerWaalsContact C-N 3.29Å; D85-R87 PolarHBondContact O-N 3.4Å; D85-R88 PolarHBondContact O-N 3.13Å; D85-K89 PolarHBondContact O-N 3.13Å |
| 86 | E | 60.7 | Low | 59.1 | Low | 89 Ų | 89 | 118 Ų | 118 | 42% | 0.416 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -64.6 | -36.6 | 175.7 | -88.1 | -60.4 | 119.4 | 0 | 0 | 111.3 | S83 R88 R90 | S83-E86 PolarHBondContact O-N 3.39Å; E86-R88 VanDerWaalsContact C-N 3.35Å; E86-R88 PolarHBondContact O-N 3.28Å; E86-R90 WeakPolarHBondContact O-CB 3.19Å; E86-R90 WeakPolarHBondContact O-CG 3.27Å; E86-R90 PolarHBondContact O-N 3.24Å; E86-R90 IonicContact OE2-NE 3.57Å; E86-R90 IonicContact OE2-NH2 3.32Å |
| 87 | R | 61.3 | Low | 61.4 | Low | 147 Ų | 147 | 120.1 Ų | 120.1 | 56% | 0.555 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -65.4 | -38 | 176.4 | -164.2 | 175.1 | -176.6 | -129.9 | 6.7 | 111.5 | S84 D85 K91 | S84-R87 PolarHBondContact O-N 3.38Å; D85-R87 VanDerWaalsContact C-N 3.29Å; D85-R87 PolarHBondContact O-N 3.4Å; R87-K91 WeakPolarHBondContact O-CB 3.18Å; R87-K91 VanDerWaalsContact O-CG 3.29Å; R87-K91 WeakPolarHBondContact O-CG 3.48Å; R87-K91 PolarHBondContact O-N 3.26Å |
| 88 | R | 66.1 | Low | 63.5 | Low | 194 Ų | 194 | 121.6 Ų | 121.6 | 73% | 0.732 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -70.8 | -42.8 | 179 | -160.8 | 175.4 | -177.2 | -174.2 | 1.3 | 111.8 | S84 D85 E86 K91 K92 | S84-R88 PolarHBondContact O-N 2.86Å; D85-R88 PolarHBondContact O-N 3.13Å; E86-R88 VanDerWaalsContact C-N 3.35Å; E86-R88 PolarHBondContact O-N 3.28Å; R88-K91 PolarHBondContact O-N 3.29Å; R88-K92 PolarHBondContact O-N 3.45Å |
| 89 | K | 68 | Low | 65.8 | Low | 134 Ų | 134 | 121.6 Ų | 121.6 | 58% | 0.583 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -60.9 | -44.1 | 173.2 | -69.9 | 179.8 | -175.6 | 173.7 | 0 | 111.9 | D85 K91 K92 S93 | D85-K89 PolarHBondContact O-N 3.13Å; K89-K91 PolarHBondContact O-N 2.96Å; K89-K92 PolarHBondContact O-N 2.97Å; K89-S93 PolarHBondContact O-N 3.49Å; K89-S93 PolarHBondContact O-OG 3.15Å |
| 90 | R | 69.4 | Low | 68.2 | Low | 152 Ų | 152 | 123.8 Ų | 123.8 | 57% | 0.574 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -63.9 | -35.7 | 174.5 | -70.8 | 171.8 | -174.1 | -159.2 | -2 | 113.1 | E86 S93 K94 | E86-R90 WeakPolarHBondContact O-CB 3.19Å; E86-R90 WeakPolarHBondContact O-CG 3.27Å; E86-R90 PolarHBondContact O-N 3.24Å; E86-R90 IonicContact OE2-NE 3.57Å; E86-R90 IonicContact OE2-NH2 3.32Å; R90-S93 PolarHBondContact O-OG 3.36Å; R90-K94 WeakPolarHBondContact O-CB 3.49Å; R90-K94 WeakPolarHBondContact O-CG 3.38Å; R90-K94 PolarHBondContact O-N 3.14Å; R90-K94 VanDerWaalsContact O-N 3.14Å |
| 91 | K | 72.3 | Confident | 70.4 | Confident | 119 Ų | 119 | 125.7 Ų | 125.7 | 52% | 0.517 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -67.6 | -42.8 | 174.3 | -77.2 | 176.6 | -179.9 | -176.9 | 0 | 111.7 | R87 R88 K89 K94 A95 | R87-K91 WeakPolarHBondContact O-CB 3.18Å; R87-K91 VanDerWaalsContact O-CG 3.29Å; R87-K91 WeakPolarHBondContact O-CG 3.48Å; R87-K91 PolarHBondContact O-N 3.26Å; R88-K91 PolarHBondContact O-N 3.29Å; K89-K91 PolarHBondContact O-N 2.96Å; K91-K94 PolarHBondContact O-N 3.44Å; K91-A95 PolarHBondContact O-N 3.47Å |
| 92 | K | 73.1 | Confident | 72.4 | Confident | 146 Ų | 146 | 124.9 Ų | 124.9 | 64% | 0.635 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -65.1 | -40.5 | 178 | -166.2 | 172.8 | -176.6 | 176.1 | 0 | 112.2 | R88 K89 A95 K96 | R88-K92 PolarHBondContact O-N 3.45Å; K89-K92 PolarHBondContact O-N 2.97Å; K92-A95 PolarHBondContact O-N 3.03Å; K92-K96 WeakPolarHBondContact O-CG 3.4Å; K92-K96 PolarHBondContact O-N 2.92Å |
| 93 | S | 73.1 | Confident | 75.1 | Confident | 71 Ų | 71 | 128.5 Ų | 128.5 | 50% | 0.497 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -67.3 | -39.5 | 175.9 | 69.1 | 0 | 0 | 0 | 0 | 112.5 | K89 R90 A95 K96 K97 | K89-S93 PolarHBondContact O-N 3.49Å; K89-S93 PolarHBondContact O-OG 3.15Å; R90-S93 PolarHBondContact O-OG 3.36Å; S93-A95 PolarHBondContact O-N 3.24Å; S93-K96 PolarHBondContact O-N 3.09Å; S93-K97 PolarHBondContact O-N 3.33Å |
| 94 | K | 78.4 | Confident | 76.9 | Confident | 142 Ų | 142 | 127.3 Ų | 127.3 | 62% | 0.617 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -61.9 | -40.9 | 172.7 | -74.1 | 175.1 | -177.7 | -175.5 | 0 | 112.1 | R90 K91 K97 K98 | R90-K94 WeakPolarHBondContact O-CB 3.49Å; R90-K94 WeakPolarHBondContact O-CG 3.38Å; R90-K94 PolarHBondContact O-N 3.14Å; R90-K94 VanDerWaalsContact O-N 3.14Å; K91-K94 PolarHBondContact O-N 3.44Å; K94-K97 PolarHBondContact O-N 3.1Å; K94-K98 WeakPolarHBondContact O-CG 3.48Å; K94-K98 PolarHBondContact O-N 3.08Å |
| 95 | A | 81.1 | Confident | 78.5 | Confident | 48 Ų | 48 | 128.7 Ų | 128.7 | 40% | 0.397 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -64.6 | -46.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | K91 K92 S93 K97 K98 L99 | K91-A95 PolarHBondContact O-N 3.47Å; K92-A95 PolarHBondContact O-N 3.03Å; S93-A95 PolarHBondContact O-N 3.24Å; A95-K97 VanDerWaalsContact C-N 3.3Å; A95-K97 PolarHBondContact O-N 2.96Å; A95-K98 PolarHBondContact O-N 3.21Å; A95-K98 VanDerWaalsContact O-N 3.13Å; A95-L99 PolarHBondContact O-N 2.96Å |
| 96 | K | 83.2 | Confident | 80 | Confident | 142 Ų | 142 | 128.8 Ų | 128.8 | 62% | 0.617 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -57.9 | -40.5 | 174.5 | -72.5 | -176.8 | 177.9 | -172.2 | 0 | 112.2 | K92 S93 L99 K100 | K92-K96 WeakPolarHBondContact O-CG 3.4Å; K92-K96 PolarHBondContact O-N 2.92Å; S93-K96 PolarHBondContact O-N 3.09Å; K96-L99 PolarHBondContact O-N 3.35Å; K96-K100 PolarHBondContact O-N 3.12Å |
| 97 | K | 83.3 | Confident | 81.6 | Confident | 167 Ų | 167 | 132.5 Ų | 132.5 | 73% | 0.726 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -65.5 | -38.8 | 176.3 | -169.5 | 173.8 | -178.2 | 175.1 | 0 | 112.4 | S93 K94 A95 K101 | S93-K97 PolarHBondContact O-N 3.33Å; K94-K97 PolarHBondContact O-N 3.1Å; A95-K97 VanDerWaalsContact C-N 3.3Å; A95-K97 PolarHBondContact O-N 2.96Å; K97-K101 PolarHBondContact O-N 3.2Å; K97-K101 VanDerWaalsContact O-N 3.12Å |
| 98 | K | 84.3 | Confident | 83.1 | Confident | 149 Ų | 149 | 132.3 Ų | 132.3 | 65% | 0.648 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -64.6 | -45 | 175.4 | -73.5 | -179.3 | -179.7 | -172.8 | 0 | 111.8 | K94 A95 K101 Q102 | K94-K98 WeakPolarHBondContact O-CG 3.48Å; K94-K98 PolarHBondContact O-N 3.08Å; A95-K98 PolarHBondContact O-N 3.21Å; A95-K98 VanDerWaalsContact O-N 3.13Å; K98-K101 WeakPolarHBondContact O-CB 3.48Å; K98-K101 PolarHBondContact O-N 3.06Å; K98-Q102 PolarHBondContact O-N 3.02Å |
| 99 | L | 87.7 | Confident | 84.3 | Confident | 113 Ų | 113 | 128.3 Ų | 128.3 | 59% | 0.592 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -61.8 | -44.4 | 176.9 | -72.3 | 166.5 | 0 | 0 | 0 | 112.1 | A95 K96 K101 Q102 K103 | A95-L99 PolarHBondContact O-N 2.96Å; K96-L99 PolarHBondContact O-N 3.35Å; L99-K101 VanDerWaalsContact C-N 3.29Å; L99-K101 PolarHBondContact O-N 3.46Å; L99-Q102 PolarHBondContact O-N 3.13Å; L99-K103 PolarHBondContact O-N 3.04Å |
| 100 | K | 90.4 | Very high | 85.6 | Confident | 169 Ų | 169 | 131.2 Ų | 131.2 | 74% | 0.735 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -60.1 | -39.2 | 175.4 | -168.5 | 174.3 | -178.5 | 177 | 0 | 111.8 | K96 A104 | K96-K100 PolarHBondContact O-N 3.12Å; K100-A104 WeakPolarHBondContact O-CB 3.34Å; K100-A104 PolarHBondContact O-N 3.34Å; K100-A104 VanDerWaalsContact O-N 3.08Å |
| 101 | K | 89.1 | Confident | 86.7 | Confident | 144 Ų | 144 | 131 Ų | 131 | 63% | 0.626 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -66.7 | -41 | 176.3 | -168 | 176.9 | -175.9 | 179 | 0 | 112.1 | K97 K98 L99 K105 | K97-K101 PolarHBondContact O-N 3.2Å; K97-K101 VanDerWaalsContact O-N 3.12Å; K98-K101 WeakPolarHBondContact O-CB 3.48Å; K98-K101 PolarHBondContact O-N 3.06Å; L99-K101 VanDerWaalsContact C-N 3.29Å; L99-K101 PolarHBondContact O-N 3.46Å; K101-K105 WeakPolarHBondContact O-CG 3.36Å; K101-K105 PolarHBondContact O-N 3.4Å; K101-K105 VanDerWaalsContact O-N 3.09Å |
| 102 | Q | 88.9 | Confident | 87.7 | Confident | 117 Ų | 117 | 131.3 Ų | 131.3 | 55% | 0.547 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -66 | -45.6 | 175.9 | -75.3 | 178.4 | -16 | 0 | 0 | 111.8 | K98 L99 A104 K105 L106 | K98-Q102 PolarHBondContact O-N 3.02Å; L99-Q102 PolarHBondContact O-N 3.13Å; Q102-A104 VanDerWaalsContact C-N 3.3Å; Q102-A104 PolarHBondContact O-N 3.05Å; Q102-K105 WeakPolarHBondContact O-CB 3.48Å; Q102-K105 PolarHBondContact O-N 3.43Å; Q102-K105 VanDerWaalsContact O-N 3.09Å; Q102-L106 PolarHBondContact O-N 3.37Å |
| 103 | K | 92.4 | Very high | 88.6 | Confident | 166 Ų | 166 | 129.9 Ų | 129.9 | 72% | 0.722 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -58.7 | -40.7 | 176.1 | -168.4 | 174.1 | -177.1 | 175 | 0 | 112.2 | L99 K107 | L99-K103 PolarHBondContact O-N 3.04Å; K103-K107 WeakPolarHBondContact O-CB 3.42Å; K103-K107 PolarHBondContact O-N 3.5Å |
| 104 | A | 91.6 | Very high | 89.6 | Confident | 61 Ų | 61 | 133.1 Ų | 133.1 | 50% | 0.504 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -65.4 | -39.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | K100 Q102 K108 | K100-A104 WeakPolarHBondContact O-CB 3.34Å; K100-A104 PolarHBondContact O-N 3.34Å; K100-A104 VanDerWaalsContact O-N 3.08Å; Q102-A104 VanDerWaalsContact C-N 3.3Å; Q102-A104 PolarHBondContact O-N 3.05Å; A104-K108 PolarHBondContact O-N 3.03Å; A104-K108 VanDerWaalsContact O-N 3.1Å |
| 105 | K | 93.3 | Very high | 90.3 | Very high | 129 Ų | 129 | 133.2 Ų | 133.2 | 56% | 0.561 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -63.8 | -47 | 175.3 | -76 | -178.9 | 174.9 | -168.2 | 0 | 111.9 | K101 Q102 K107 K108 Q109 | K101-K105 WeakPolarHBondContact O-CG 3.36Å; K101-K105 PolarHBondContact O-N 3.4Å; K101-K105 VanDerWaalsContact O-N 3.09Å; Q102-K105 WeakPolarHBondContact O-CB 3.48Å; Q102-K105 PolarHBondContact O-N 3.43Å; Q102-K105 VanDerWaalsContact O-N 3.09Å; K105-K107 PolarHBondContact O-N 3.38Å; K105-K108 WeakPolarHBondContact O-CB 3.49Å; K105-K108 PolarHBondContact O-N 3.14Å; K105-K108 VanDerWaalsContact O-N 3.14Å; K105-Q109 PolarHBondContact O-N 3.48Å |
| 106 | L | 92.9 | Very high | 90.8 | Very high | 106 Ų | 106 | 137.9 Ų | 137.9 | 56% | 0.555 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -61.8 | -42 | 177.7 | -69 | 172.9 | 0 | 0 | 0 | 111.8 | Q102 K108 Q109 R110 | Q102-L106 PolarHBondContact O-N 3.37Å; L106-K108 VanDerWaalsContact C-N 3.29Å; L106-K108 PolarHBondContact O-N 3.03Å; L106-Q109 PolarHBondContact O-N 2.98Å; L106-R110 PolarHBondContact O-N 3Å |
| 107 | K | 93.7 | Very high | 91.2 | Very high | 167 Ų | 167 | 136.7 Ų | 136.7 | 73% | 0.726 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -61.2 | -37.4 | 174.9 | -167.5 | 176.2 | -177.6 | 178.3 | 0 | 112 | K103 K105 K111 | K103-K107 WeakPolarHBondContact O-CB 3.42Å; K103-K107 PolarHBondContact O-N 3.5Å; K105-K107 PolarHBondContact O-N 3.38Å; K107-K111 PolarHBondContact O-N 2.97Å; K107-K111 VanDerWaalsContact O-N 3.15Å |
| 108 | K | 93.2 | Very high | 91.6 | Very high | 143 Ų | 143 | 134.5 Ų | 134.5 | 62% | 0.622 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -69 | -40 | 176.3 | -169.9 | 175.9 | -177.3 | 176.9 | 0 | 112.1 | A104 K105 L106 K111 K112 | A104-K108 PolarHBondContact O-N 3.03Å; A104-K108 VanDerWaalsContact O-N 3.1Å; K105-K108 WeakPolarHBondContact O-CB 3.49Å; K105-K108 PolarHBondContact O-N 3.14Å; K105-K108 VanDerWaalsContact O-N 3.14Å; L106-K108 VanDerWaalsContact C-N 3.29Å; L106-K108 PolarHBondContact O-N 3.03Å; K108-K111 PolarHBondContact O-N 2.98Å; K108-K112 WeakPolarHBondContact O-CG 3.47Å; K108-K112 PolarHBondContact O-N 3.06Å |
| 109 | Q | 91.4 | Very high | 91.8 | Very high | 110 Ų | 110 | 134.2 Ų | 134.2 | 51% | 0.514 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -64.9 | -49.5 | 176.4 | -75.8 | 174.3 | -24 | 0 | 0 | 111.4 | K105 L106 K111 K112 E113 | K105-Q109 PolarHBondContact O-N 3.48Å; L106-Q109 PolarHBondContact O-N 2.98Å; Q109-K111 VanDerWaalsContact C-N 3.3Å; Q109-K111 PolarHBondContact O-N 3.02Å; Q109-K112 WeakPolarHBondContact O-CA 3.42Å; Q109-K112 WeakPolarHBondContact O-CB 3.49Å; Q109-K112 PolarHBondContact O-N 3.32Å; Q109-E113 PolarHBondContact O-N 3.21Å |
| 110 | R | 94.1 | Very high | 91.9 | Very high | 195 Ų | 195 | 135.5 Ų | 135.5 | 74% | 0.736 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -55.1 | -41.2 | 174.6 | -78.3 | -175.6 | 160 | -171 | -4.3 | 113.1 | L106 K112 E113 K114 | L106-R110 PolarHBondContact O-N 3Å; R110-K112 VanDerWaalsContact C-N 3.33Å; R110-K112 PolarHBondContact O-N 3.47Å; R110-E113 PolarHBondContact O-N 3.24Å; R110-K114 WeakPolarHBondContact O-CB 3.46Å; R110-K114 PolarHBondContact O-N 3.2Å |
| 111 | K | 93.8 | Very high | 91.9 | Very high | 146 Ų | 146 | 132 Ų | 132 | 64% | 0.635 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -65.3 | -35.1 | 176.5 | -168.9 | 175.5 | -177 | 177.1 | 0 | 112.2 | K107 K108 Q109 K115 | K107-K111 PolarHBondContact O-N 2.97Å; K107-K111 VanDerWaalsContact O-N 3.15Å; K108-K111 PolarHBondContact O-N 2.98Å; Q109-K111 VanDerWaalsContact C-N 3.3Å; Q109-K111 PolarHBondContact O-N 3.02Å; K111-K115 WeakPolarHBondContact O-CG 3.41Å; K111-K115 PolarHBondContact O-N 3.47Å |
| 112 | K | 92.4 | Very high | 91.8 | Very high | 127 Ų | 127 | 132.3 Ų | 132.3 | 55% | 0.552 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -70.6 | -44.3 | 176.2 | -74 | -179.1 | 174.3 | -167.9 | 0 | 111.4 | K108 Q109 R110 K115 K116 | K108-K112 WeakPolarHBondContact O-CG 3.47Å; K108-K112 PolarHBondContact O-N 3.06Å; Q109-K112 WeakPolarHBondContact O-CA 3.42Å; Q109-K112 WeakPolarHBondContact O-CB 3.49Å; Q109-K112 PolarHBondContact O-N 3.32Å; R110-K112 VanDerWaalsContact C-N 3.33Å; R110-K112 PolarHBondContact O-N 3.47Å; K112-K115 PolarHBondContact O-N 3.4Å; K112-K116 WeakPolarHBondContact O-CG 3.48Å; K112-K116 PolarHBondContact O-N 3.43Å |
| 113 | E | 92.3 | Very high | 91.6 | Very high | 115 Ų | 115 | 133.1 Ų | 133.1 | 54% | 0.537 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -63 | -45.9 | 177.5 | -74.2 | 169.3 | 179.6 | 0 | 0 | 111.7 | Q109 R110 K115 K116 L117 | Q109-E113 PolarHBondContact O-N 3.21Å; R110-E113 PolarHBondContact O-N 3.24Å; E113-K115 VanDerWaalsContact C-N 3.25Å; E113-K115 PolarHBondContact O-N 3.08Å; E113-K116 PolarHBondContact O-N 3.22Å; E113-L117 WeakPolarHBondContact O-CG 3.2Å; E113-L117 PolarHBondContact O-N 2.9Å |
| 114 | K | 94.3 | Very high | 91.3 | Very high | 139 Ų | 139 | 130.1 Ų | 130.1 | 60% | 0.604 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -57.7 | -37.2 | 174.9 | -170.5 | 171 | -176.6 | 171.3 | 0 | 112.5 | R110 K118 | R110-K114 WeakPolarHBondContact O-CB 3.46Å; R110-K114 PolarHBondContact O-N 3.2Å; K114-K118 WeakPolarHBondContact O-CG 3.42Å; K114-K118 PolarHBondContact O-N 3.3Å; K114-K118 VanDerWaalsContact O-N 3.13Å |
| 115 | K | 92.1 | Very high | 90.9 | Very high | 144 Ų | 144 | 135.1 Ų | 135.1 | 63% | 0.626 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -69.3 | -39.4 | 174.6 | -76.5 | -174.1 | 175.4 | -162.2 | 0 | 112.5 | K111 K112 E113 K119 | K111-K115 WeakPolarHBondContact O-CG 3.41Å; K111-K115 PolarHBondContact O-N 3.47Å; K112-K115 PolarHBondContact O-N 3.4Å; E113-K115 VanDerWaalsContact C-N 3.25Å; E113-K115 PolarHBondContact O-N 3.08Å; K115-K119 PolarHBondContact O-N 2.9Å |
| 116 | K | 91.8 | Very high | 90.2 | Very high | 147 Ų | 147 | 136.1 Ų | 136.1 | 64% | 0.639 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -65.3 | -45.6 | 177 | -73.3 | -177.3 | 177.1 | -171.5 | 0 | 111.4 | K112 E113 K119 K120 | K112-K116 WeakPolarHBondContact O-CG 3.48Å; K112-K116 PolarHBondContact O-N 3.43Å; E113-K116 PolarHBondContact O-N 3.22Å; K116-K119 PolarHBondContact O-N 3.45Å; K116-K119 VanDerWaalsContact O-N 3.16Å; K116-K120 PolarHBondContact O-N 3.32Å |
| 117 | L | 91.9 | Very high | 89.4 | Confident | 117 Ų | 117 | 136.7 Ų | 136.7 | 61% | 0.613 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -60.7 | -47.1 | 177 | -69.3 | 172.3 | 0 | 0 | 0 | 111.3 | E113 K119 K120 E121 | E113-L117 WeakPolarHBondContact O-CG 3.2Å; E113-L117 PolarHBondContact O-N 2.9Å; L117-K119 VanDerWaalsContact C-N 3.28Å; L117-K119 PolarHBondContact O-N 3.45Å; L117-K120 PolarHBondContact O-N 3.01Å; L117-K120 VanDerWaalsContact O-N 3.13Å; L117-E121 PolarHBondContact O-N 2.91Å |
| 118 | K | 92.7 | Very high | 88.6 | Confident | 121 Ų | 121 | 132.2 Ų | 132.2 | 53% | 0.526 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -58.7 | -35.7 | 173.7 | -75.6 | -171.9 | 173.9 | -155.2 | 0 | 113.6 | K114 K122 | K114-K118 WeakPolarHBondContact O-CG 3.42Å; K114-K118 PolarHBondContact O-N 3.3Å; K114-K118 VanDerWaalsContact O-N 3.13Å; K118-K122 WeakPolarHBondContact O-CB 3.29Å; K118-K122 WeakPolarHBondContact O-CG 3.19Å; K118-K122 PolarHBondContact O-N 3.24Å; K118-K122 VanDerWaalsContact O-N 3.12Å |
| 119 | K | 88.6 | Confident | 87.6 | Confident | 142 Ų | 142 | 131.8 Ų | 131.8 | 62% | 0.617 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -71.7 | -38.4 | 176.8 | -169.8 | 176.7 | -179.2 | -179.1 | 0 | 111.5 | K115 K116 L117 K123 | K115-K119 PolarHBondContact O-N 2.9Å; K116-K119 PolarHBondContact O-N 3.45Å; K116-K119 VanDerWaalsContact O-N 3.16Å; L117-K119 VanDerWaalsContact C-N 3.28Å; L117-K119 PolarHBondContact O-N 3.45Å; K119-K123 WeakPolarHBondContact O-CG 3.33Å; K119-K123 PolarHBondContact O-N 3.04Å; K119-K123 VanDerWaalsContact O-N 3.16Å |
| 120 | K | 88.2 | Confident | 86.5 | Confident | 141 Ų | 141 | 129.9 Ų | 129.9 | 61% | 0.613 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -66 | -46.7 | 174.8 | -72.8 | -172 | 173.9 | -165.1 | 0 | 111.4 | K116 L117 K122 K123 L124 | K116-K120 PolarHBondContact O-N 3.32Å; L117-K120 PolarHBondContact O-N 3.01Å; L117-K120 VanDerWaalsContact O-N 3.13Å; K120-K122 VanDerWaalsContact C-N 3.33Å; K120-K122 PolarHBondContact O-N 2.94Å; K120-K123 WeakPolarHBondContact O-CB 3.34Å; K120-K123 PolarHBondContact O-N 3.16Å; K120-L124 WeakPolarHBondContact O-CG 3.35Å; K120-L124 PolarHBondContact O-N 2.93Å |
| 121 | E | 90.9 | Very high | 85.1 | Confident | 95 Ų | 95 | 127.4 Ų | 127.4 | 44% | 0.444 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -58.9 | -43.3 | 176.8 | -169.1 | -168.1 | 162 | 0 | 0 | 111.8 | L117 K123 L124 R125 | L117-E121 PolarHBondContact O-N 2.91Å; E121-K123 VanDerWaalsContact C-N 3.3Å; E121-K123 PolarHBondContact O-N 2.91Å; E121-L124 PolarHBondContact O-N 3.1Å; E121-R125 WeakPolarHBondContact O-CB 3.46Å; E121-R125 WeakPolarHBondContact O-CG 3.46Å; E121-R125 PolarHBondContact O-N 3.16Å; E121-R125 IonicContact OE1-CZ 3.55Å; E121-R125 IonicContact OE1-NE 3.31Å; E121-R125 PolarHBondContact OE1-NE 3.07Å; E121-R125 IonicContact OE1-NH2 2.94Å; E121-R125 PolarHBondContact OE1-NH2 3.03Å |
| 122 | K | 87.8 | Confident | 83.4 | Confident | 151 Ų | 151 | 127.8 Ų | 127.8 | 66% | 0.657 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -63.8 | -31.8 | 174.6 | -76.9 | -173.2 | 176.7 | -158.1 | 0 | 113.8 | K118 K120 K126 | K118-K122 WeakPolarHBondContact O-CB 3.29Å; K118-K122 WeakPolarHBondContact O-CG 3.19Å; K118-K122 PolarHBondContact O-N 3.24Å; K118-K122 VanDerWaalsContact O-N 3.12Å; K120-K122 VanDerWaalsContact C-N 3.33Å; K120-K122 PolarHBondContact O-N 2.94Å; K122-K126 WeakPolarHBondContact O-CG 3.48Å; K122-K126 PolarHBondContact O-N 3Å |
| 123 | K | 85.1 | Confident | 81.3 | Confident | 133 Ų | 133 | 131 Ų | 131 | 58% | 0.578 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -71.5 | -48.7 | 175.7 | -77.1 | -178 | 167 | -146.2 | 0 | 110.7 | K119 K120 E121 R125 K126 E127 | K119-K123 WeakPolarHBondContact O-CG 3.33Å; K119-K123 PolarHBondContact O-N 3.04Å; K119-K123 VanDerWaalsContact O-N 3.16Å; K120-K123 WeakPolarHBondContact O-CB 3.34Å; K120-K123 PolarHBondContact O-N 3.16Å; E121-K123 VanDerWaalsContact C-N 3.3Å; E121-K123 PolarHBondContact O-N 2.91Å; K123-R125 VanDerWaalsContact C-N 3.3Å; K123-R125 PolarHBondContact O-N 2.88Å; K123-K126 WeakPolarHBondContact O-CB 3.33Å; K123-K126 PolarHBondContact O-N 2.95Å; K123-K126 VanDerWaalsContact O-N 3.1Å; K123-E127 WeakPolarHBondContact O-CB 3.4Å; K123-E127 PolarHBondContact O-N 2.96Å |
| 124 | L | 85.4 | Confident | 79.2 | Confident | 103 Ų | 103 | 129.9 Ų | 129.9 | 54% | 0.539 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -60.6 | -39.7 | 177.5 | -67.1 | 171.6 | 0 | 0 | 0 | 111.6 | K120 E121 E127 V128 | K120-L124 WeakPolarHBondContact O-CG 3.35Å; K120-L124 PolarHBondContact O-N 2.93Å; E121-L124 PolarHBondContact O-N 3.1Å; L124-E127 PolarHBondContact O-N 3.25Å; L124-V128 WeakPolarHBondContact O-CB 3.44Å; L124-V128 VanDerWaalsContact O-CG2 3.27Å; L124-V128 WeakPolarHBondContact O-CG2 3.47Å; L124-V128 PolarHBondContact O-N 3.18Å |
| 125 | R | 83.5 | Confident | 77.2 | Confident | 166 Ų | 166 | 129.4 Ų | 129.4 | 63% | 0.626 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -61.6 | -42.7 | 173.3 | -76.1 | -175.8 | -173.1 | -132.5 | 3.3 | 112.8 | E121 K123 E127 E129 | E121-R125 WeakPolarHBondContact O-CB 3.46Å; E121-R125 WeakPolarHBondContact O-CG 3.46Å; E121-R125 PolarHBondContact O-N 3.16Å; E121-R125 IonicContact OE1-CZ 3.55Å; E121-R125 IonicContact OE1-NE 3.31Å; E121-R125 PolarHBondContact OE1-NE 3.07Å; E121-R125 IonicContact OE1-NH2 2.94Å; E121-R125 PolarHBondContact OE1-NH2 3.03Å; K123-R125 VanDerWaalsContact C-N 3.3Å; K123-R125 PolarHBondContact O-N 2.88Å; R125-E127 VanDerWaalsContact C-N 3.33Å; R125-E129 WeakPolarHBondContact O-CB 3.41Å; R125-E129 PolarHBondContact O-N 3.09Å |
| 126 | K | 79.2 | Confident | 75 | Confident | 151 Ų | 151 | 128.8 Ų | 128.8 | 66% | 0.657 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -65.9 | -36.7 | 176.4 | -76.2 | -178.2 | 173.3 | -149.6 | 0 | 112.6 | K122 K123 A130 | K122-K126 WeakPolarHBondContact O-CG 3.48Å; K122-K126 PolarHBondContact O-N 3Å; K123-K126 WeakPolarHBondContact O-CB 3.33Å; K123-K126 PolarHBondContact O-N 2.95Å; K123-K126 VanDerWaalsContact O-N 3.1Å; K126-A130 WeakPolarHBondContact O-CB 3.47Å; K126-A130 PolarHBondContact O-N 3.13Å |
| 127 | E | 75.1 | Confident | 73.3 | Confident | 117 Ų | 117 | 130.9 Ų | 130.9 | 55% | 0.547 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -68.8 | -44.2 | 177.7 | -171.6 | 175 | 178.1 | 0 | 0 | 111.1 | K123 L124 R125 A130 L131 | K123-E127 WeakPolarHBondContact O-CB 3.4Å; K123-E127 PolarHBondContact O-N 2.96Å; L124-E127 PolarHBondContact O-N 3.25Å; R125-E127 VanDerWaalsContact C-N 3.33Å; E127-A130 PolarHBondContact O-N 3.44Å; E127-L131 WeakPolarHBondContact O-CG 3.45Å; E127-L131 PolarHBondContact O-N 2.87Å |
| 128 | V | 76.3 | Confident | 71.3 | Confident | 73 Ų | 73 | 131.1 Ų | 131.1 | 44% | 0.442 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -66.3 | -37.7 | 173.7 | 174.7 | 0 | 0 | 0 | 0 | 111.7 | L124 A130 L131 Q132 | L124-V128 WeakPolarHBondContact O-CB 3.44Å; L124-V128 VanDerWaalsContact O-CG2 3.27Å; L124-V128 WeakPolarHBondContact O-CG2 3.47Å; L124-V128 PolarHBondContact O-N 3.18Å; V128-A130 VanDerWaalsContact C-N 3.34Å; V128-L131 PolarHBondContact O-N 2.98Å; V128-Q132 HydrophobicContact CG1-CG 4.41Å; V128-Q132 WeakPolarHBondContact O-CB 3.46Å; V128-Q132 WeakPolarHBondContact O-CG 3.41Å; V128-Q132 PolarHBondContact O-N 2.83Å |
| 129 | E | 73.3 | Confident | 69.3 | Low | 135 Ų | 135 | 129.4 Ų | 129.4 | 63% | 0.631 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -68.3 | -31.7 | 175.2 | -174.6 | 176.8 | -174.2 | 0 | 0 | 112.5 | R125 | R125-E129 WeakPolarHBondContact O-CB 3.41Å; R125-E129 PolarHBondContact O-N 3.09Å |
| 130 | A | 67.5 | Low | 67.8 | Low | 69 Ų | 69 | 126.4 Ų | 126.4 | 57% | 0.57 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -70.2 | -37.3 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | K126 E127 V128 | K126-A130 WeakPolarHBondContact O-CB 3.47Å; K126-A130 PolarHBondContact O-N 3.13Å; E127-A130 PolarHBondContact O-N 3.44Å; V128-A130 VanDerWaalsContact C-N 3.34Å |
| 131 | L | 64.3 | Low | 65.9 | Low | 143 Ų | 143 | 128.4 Ų | 128.4 | 75% | 0.749 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -78.1 | -23.5 | 178.3 | -69.6 | 167.4 | 0 | 0 | 0 | 113.8 | E127 V128 | E127-L131 WeakPolarHBondContact O-CG 3.45Å; E127-L131 PolarHBondContact O-N 2.87Å; V128-L131 PolarHBondContact O-N 2.98Å |
| 132 | Q | 58.5 | Low | 64.2 | Low | 154 Ų | 154 | 129.8 Ų | 129.8 | 72% | 0.72 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.1 | 5.9 | 177.2 | -77.6 | -174.6 | -5 | 0 | 0 | 113.9 | V128 P134 | V128-Q132 HydrophobicContact CG1-CG 4.41Å; V128-Q132 WeakPolarHBondContact O-CB 3.46Å; V128-Q132 WeakPolarHBondContact O-CG 3.41Å; V128-Q132 PolarHBondContact O-N 2.83Å; Q132-P134 WeakPolarHBondContact O-CD 3.46Å |
| 133 | R | 49.5 | Very low | 62.6 | Low | 196 Ų | 196 | 127.8 Ų | 127.8 | 74% | 0.74 | 64% | 0.644 | S | S | * | * | trans | -73.8 | 113.6 | 174.3 | -167.7 | 179.1 | -71.3 | -163 | 0.1 | 108.7 | ||||
| 134 | P | 48 | Very low | 61.2 | Low | 91 Ų | 91 | 122.7 Ų | 122.7 | 59% | 0.591 | 63% | 0.627 | S | S | * | * | trans | -67.8 | 145.5 | 176.9 | 28.6 | -33.2 | 0 | 0 | 0 | 110.3 | Q132 D136 | Q132-P134 WeakPolarHBondContact O-CD 3.46Å; P134-D136 PolarHBondContact O-N 3.14Å | ||
| 135 | P | 51 | Low | 59.6 | Low | 128 Ų | 128 | 121.1 Ų | 121.1 | 83% | 0.831 | 62% | 0.618 | S | S | * | * | S | Bend | trans | -81.1 | 63.8 | -176.5 | 35.9 | -36.4 | 0 | 0 | 0 | 111.1 | ||
| 136 | D | 47.5 | Very low | 58 | Low | 132 Ų | 132 | 119 Ų | 119 | 71% | 0.706 | 62% | 0.615 | S | S | * | * | trans | -127.1 | 66.5 | 176.1 | -72.3 | -39.8 | 0 | 0 | 0 | 110.3 | P134 | P134-D136 PolarHBondContact O-N 3.14Š| ||
| 137 | K | 55.1 | Low | 56.6 | Low | 190 Ų | 190 | 115.5 Ų | 115.5 | 83% | 0.826 | 60% | 0.604 | S | S | * | * | S | Bend | trans | -179.3 | 128.4 | 150.8 | -92.9 | 140.5 | -161.4 | 179 | 0 | 108.1 | ||
| 138 | P | 50.1 | Low | 55.5 | Low | 123 Ų | 123 | 115.1 Ų | 115.1 | 80% | 0.799 | 60% | 0.602 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 130.8 | 176.1 | 25.2 | -32.6 | 0 | 0 | 0 | 109 | S140 | P138-S140 PolarHBondContact O-N 3.28Š|
| 139 | P | 50.9 | Low | 54.2 | Low | 85 Ų | 85 | 117.5 Ų | 117.5 | 55% | 0.552 | 61% | 0.608 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 137.8 | 175.6 | 24.2 | -31.3 | 0 | 0 | 0 | 108.8 | Y141 | P139-Y141 PolarHBondContact O-N 3.22Š|
| 140 | S | 57.8 | Low | 53.1 | Low | 79 Ų | 79 | 117.4 Ų | 117.4 | 55% | 0.552 | 61% | 0.607 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 139.9 | 175.7 | 87.1 | 0 | 0 | 0 | 0 | 108.7 | P138 L142 E143 | P138-S140 PolarHBondContact O-N 3.28Å; S140-L142 PolarHBondContact O-N 2.8Å; S140-E143 PolarHBondContact O-N 3.3Å |
| 141 | Y | 48.3 | Very low | 52.2 | Low | 182 Ų | 182 | 120.3 Ų | 120.3 | 71% | 0.714 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -41.7 | -29.4 | -175.6 | -178.9 | -99.9 | 0 | 0 | 0 | 115.7 | P139 M145 | P139-Y141 PolarHBondContact O-N 3.22Å; Y141-M145 HydrophobicContact CE1-CG 4.21Å; Y141-M145 HydrophobicContact CE1-SD 4.08Å; Y141-M145 WeakPolarHBondContact O-CG 3.34Å; Y141-M145 PolarHBondContact O-N 3.47Å |
| 142 | L | 53.5 | Low | 51.2 | Low | 125 Ų | 125 | 119.8 Ų | 119.8 | 65% | 0.654 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -71.8 | -29.2 | 178.1 | -76.9 | 173.3 | 0 | 0 | 0 | 115 | S140 Q146 | S140-L142 PolarHBondContact O-N 2.8Å; L142-Q146 WeakPolarHBondContact O-CG 3.29Å |
| 143 | E | 54.2 | Low | 50.7 | Low | 108 Ų | 108 | 120.4 Ų | 120.4 | 51% | 0.505 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -85.5 | -28.9 | -178 | -144.7 | 165.1 | -162.9 | 0 | 0 | 110.5 | S140 N147 | S140-E143 PolarHBondContact O-N 3.3Å; E143-N147 PolarHBondContact O-N 2.8Å; E143-N147 PolarHBondContact O-ND2 3.31Å; E143-N147 VanDerWaalsContact O-ND2 3.14Å |
| 144 | A | 56.5 | Low | 50.7 | Low | 26 Ų | 26 | 119.4 Ų | 119.4 | 22% | 0.215 | 61% | 0.61 | C | S | . | * | H | α-helix | trans | -67.5 | -44 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q146 N147 E148 | A144-Q146 VanDerWaalsContact C-N 3.31Å; A144-Q146 PolarHBondContact O-N 2.93Å; A144-N147 PolarHBondContact O-N 3.04Å; A144-E148 VanDerWaalsContact O-CB 3.29Å; A144-E148 WeakPolarHBondContact O-CB 3.22Å; A144-E148 VanDerWaalsContact O-CG 3.24Å; A144-E148 WeakPolarHBondContact O-CG 3.28Å; A144-E148 PolarHBondContact O-N 2.81Å |
| 145 | M | 51.2 | Low | 50.7 | Low | 70 Ų | 70 | 122.8 Ų | 122.8 | 35% | 0.345 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -62.3 | -35.3 | 177.2 | -69.9 | -125.1 | 68.3 | 0 | 0 | 113.2 | Y141 E149 | Y141-M145 HydrophobicContact CE1-CG 4.21Å; Y141-M145 HydrophobicContact CE1-SD 4.08Å; Y141-M145 WeakPolarHBondContact O-CG 3.34Å; Y141-M145 PolarHBondContact O-N 3.47Å; M145-E149 VanDerWaalsContact O-CB 3.28Å; M145-E149 WeakPolarHBondContact O-CB 3.46Å; M145-E149 VanDerWaalsContact O-CG 3.22Å; M145-E149 WeakPolarHBondContact O-CG 3.24Å; M145-E149 PolarHBondContact O-N 3.2Å |
| 146 | Q | 51.2 | Low | 50.3 | Low | 122 Ų | 122 | 123.8 Ų | 123.8 | 57% | 0.57 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -73.8 | -34.2 | 178.4 | -72.6 | 178.7 | -8.5 | 0 | 0 | 112.7 | L142 A144 E150 | L142-Q146 WeakPolarHBondContact O-CG 3.29Å; A144-Q146 VanDerWaalsContact C-N 3.31Å; A144-Q146 PolarHBondContact O-N 2.93Å; Q146-E150 PolarHBondContact O-N 3.26Å |
| 147 | N | 49.1 | Very low | 50 | Low | 78 Ų | 78 | 119.4 Ų | 119.4 | 42% | 0.417 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -78 | -36.6 | 176.1 | -64.1 | -22.1 | 0 | 0 | 0 | 111.3 | E143 A144 E150 E151 | E143-N147 PolarHBondContact O-N 2.8Å; E143-N147 PolarHBondContact O-ND2 3.31Å; E143-N147 VanDerWaalsContact O-ND2 3.14Å; A144-N147 PolarHBondContact O-N 3.04Å; N147-E150 PolarHBondContact O-N 3.34Å; N147-E151 VanDerWaalsContact O-CB 3.31Å; N147-E151 WeakPolarHBondContact O-CB 3.32Å; N147-E151 VanDerWaalsContact O-CG 3.32Å; N147-E151 WeakPolarHBondContact O-CG 3.31Å; N147-E151 PolarHBondContact O-N 3.22Å |
| 148 | E | 51.2 | Low | 49.8 | Very low | 109 Ų | 109 | 116.8 Ų | 116.8 | 51% | 0.509 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -65.3 | -38.6 | 172.1 | -73.2 | 172.2 | -174.4 | 0 | 0 | 110.7 | A144 E151 E152 | A144-E148 VanDerWaalsContact O-CB 3.29Å; A144-E148 WeakPolarHBondContact O-CB 3.22Å; A144-E148 VanDerWaalsContact O-CG 3.24Å; A144-E148 WeakPolarHBondContact O-CG 3.28Å; A144-E148 PolarHBondContact O-N 2.81Å; E148-E151 PolarHBondContact O-N 3.3Å; E148-E152 WeakPolarHBondContact O-CB 3.42Å; E148-E152 PolarHBondContact O-N 3.1Å |
| 149 | E | 50.2 | Low | 49.8 | Very low | 123 Ų | 123 | 116.6 Ų | 116.6 | 58% | 0.575 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -66.3 | -37.4 | 171.5 | -78.6 | 175.8 | 176.6 | 0 | 0 | 112.6 | M145 E153 | M145-E149 VanDerWaalsContact O-CB 3.28Å; M145-E149 WeakPolarHBondContact O-CB 3.46Å; M145-E149 VanDerWaalsContact O-CG 3.22Å; M145-E149 WeakPolarHBondContact O-CG 3.24Å; M145-E149 PolarHBondContact O-N 3.2Å; E149-E153 WeakPolarHBondContact O-CB 3.17Å; E149-E153 PolarHBondContact O-N 3.12Å; E149-E153 VanDerWaalsContact O-N 3.12Å |
| 150 | E | 49.7 | Very low | 49.9 | Very low | 132 Ų | 132 | 117 Ų | 117 | 62% | 0.617 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -70.8 | -37.2 | 173.9 | -86.4 | -173.6 | 160 | 0 | 0 | 112.6 | Q146 N147 E154 | Q146-E150 PolarHBondContact O-N 3.26Å; N147-E150 PolarHBondContact O-N 3.34Å; E150-E154 WeakPolarHBondContact O-CG 3.05Å; E150-E154 PolarHBondContact O-N 2.95Å |
| 151 | E | 47.6 | Very low | 50.5 | Low | 131 Ų | 131 | 116.8 Ų | 116.8 | 61% | 0.612 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -76 | -38.4 | 178.3 | -74.4 | 178.7 | 174.7 | 0 | 0 | 111.8 | N147 E148 E154 E155 | N147-E151 VanDerWaalsContact O-CB 3.31Å; N147-E151 WeakPolarHBondContact O-CB 3.32Å; N147-E151 VanDerWaalsContact O-CG 3.32Å; N147-E151 WeakPolarHBondContact O-CG 3.31Å; N147-E151 PolarHBondContact O-N 3.22Å; E148-E151 PolarHBondContact O-N 3.3Å; E151-E154 PolarHBondContact O-N 3.41Å; E151-E155 PolarHBondContact O-N 3.03Å; E151-E155 VanDerWaalsContact O-N 3.1Å |
| 152 | E | 44.1 | Very low | 51.2 | Low | 132 Ų | 132 | 114.2 Ų | 114.2 | 62% | 0.617 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -73.7 | -26.8 | 177.5 | -160.6 | 174.9 | -155.1 | 0 | 0 | 111.9 | E148 E154 L156 | E148-E152 WeakPolarHBondContact O-CB 3.42Å; E148-E152 PolarHBondContact O-N 3.1Å; E152-E154 VanDerWaalsContact C-N 3.35Å; E152-L156 PolarHBondContact O-N 3.31Å |
| 153 | E | 47.2 | Very low | 51.6 | Low | 166 Ų | 166 | 114.7 Ų | 114.7 | 78% | 0.776 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -76.2 | -21.1 | 170.6 | -160.3 | 171.7 | -148.4 | 0 | 0 | 112.5 | E149 | E149-E153 WeakPolarHBondContact O-CB 3.17Å; E149-E153 PolarHBondContact O-N 3.12Å; E149-E153 VanDerWaalsContact O-N 3.12Å |
| 154 | E | 49.6 | Very low | 52.2 | Low | 175 Ų | 175 | 113.4 Ų | 113.4 | 82% | 0.818 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -84.9 | -26.7 | 172.2 | -75 | -168.7 | 171.9 | 0 | 0 | 113.6 | E150 E151 E152 | E150-E154 WeakPolarHBondContact O-CG 3.05Å; E150-E154 PolarHBondContact O-N 2.95Å; E151-E154 PolarHBondContact O-N 3.41Å; E152-E154 VanDerWaalsContact C-N 3.35Å |
| 155 | E | 49.2 | Very low | 52.8 | Low | 163 Ų | 163 | 117.6 Ų | 117.6 | 76% | 0.762 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -101.7 | -19.7 | -170.7 | -160.9 | 148.9 | -153.3 | 0 | 0 | 115.6 | E151 | E151-E155 PolarHBondContact O-N 3.03Å; E151-E155 VanDerWaalsContact O-N 3.1Å |
| 156 | L | 41.7 | Very low | 53.5 | Low | 148 Ų | 148 | 116.8 Ų | 116.8 | 78% | 0.775 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -132 | 27.8 | -173.1 | -70.7 | 170 | 0 | 0 | 0 | 116.2 | E152 | E152-L156 PolarHBondContact O-N 3.31Š|
| 157 | G | 41.3 | Very low | 54.1 | Low | 41 Ų | 41 | 115 Ų | 115 | 42% | 0.423 | 59% | 0.589 | S | S | . | * | S | Bend | trans | -131.3 | 149.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | V159 | G157-V159 PolarHBondContact O-N 3.29Š|
| 158 | P | 51.8 | Low | 54.9 | Low | 134 Ų | 134 | 117 Ų | 117 | 87% | 0.87 | 60% | 0.599 | S | S | * | * | trans | -56.8 | 117.2 | 173.9 | -17.7 | 28.8 | 0 | 0 | 0 | 109.7 | M160 | P158-M160 PolarHBondContact O-N 3.48Š| ||
| 159 | V | 50.2 | Low | 55.7 | Low | 120 Ų | 120 | 115.7 Ų | 115.7 | 73% | 0.727 | 61% | 0.607 | S | S | * | * | trans | -41.6 | 109.1 | -179.4 | 179.6 | 0 | 0 | 0 | 0 | 110.1 | G157 T161 | G157-V159 PolarHBondContact O-N 3.29Å; V159-T161 PolarHBondContact O-N 2.97Å | ||
| 160 | M | 52.3 | Low | 56.7 | Low | 92 Ų | 92 | 113.6 Ų | 113.6 | 45% | 0.453 | 60% | 0.602 | S | S | . | * | trans | -51.5 | 114.4 | 172.9 | -80.5 | -84.7 | -84.7 | 0 | 0 | 108.4 | P158 Q164 K165 L168 | P158-M160 PolarHBondContact O-N 3.48Å; M160-Q164 HydrophobicContact CE-CB 4.14Å; M160-Q164 HydrophobicContact SD-CB 4.34Å; M160-Q164 PolarHBondContact SD-OE1 3.04Å; M160-K165 VanDerWaalsContact O-CE 3.3Å; M160-K165 WeakPolarHBondContact O-CE 3.26Å; M160-L168 HydrophobicContact CE-CD1 3.86Å | ||
| 161 | T | 70.1 | Confident | 58 | Low | 76 Ų | 76 | 116.6 Ų | 116.6 | 47% | 0.466 | 61% | 0.613 | S | S | . | * | trans | -52.5 | 147.2 | -173.9 | 56.3 | 0 | 0 | 0 | 0 | 111.3 | V159 E163 Q164 K165 | V159-T161 PolarHBondContact O-N 2.97Å; T161-E163 PolarHBondContact O-N 2.75Å; T161-Q164 WeakPolarHBondContact O-CA 3.3Å; T161-Q164 WeakPolarHBondContact O-CB 3.33Å; T161-Q164 PolarHBondContact O-N 3.12Å; T161-Q164 VanDerWaalsContact OG1-CG 3.27Å; T161-Q164 WeakPolarHBondContact OG1-CG 3.34Å; T161-Q164 PolarHBondContact OG1-OE1 3.3Å; T161-K165 PolarHBondContact O-N 3.46Å; T161-K165 VanDerWaalsContact O-N 3.12Å | ||
| 162 | D | 63.3 | Low | 59.4 | Low | 128 Ų | 128 | 118.1 Ų | 118.1 | 68% | 0.684 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -54.7 | -25.8 | -179.4 | -68.8 | -25.1 | 0 | 0 | 0 | 113 | A166 | D162-A166 WeakPolarHBondContact O-CB 3.39Å; D162-A166 PolarHBondContact O-N 3.17Å |
| 163 | E | 62.6 | Low | 61.1 | Low | 135 Ų | 135 | 117.3 Ų | 117.3 | 63% | 0.631 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -71.2 | -39.6 | 173.4 | -60 | -161.9 | 168.8 | 0 | 0 | 113.5 | T161 A166 R167 | T161-E163 PolarHBondContact O-N 2.75Å; E163-A166 PolarHBondContact O-N 3.5Å; E163-R167 WeakPolarHBondContact O-CB 3.41Å; E163-R167 VanDerWaalsContact O-CG 3.24Å; E163-R167 WeakPolarHBondContact O-CG 3.37Å; E163-R167 PolarHBondContact O-N 3.03Å |
| 164 | Q | 66.1 | Low | 62.6 | Low | 81 Ų | 81 | 113 Ų | 113 | 38% | 0.379 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -65.5 | -41.5 | 174.3 | -72.2 | 165.3 | -35.7 | 0 | 0 | 110.2 | M160 T161 R167 L168 | M160-Q164 HydrophobicContact CE-CB 4.14Å; M160-Q164 HydrophobicContact SD-CB 4.34Å; M160-Q164 PolarHBondContact SD-OE1 3.04Å; T161-Q164 WeakPolarHBondContact O-CA 3.3Å; T161-Q164 WeakPolarHBondContact O-CB 3.33Å; T161-Q164 PolarHBondContact O-N 3.12Å; T161-Q164 VanDerWaalsContact OG1-CG 3.27Å; T161-Q164 WeakPolarHBondContact OG1-CG 3.34Å; T161-Q164 PolarHBondContact OG1-OE1 3.3Å; Q164-R167 PolarHBondContact O-N 2.95Å; Q164-L168 WeakPolarHBondContact O-CD1 3.48Å; Q164-L168 WeakPolarHBondContact O-CG 3.24Å; Q164-L168 PolarHBondContact O-N 3.12Å |
| 165 | K | 69.9 | Low | 64.3 | Low | 113 Ų | 113 | 106.8 Ų | 106.8 | 49% | 0.491 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -62.2 | -42.7 | 174.1 | -68.3 | -179.1 | 178.5 | 179.3 | 0 | 112.1 | M160 T161 L168 A169 | M160-K165 VanDerWaalsContact O-CE 3.3Å; M160-K165 WeakPolarHBondContact O-CE 3.26Å; T161-K165 PolarHBondContact O-N 3.46Å; T161-K165 VanDerWaalsContact O-N 3.12Å; K165-L168 PolarHBondContact O-N 2.84Å; K165-A169 WeakPolarHBondContact O-CB 3.27Å; K165-A169 PolarHBondContact O-N 2.97Å |
| 166 | A | 65.3 | Low | 66 | Low | 53 Ų | 53 | 106.3 Ų | 106.3 | 44% | 0.438 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -67.7 | -35 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | D162 E163 T170 | D162-A166 WeakPolarHBondContact O-CB 3.39Å; D162-A166 PolarHBondContact O-N 3.17Å; E163-A166 PolarHBondContact O-N 3.5Å; A166-T170 WeakPolarHBondContact O-CB 3.34Å; A166-T170 VanDerWaalsContact O-CG2 3.26Å; A166-T170 WeakPolarHBondContact O-CG2 3.47Å; A166-T170 PolarHBondContact O-N 3.3Å; A166-T170 PolarHBondContact O-OG1 3.38Å |
| 167 | R | 64.1 | Low | 68 | Low | 85 Ų | 85 | 106.2 Ų | 106.2 | 32% | 0.321 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -67.1 | -43.8 | 175.4 | -74.4 | 174.8 | -174.9 | -159.5 | 5.8 | 112 | E163 Q164 T170 K171 E178 | E163-R167 WeakPolarHBondContact O-CB 3.41Å; E163-R167 VanDerWaalsContact O-CG 3.24Å; E163-R167 WeakPolarHBondContact O-CG 3.37Å; E163-R167 PolarHBondContact O-N 3.03Å; Q164-R167 PolarHBondContact O-N 2.95Å; R167-T170 PolarHBondContact O-N 2.96Å; R167-T170 PolarHBondContact O-OG1 3.47Å; R167-K171 PolarHBondContact O-N 3.41Å; R167-E178 IonicContact NH1-OE1 3.96Å |
| 168 | L | 64.9 | Low | 70 | Confident | 120 Ų | 120 | 107.1 Ų | 107.1 | 63% | 0.628 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -61.3 | -45.6 | 174.1 | -71.6 | 158.6 | 0 | 0 | 0 | 111.1 | M160 Q164 K165 T170 K171 | M160-L168 HydrophobicContact CE-CD1 3.86Å; Q164-L168 WeakPolarHBondContact O-CD1 3.48Å; Q164-L168 WeakPolarHBondContact O-CG 3.24Å; Q164-L168 PolarHBondContact O-N 3.12Å; K165-L168 PolarHBondContact O-N 2.84Å; L168-T170 VanDerWaalsContact C-N 3.27Å; L168-T170 PolarHBondContact O-N 3.42Å; L168-K171 PolarHBondContact O-N 3Å |
| 169 | A | 68.9 | Low | 71.5 | Confident | 82 Ų | 82 | 107 Ų | 107 | 68% | 0.678 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63.3 | -31.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | K165 K171 | K165-A169 WeakPolarHBondContact O-CB 3.27Å; K165-A169 PolarHBondContact O-N 2.97Å; A169-K171 VanDerWaalsContact C-N 3.34Å |
| 170 | T | 70.4 | Confident | 73.1 | Confident | 79 Ų | 79 | 106 Ų | 106 | 49% | 0.485 | 53% | 0.531 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.7 | 6.7 | -177.8 | 53.1 | 0 | 0 | 0 | 0 | 114.3 | A166 R167 L168 R172 | A166-T170 WeakPolarHBondContact O-CB 3.34Å; A166-T170 VanDerWaalsContact O-CG2 3.26Å; A166-T170 WeakPolarHBondContact O-CG2 3.47Å; A166-T170 PolarHBondContact O-N 3.3Å; A166-T170 PolarHBondContact O-OG1 3.38Å; R167-T170 PolarHBondContact O-N 2.96Å; R167-T170 PolarHBondContact O-OG1 3.47Å; L168-T170 VanDerWaalsContact C-N 3.27Å; L168-T170 PolarHBondContact O-N 3.42Å; T170-R172 PolarHBondContact O-N 2.88Å; T170-R172 VanDerWaalsContact O-N 3.12Å |
| 171 | K | 76.4 | Confident | 74.7 | Confident | 195 Ų | 195 | 104.2 Ų | 104.2 | 85% | 0.848 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.9 | 36.2 | -179.8 | -60.1 | -170.2 | 176.7 | -165.5 | 0 | 112.8 | R167 L168 A169 | R167-K171 PolarHBondContact O-N 3.41Å; L168-K171 PolarHBondContact O-N 3Å; A169-K171 VanDerWaalsContact C-N 3.34Å |
| 172 | R | 78.1 | Confident | 75.2 | Confident | 162 Ų | 162 | 107.2 Ų | 107.2 | 61% | 0.611 | 53% | 0.533 | S | S | * | . | P | Polyproline II helix | trans | -66.1 | 141.1 | 175.9 | -75.4 | 176.9 | 178.2 | 179.3 | 1.1 | 108.7 | T170 | T170-R172 PolarHBondContact O-N 2.88Å; T170-R172 VanDerWaalsContact O-N 3.12Å |
| 173 | P | 78.9 | Confident | 76.1 | Confident | 116 Ų | 116 | 102.8 Ų | 102.8 | 75% | 0.753 | 51% | 0.508 | S | S | * | . | P | Polyproline II helix | trans | -58.7 | 146.4 | 169 | 26.8 | -33 | 0 | 0 | 0 | 109.1 | T175 | P173-T175 PolarHBondContact O-N 3.05Š|
| 174 | L | 78.8 | Confident | 76.9 | Confident | 76 Ų | 76 | 99.6 Ų | 99.6 | 40% | 0.398 | 50% | 0.501 | S | S | . | . | P | Polyproline II helix | trans | -51.4 | 135.3 | -178.6 | -142.9 | 95.2 | 0 | 0 | 0 | 110.3 | E178 Y179 | L174-E178 HydrophobicContact CD2-CB 3.83Å; L174-E178 HydrophobicContact CG-CB 3.84Å; L174-Y179 HydrophobicContact CD2-CD2 4.48Å |
| 175 | T | 85.5 | Confident | 77.8 | Confident | 44 Ų | 44 | 98.8 Ų | 98.8 | 27% | 0.27 | 50% | 0.501 | S | S | . | . | P | Polyproline II helix | trans | -74.2 | 156 | 173.6 | 65.9 | 0 | 0 | 0 | 0 | 110.1 | P173 E177 E178 Y179 | P173-T175 PolarHBondContact O-N 3.05Å; T175-E177 PolarHBondContact O-N 2.9Å; T175-E178 PolarHBondContact N-OE2 3.24Å; T175-E178 PolarHBondContact O-N 3.3Å; T175-E178 VanDerWaalsContact OG1-CG 3.22Å; T175-E178 WeakPolarHBondContact OG1-CG 3.36Å; T175-E178 PolarHBondContact OG1-N 3.18Å; T175-E178 PolarHBondContact OG1-OE1 3.1Å; T175-Y179 PolarHBondContact O-N 3.32Å; T175-Y179 VanDerWaalsContact O-N 3.1Å |
| 176 | K | 85.9 | Confident | 78.6 | Confident | 153 Ų | 153 | 98.3 Ų | 98.3 | 67% | 0.665 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.1 | -37.9 | 179.5 | -179.4 | 179.9 | 166.2 | -172.4 | 0 | 111.5 | Y179 E180 | K176-Y179 WeakPolarHBondContact O-CB 3.22Å; K176-Y179 PolarHBondContact O-N 3.21Å; K176-E180 WeakPolarHBondContact CE-OE1 3.38Å; K176-E180 IonicContact NZ-OE1 3.66Å; K176-E180 WeakPolarHBondContact O-CG 3.44Å; K176-E180 PolarHBondContact O-N 2.88Å |
| 177 | E | 82.7 | Confident | 79.6 | Confident | 145 Ų | 145 | 103.3 Ų | 103.3 | 68% | 0.678 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.5 | -43 | 178.3 | -65.6 | 167.6 | -171.3 | 0 | 0 | 111.7 | T175 Y179 E180 A181 | T175-E177 PolarHBondContact O-N 2.9Å; E177-Y179 VanDerWaalsContact C-N 3.29Å; E177-Y179 PolarHBondContact O-N 3.46Å; E177-E180 PolarHBondContact O-N 2.86Å; E177-A181 VanDerWaalsContact O-CB 3.3Å; E177-A181 WeakPolarHBondContact O-CB 3.41Å; E177-A181 PolarHBondContact O-N 2.83Å |
| 178 | E | 84.4 | Confident | 80.6 | Confident | 61 Ų | 61 | 107.9 Ų | 107.9 | 29% | 0.285 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.4 | -35.5 | 174.6 | -71.8 | 156.7 | -148.8 | 0 | 0 | 111.8 | R167 L174 T175 R182 | R167-E178 IonicContact NH1-OE1 3.96Å; L174-E178 HydrophobicContact CD2-CB 3.83Å; L174-E178 HydrophobicContact CG-CB 3.84Å; T175-E178 PolarHBondContact N-OE2 3.24Å; T175-E178 PolarHBondContact O-N 3.3Å; T175-E178 VanDerWaalsContact OG1-CG 3.22Å; T175-E178 WeakPolarHBondContact OG1-CG 3.36Å; T175-E178 PolarHBondContact OG1-N 3.18Å; T175-E178 PolarHBondContact OG1-OE1 3.1Å; E178-R182 WeakPolarHBondContact O-CG 3.31Å; E178-R182 PolarHBondContact O-N 3.19Å |
| 179 | Y | 82 | Confident | 81.6 | Confident | 131 Ų | 131 | 105.5 Ų | 105.5 | 51% | 0.514 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -68.5 | -46 | 175.9 | -176.3 | -97.2 | 0 | 0 | 0 | 111.6 | L174 T175 K176 E177 A181 R182 Q183 | L174-Y179 HydrophobicContact CD2-CD2 4.48Å; T175-Y179 PolarHBondContact O-N 3.32Å; T175-Y179 VanDerWaalsContact O-N 3.1Å; K176-Y179 WeakPolarHBondContact O-CB 3.22Å; K176-Y179 PolarHBondContact O-N 3.21Å; E177-Y179 VanDerWaalsContact C-N 3.29Å; E177-Y179 PolarHBondContact O-N 3.46Å; Y179-A181 VanDerWaalsContact C-N 3.31Å; Y179-A181 PolarHBondContact O-N 3.29Å; Y179-R182 PolarHBondContact O-N 3.37Å; Y179-Q183 HydrophobicContact CD1-CG 4.16Å; Y179-Q183 HydrophobicContact CE1-CG 3.8Å; Y179-Q183 HydrophobicContact CE2-CG 4.5Å; Y179-Q183 WeakPolarHBondContact O-CB 3.3Å; Y179-Q183 VanDerWaalsContact O-CG 3.3Å; Y179-Q183 WeakPolarHBondContact O-CG 3.47Å; Y179-Q183 PolarHBondContact O-N 2.83Å |
| 180 | E | 84.9 | Confident | 82.3 | Confident | 100 Ų | 100 | 105.9 Ų | 105.9 | 47% | 0.467 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.5 | -36.9 | 176.9 | -72.6 | 176.8 | 178.5 | 0 | 0 | 111.8 | K176 E177 Q183 S184 | K176-E180 WeakPolarHBondContact CE-OE1 3.38Å; K176-E180 IonicContact NZ-OE1 3.66Å; K176-E180 WeakPolarHBondContact O-CG 3.44Å; K176-E180 PolarHBondContact O-N 2.88Å; E177-E180 PolarHBondContact O-N 2.86Å; E180-Q183 CarbonylContact O-C 3.59Å; E180-Q183 PolarHBondContact O-N 2.74Å; E180-S184 WeakPolarHBondContact O-CB 3.3Å; E180-S184 PolarHBondContact O-N 3.37Å; E180-S184 PolarHBondContact O-OG 3.46Å |
| 181 | A | 84.3 | Confident | 82.9 | Confident | 53 Ų | 53 | 103.8 Ų | 103.8 | 44% | 0.438 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.5 | -41.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112 | E177 Y179 Q183 S184 | E177-A181 VanDerWaalsContact O-CB 3.3Å; E177-A181 WeakPolarHBondContact O-CB 3.41Å; E177-A181 PolarHBondContact O-N 2.83Å; Y179-A181 VanDerWaalsContact C-N 3.31Å; Y179-A181 PolarHBondContact O-N 3.29Å; A181-Q183 VanDerWaalsContact C-N 3.3Å; A181-Q183 PolarHBondContact O-N 2.9Å; A181-S184 PolarHBondContact O-N 3.25Å; A181-S184 PolarHBondContact O-OG 3.47Å |
| 182 | R | 81.9 | Confident | 83.2 | Confident | 140 Ų | 140 | 100.4 Ų | 100.4 | 53% | 0.528 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.4 | -37.3 | 173.5 | -75.1 | 177.6 | 178.9 | -176.9 | -1 | 112.2 | E178 Y179 G202 | E178-R182 WeakPolarHBondContact O-CG 3.31Å; E178-R182 PolarHBondContact O-N 3.19Å; Y179-R182 PolarHBondContact O-N 3.37Å; R182-G202 VanDerWaalsContact O-CA 3.31Å; R182-G202 WeakPolarHBondContact O-CA 3.46Å |
| 183 | Q | 82.3 | Confident | 83 | Confident | 35 Ų | 35 | 101.4 Ų | 101.4 | 16% | 0.164 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -80.2 | -15.6 | 179.3 | -67.3 | -62.3 | -30.2 | 0 | 0 | 113.6 | Y179 E180 A181 R201 | Y179-Q183 HydrophobicContact CD1-CG 4.16Å; Y179-Q183 HydrophobicContact CE1-CG 3.8Å; Y179-Q183 HydrophobicContact CE2-CG 4.5Å; Y179-Q183 WeakPolarHBondContact O-CB 3.3Å; Y179-Q183 VanDerWaalsContact O-CG 3.3Å; Y179-Q183 WeakPolarHBondContact O-CG 3.47Å; Y179-Q183 PolarHBondContact O-N 2.83Å; E180-Q183 CarbonylContact O-C 3.59Å; E180-Q183 PolarHBondContact O-N 2.74Å; A181-Q183 VanDerWaalsContact C-N 3.3Å; A181-Q183 PolarHBondContact O-N 2.9Å; Q183-R201 WeakPolarHBondContact O-CD 3.35Å; Q183-R201 WeakPolarHBondContact O-CG 3.29Å; Q183-R201 PolarHBondContact O-NE 2.97Å |
| 184 | S | 79.4 | Confident | 83.2 | Confident | 68 Ų | 68 | 99.2 Ų | 99.2 | 48% | 0.476 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -85.7 | -13.6 | 179.8 | 65.3 | 0 | 0 | 0 | 0 | 113.5 | E180 A181 I186 | E180-S184 WeakPolarHBondContact O-CB 3.3Å; E180-S184 PolarHBondContact O-N 3.37Å; E180-S184 PolarHBondContact O-OG 3.46Å; A181-S184 PolarHBondContact O-N 3.25Å; A181-S184 PolarHBondContact O-OG 3.47Å; S184-I186 PolarHBondContact O-N 3.24Å |
| 185 | V | 84.8 | Confident | 83.2 | Confident | 64 Ų | 64 | 98.2 Ų | 98.2 | 39% | 0.388 | 50% | 0.5 | S | S | . | . | trans | -67.2 | 120.2 | 177 | -176.5 | 0 | 0 | 0 | 0 | 109.9 | R187 R201 G202 | V185-R187 HydrophobicContact CG1-CG 4.24Å; V185-R201 WeakPolarHBondContact O-CA 2.99Å; V185-G202 PolarHBondContact O-N 2.86Å | ||
| 186 | I | 85.6 | Confident | 83 | Confident | 103 Ų | 103 | 104.3 Ų | 104.3 | 53% | 0.528 | 52% | 0.517 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 124.2 | 177.3 | -59 | 168.9 | 0 | 0 | 0 | 108.7 | S184 L199 V200 | S184-I186 PolarHBondContact O-N 3.24Å; I186-L199 HydrophobicContact CG2-CB 4.03Å; I186-L199 HydrophobicContact CG2-CD2 3.72Å; I186-L199 HydrophobicContact CG2-CG 4.41Å; I186-V200 CarbonylContact C-O 3.57Å; I186-V200 WeakPolarHBondContact CA-O 3.46Å |
| 187 | R | 87 | Confident | 82.6 | Confident | 157 Ų | 157 | 102 Ų | 102 | 59% | 0.592 | 52% | 0.517 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -115.9 | 140.3 | 179 | -61.9 | -179 | 178.8 | 136.7 | -4.8 | 110.3 | V185 V189 L199 V200 | V185-R187 HydrophobicContact CG1-CG 4.24Å; R187-V189 HydrophobicContact CB-CG2 4.24Å; R187-L199 CarbonylContact O-C 3.49Å; R187-L199 WeakPolarHBondContact O-CA 3.3Å; R187-V200 PolarHBondContact N-O 3.24Å; R187-V200 PolarHBondContact O-N 3.41Å |
| 188 | R | 86.3 | Confident | 82.7 | Confident | 182 Ų | 182 | 97.8 Ų | 97.8 | 69% | 0.687 | 50% | 0.495 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89.9 | 110.8 | 170.3 | -76.2 | 177.2 | 167.9 | 172.3 | -5.8 | 108.3 | L199 E209 | R188-L199 HydrophobicContact CG-CD2 3.36Å; R188-L199 HydrophobicContact CG-CG 4.46Å; R188-E209 IonicContact CZ-OE2 3.6Å; R188-E209 IonicContact NH2-OE2 3Å; R188-E209 PolarHBondContact NH2-OE2 3.34Å |
| 189 | V | 85 | Confident | 82.7 | Confident | 70 Ų | 70 | 96.3 Ų | 96.3 | 42% | 0.424 | 49% | 0.488 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.4 | 132.4 | 179.9 | -176.8 | 0 | 0 | 0 | 0 | 108.7 | R187 R198 V200 | R187-V189 HydrophobicContact CB-CG2 4.24Å; V189-R198 PolarHBondContact N-O 3.35Å; V189-R198 PolarHBondContact O-N 2.79Å; V189-R198 VanDerWaalsContact O-O 3.09Å; V189-V200 HydrophobicContact CB-CG2 3.92Å; V189-V200 HydrophobicContact CG2-CB 4.29Å; V189-V200 HydrophobicContact CG2-CG2 3.8Å |
| 190 | V | 83.8 | Confident | 82.8 | Confident | 90 Ų | 90 | 91.5 Ų | 91.5 | 55% | 0.545 | 47% | 0.473 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.6 | 123.8 | 173.7 | 179.7 | 0 | 0 | 0 | 0 | 108.1 | T197 | V190-T197 HydrophobicContact CG2-CG2 3.96Å |
| 191 | D | 83.7 | Confident | 82.9 | Confident | 35 Ų | 35 | 91.5 Ų | 91.5 | 19% | 0.187 | 47% | 0.468 | C | S | . | . | trans | -76.9 | 124 | 178.7 | -154.7 | 48.4 | 0 | 0 | 0 | 109.7 | E193 T194 G195 R196 R198 | D191-E193 VanDerWaalsContact C-N 3.3Å; D191-E193 PolarHBondContact O-N 3.33Å; D191-T194 PolarHBondContact OD2-OG1 2.7Å; D191-G195 VanDerWaalsContact O-CA 3.3Å; D191-G195 WeakPolarHBondContact O-CA 3.49Å; D191-G195 PolarHBondContact O-N 3Å; D191-R196 PolarHBondContact N-O 3.2Å; D191-R198 IonicContact OD1-NH1 2.96Å; D191-R198 PolarHBondContact OD1-NH1 3.33Å; D191-R198 IonicContact OD2-CZ 3.14Å; D191-R198 IonicContact OD2-NE 3.92Å; D191-R198 IonicContact OD2-NH1 3.75Å; D191-R198 PolarHBondContact OD2-NH1 3.08Å; D191-R198 IonicContact OD2-NH2 2.66Å; D191-R198 PolarHBondContact OD2-NH2 2.84Å; D191-R198 VanDerWaalsContact OD2-NH2 3.14Å | ||
| 192 | P | 82.3 | Confident | 82.8 | Confident | 123 Ų | 123 | 89.6 Ų | 89.6 | 80% | 0.799 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68 | -27 | -170.3 | 25.3 | -33.9 | 0 | 0 | 0 | 113.5 | ||
| 193 | E | 74.4 | Confident | 82.5 | Confident | 184 Ų | 184 | 90.6 Ų | 90.6 | 86% | 0.86 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.7 | -36.9 | -177.6 | -61.8 | -167.5 | 164.7 | 0 | 0 | 113.3 | D191 | D191-E193 VanDerWaalsContact C-N 3.3Å; D191-E193 PolarHBondContact O-N 3.33Å |
| 194 | T | 82.9 | Confident | 82.1 | Confident | 70 Ų | 70 | 91 Ų | 91 | 43% | 0.429 | 48% | 0.479 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108.3 | -10.2 | -174.8 | 50.4 | 0 | 0 | 0 | 0 | 113.6 | D191 R196 | D191-T194 PolarHBondContact OD2-OG1 2.7Å; T194-R196 PolarHBondContact O-N 3.15Å; T194-R196 VanDerWaalsContact O-N 3.08Å |
| 195 | G | 78.6 | Confident | 82 | Confident | 55 Ų | 55 | 93.5 Ų | 93.5 | 57% | 0.567 | 48% | 0.483 | S | S | * | . | trans | 63.3 | 8.6 | -175.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | D191 | D191-G195 VanDerWaalsContact O-CA 3.3Å; D191-G195 WeakPolarHBondContact O-CA 3.49Å; D191-G195 PolarHBondContact O-N 3Å | ||
| 196 | R | 80.2 | Confident | 81.7 | Confident | 171 Ų | 171 | 94.8 Ų | 94.8 | 65% | 0.645 | 49% | 0.487 | S | S | * | . | trans | -83.4 | 136.1 | -179.2 | -66.1 | -179.2 | -175.3 | 171.9 | 3 | 109.5 | D191 T194 R198 | D191-R196 PolarHBondContact N-O 3.2Å; T194-R196 PolarHBondContact O-N 3.15Å; T194-R196 VanDerWaalsContact O-N 3.08Å; R196-R198 PolarHBondContact O-N 2.8Å | ||
| 197 | T | 78.4 | Confident | 81.4 | Confident | 106 Ų | 106 | 92.5 Ų | 92.5 | 65% | 0.65 | 48% | 0.475 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -72.4 | 116 | 169.3 | 52.3 | 0 | 0 | 0 | 0 | 109 | V190 | V190-T197 HydrophobicContact CG2-CG2 3.96Å |
| 198 | R | 83.9 | Confident | 80.8 | Confident | 56 Ų | 56 | 91.7 Ų | 91.7 | 21% | 0.211 | 48% | 0.478 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.8 | 142.9 | 174.3 | -69.6 | 176.8 | 172.9 | 161.9 | 14.1 | 109.3 | V189 D191 R196 I206 | V189-R198 PolarHBondContact N-O 3.35Å; V189-R198 PolarHBondContact O-N 2.79Å; V189-R198 VanDerWaalsContact O-O 3.09Å; D191-R198 IonicContact OD1-NH1 2.96Å; D191-R198 PolarHBondContact OD1-NH1 3.33Å; D191-R198 IonicContact OD2-CZ 3.14Å; D191-R198 IonicContact OD2-NE 3.92Å; D191-R198 IonicContact OD2-NH1 3.75Å; D191-R198 PolarHBondContact OD2-NH1 3.08Å; D191-R198 IonicContact OD2-NH2 2.66Å; D191-R198 PolarHBondContact OD2-NH2 2.84Å; D191-R198 VanDerWaalsContact OD2-NH2 3.14Å; R196-R198 PolarHBondContact O-N 2.8Å; R198-I206 HydrophobicContact CB-CG2 3.93Å; R198-I206 HydrophobicContact CG-CG2 4.1Å |
| 199 | L | 84.9 | Confident | 80.6 | Confident | 29 Ų | 29 | 87.9 Ų | 87.9 | 15% | 0.152 | 47% | 0.468 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.9 | 128.3 | 171.4 | -66.1 | 160 | 0 | 0 | 0 | 107.1 | I186 R187 R188 I206 I207 E209 | I186-L199 HydrophobicContact CG2-CB 4.03Å; I186-L199 HydrophobicContact CG2-CD2 3.72Å; I186-L199 HydrophobicContact CG2-CG 4.41Å; R187-L199 CarbonylContact O-C 3.49Å; R187-L199 WeakPolarHBondContact O-CA 3.3Å; R188-L199 HydrophobicContact CG-CD2 3.36Å; R188-L199 HydrophobicContact CG-CG 4.46Å; L199-I206 CarbonylContact O-C 3.59Å; L199-I207 CarbonylContact C-O 3.6Å; L199-I207 WeakPolarHBondContact CA-O 3.41Å; L199-I207 HydrophobicContact CB-CB 4.05Å; L199-I207 VanDerWaalsContact CB-O 3.29Å; L199-I207 WeakPolarHBondContact CB-O 2.83Å; L199-I207 PolarHBondContact N-O 3Å; L199-I207 CarbonylContact O-C 3.5Å; L199-I207 WeakPolarHBondContact O-CA 3.45Å; L199-I207 PolarHBondContact O-N 2.96Å; L199-E209 HydrophobicContact CD1-CB 3.83Å; L199-E209 HydrophobicContact CD1-CG 4.35Å |
| 200 | V | 83.7 | Confident | 80.3 | Confident | 31 Ų | 31 | 91.9 Ų | 91.9 | 19% | 0.188 | 49% | 0.485 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.8 | 123 | 177.5 | -178.8 | 0 | 0 | 0 | 0 | 107.6 | I186 R187 V189 | I186-V200 CarbonylContact C-O 3.57Å; I186-V200 WeakPolarHBondContact CA-O 3.46Å; R187-V200 PolarHBondContact N-O 3.24Å; R187-V200 PolarHBondContact O-N 3.41Å; V189-V200 HydrophobicContact CB-CG2 3.92Å; V189-V200 HydrophobicContact CG2-CB 4.29Å; V189-V200 HydrophobicContact CG2-CG2 3.8Å |
| 201 | R | 87.4 | Confident | 80.2 | Confident | 99 Ų | 99 | 90.8 Ų | 90.8 | 37% | 0.374 | 48% | 0.479 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.3 | 129.7 | 177.5 | -176.3 | 176 | -176.7 | 177.8 | 4.6 | 110.3 | Q183 V185 E203 G204 E205 I207 | Q183-R201 WeakPolarHBondContact O-CD 3.35Å; Q183-R201 WeakPolarHBondContact O-CG 3.29Å; Q183-R201 PolarHBondContact O-NE 2.97Å; V185-R201 WeakPolarHBondContact O-CA 2.99Å; R201-E203 PolarHBondContact O-N 2.66Å; R201-G204 PolarHBondContact O-N 3.19Å; R201-E205 HydrophobicContact CB-CB 4.42Å; R201-E205 PolarHBondContact N-O 2.94Å; R201-E205 PolarHBondContact O-N 3.14Å; R201-E205 VanDerWaalsContact O-N 3.15Å; R201-I207 HydrophobicContact CB-CD1 3.63Å; R201-I207 HydrophobicContact CB-CG1 4.18Å; R201-I207 HydrophobicContact CG-CD1 4.24Å |
| 202 | G | 81.8 | Confident | 80.4 | Confident | 14 Ų | 14 | 92 Ų | 92 | 14% | 0.144 | 49% | 0.487 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 53.3 | -117 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | R182 V185 | R182-G202 VanDerWaalsContact O-CA 3.31Å; R182-G202 WeakPolarHBondContact O-CA 3.46Å; V185-G202 PolarHBondContact O-N 2.86Å |
| 203 | E | 76.1 | Confident | 80.7 | Confident | 160 Ų | 160 | 96.7 Ų | 96.7 | 75% | 0.748 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.7 | 13.1 | -173.8 | -69.5 | -173.7 | 167.8 | 0 | 0 | 114.4 | R201 | R201-E203 PolarHBondContact O-N 2.66Š|
| 204 | G | 73.6 | Confident | 81.4 | Confident | 45 Ų | 45 | 94.8 Ų | 94.8 | 46% | 0.464 | 48% | 0.48 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 130.5 | 13.3 | 170.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | R201 I206 | R201-G204 PolarHBondContact O-N 3.19Å; G204-I206 PolarHBondContact O-N 3.43Å |
| 205 | E | 78.5 | Confident | 81.8 | Confident | 120 Ų | 120 | 97.4 Ų | 97.4 | 56% | 0.561 | 49% | 0.486 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -70.4 | 115.2 | 171.1 | -172.2 | 177.2 | -169.7 | 0 | 0 | 108.9 | R201 I207 | R201-E205 HydrophobicContact CB-CB 4.42Å; R201-E205 PolarHBondContact N-O 2.94Å; R201-E205 PolarHBondContact O-N 3.14Å; R201-E205 VanDerWaalsContact O-N 3.15Å; E205-I207 PolarHBondContact O-N 2.91Å |
| 206 | I | 77.9 | Confident | 82.6 | Confident | 90 Ų | 90 | 99.5 Ų | 99.5 | 46% | 0.462 | 48% | 0.48 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.3 | 115.6 | 178.8 | -61.1 | 178.7 | 0 | 0 | 0 | 108.5 | R198 L199 G204 | R198-I206 HydrophobicContact CB-CG2 3.93Å; R198-I206 HydrophobicContact CG-CG2 4.1Å; L199-I206 CarbonylContact O-C 3.59Å; G204-I206 PolarHBondContact O-N 3.43Å |
| 207 | I | 80 | Confident | 83.2 | Confident | 56 Ų | 56 | 98.3 Ų | 98.3 | 29% | 0.287 | 48% | 0.48 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 131.4 | 171.7 | -57 | -177.6 | 0 | 0 | 0 | 108.2 | L199 R201 E205 | L199-I207 CarbonylContact C-O 3.6Å; L199-I207 WeakPolarHBondContact CA-O 3.41Å; L199-I207 HydrophobicContact CB-CB 4.05Å; L199-I207 VanDerWaalsContact CB-O 3.29Å; L199-I207 WeakPolarHBondContact CB-O 2.83Å; L199-I207 PolarHBondContact N-O 3Å; L199-I207 CarbonylContact O-C 3.5Å; L199-I207 WeakPolarHBondContact O-CA 3.45Å; L199-I207 PolarHBondContact O-N 2.96Å; R201-I207 HydrophobicContact CB-CD1 3.63Å; R201-I207 HydrophobicContact CB-CG1 4.18Å; R201-I207 HydrophobicContact CG-CD1 4.24Å; E205-I207 PolarHBondContact O-N 2.91Å |
| 208 | E | 74.4 | Confident | 84 | Confident | 140 Ų | 140 | 97.4 Ų | 97.4 | 65% | 0.654 | 47% | 0.471 | S | S | * | . | P | Polyproline II helix | trans | -95.1 | 131.2 | 171.9 | -63.1 | -172.8 | 162.8 | 0 | 0 | 109.4 | I210 | E208-I210 PolarHBondContact O-N 3.36Š|
| 209 | E | 81.5 | Confident | 84.4 | Confident | 102 Ų | 102 | 98.8 Ų | 98.8 | 48% | 0.477 | 48% | 0.482 | S | S | . | . | P | Polyproline II helix | trans | -71 | 119.9 | 170.7 | -165.2 | 177.7 | 134 | 0 | 0 | 108 | R188 L199 V211 | R188-E209 IonicContact CZ-OE2 3.6Å; R188-E209 IonicContact NH2-OE2 3Å; R188-E209 PolarHBondContact NH2-OE2 3.34Å; L199-E209 HydrophobicContact CD1-CB 3.83Å; L199-E209 HydrophobicContact CD1-CG 4.35Å; E209-V211 PolarHBondContact O-N 3.45Å |
| 210 | I | 77.7 | Confident | 84.8 | Confident | 154 Ų | 154 | 101.2 Ų | 101.2 | 79% | 0.79 | 50% | 0.495 | S | S | * | . | P | Polyproline II helix | trans | -62.2 | 137.9 | 171.6 | -60 | 175.1 | 0 | 0 | 0 | 108 | E208 T212 | E208-I210 PolarHBondContact O-N 3.36Å; I210-T212 PolarHBondContact O-N 2.89Å |
| 211 | V | 81.8 | Confident | 85.3 | Confident | 67 Ų | 67 | 107 Ų | 107 | 41% | 0.406 | 52% | 0.518 | S | S | . | . | P | Polyproline II helix | trans | -54.5 | 132.2 | 177.2 | -175.7 | 0 | 0 | 0 | 0 | 110.3 | E209 K215 H216 I219 | E209-V211 PolarHBondContact O-N 3.45Å; V211-K215 HydrophobicContact CG1-CB 3.26Å; V211-K215 HydrophobicContact CG1-CD 4.35Å; V211-K215 HydrophobicContact CG1-CG 4.44Å; V211-H216 HydrophobicContact CG1-CB 4.32Å; V211-I219 HydrophobicContact CG1-CD1 3.99Å; V211-I219 HydrophobicContact CG2-CD1 4.5Å |
| 212 | T | 87.8 | Confident | 85.6 | Confident | 59 Ų | 59 | 109.3 Ų | 109.3 | 36% | 0.362 | 53% | 0.532 | S | S | . | . | P | Polyproline II helix | trans | -58.3 | 152.9 | 176.3 | 62.1 | 0 | 0 | 0 | 0 | 110.9 | I210 E214 K215 H216 | I210-T212 PolarHBondContact O-N 2.89Å; T212-E214 PolarHBondContact O-N 3.21Å; T212-E214 VanDerWaalsContact O-N 3.14Å; T212-K215 PolarHBondContact O-N 3.48Å; T212-K215 VanDerWaalsContact O-N 3.17Å; T212-K215 WeakPolarHBondContact OG1-CB 3.5Å; T212-K215 WeakPolarHBondContact OG1-CG 3.39Å; T212-H216 WeakPolarHBondContact O-CB 3.33Å; T212-H216 PolarHBondContact O-N 2.81Å |
| 213 | R | 89.6 | Confident | 86.2 | Confident | 222 Ų | 222 | 112.3 Ų | 112.3 | 84% | 0.838 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -55.7 | -35.4 | -177.8 | -69.4 | -178.2 | -179.7 | 174.1 | 0.7 | 112.9 | K217 | R213-K217 WeakPolarHBondContact O-CG 3.35Å; R213-K217 PolarHBondContact O-N 2.93Å; R213-K217 VanDerWaalsContact O-N 3.1Å |
| 214 | E | 89.3 | Confident | 87 | Confident | 145 Ų | 145 | 108.8 Ų | 108.8 | 68% | 0.678 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -68.2 | -52.5 | 177.5 | -67.6 | 171.9 | -179.1 | 0 | 0 | 111.3 | T212 H216 K217 D218 | T212-E214 PolarHBondContact O-N 3.21Å; T212-E214 VanDerWaalsContact O-N 3.14Å; E214-H216 PolarHBondContact O-N 3.25Å; E214-K217 WeakPolarHBondContact O-CA 3.45Å; E214-K217 WeakPolarHBondContact O-CB 3.49Å; E214-K217 PolarHBondContact O-N 2.86Å; E214-D218 PolarHBondContact O-N 3.1Å |
| 215 | K | 90.7 | Very high | 87.8 | Confident | 124 Ų | 124 | 113.3 Ų | 113.3 | 54% | 0.539 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -58.4 | -36.9 | 175.4 | -72.2 | 178.9 | -178.6 | 179.6 | 0 | 112 | V211 T212 D218 I219 | V211-K215 HydrophobicContact CG1-CB 3.26Å; V211-K215 HydrophobicContact CG1-CD 4.35Å; V211-K215 HydrophobicContact CG1-CG 4.44Å; T212-K215 PolarHBondContact O-N 3.48Å; T212-K215 VanDerWaalsContact O-N 3.17Å; T212-K215 WeakPolarHBondContact OG1-CB 3.5Å; T212-K215 WeakPolarHBondContact OG1-CG 3.39Å; K215-D218 PolarHBondContact O-N 3.24Å; K215-I219 VanDerWaalsContact O-CG1 3.24Å; K215-I219 WeakPolarHBondContact O-CG1 3.46Å; K215-I219 PolarHBondContact O-N 3.27Å |
| 216 | H | 94.7 | Very high | 88.3 | Confident | 99 Ų | 99 | 109.9 Ų | 109.9 | 46% | 0.458 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -65.2 | -38.7 | 175.5 | -172.8 | -81.8 | 0 | 0 | 0 | 112 | V211 T212 E214 N220 | V211-H216 HydrophobicContact CG1-CB 4.32Å; T212-H216 WeakPolarHBondContact O-CB 3.33Å; T212-H216 PolarHBondContact O-N 2.81Å; E214-H216 PolarHBondContact O-N 3.25Å; H216-N220 PolarHBondContact CE1-ND2 3.41Å; H216-N220 PolarHBondContact O-N 3.03Å |
| 217 | K | 93.9 | Very high | 89 | Confident | 147 Ų | 147 | 111.3 Ų | 111.3 | 64% | 0.639 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.5 | -40.8 | 172.3 | -72.6 | 172.5 | -180 | -177.6 | 0 | 111.4 | R213 E214 N220 K221 | R213-K217 WeakPolarHBondContact O-CG 3.35Å; R213-K217 PolarHBondContact O-N 2.93Å; R213-K217 VanDerWaalsContact O-N 3.1Å; E214-K217 WeakPolarHBondContact O-CA 3.45Å; E214-K217 WeakPolarHBondContact O-CB 3.49Å; E214-K217 PolarHBondContact O-N 2.86Å; K217-N220 PolarHBondContact O-N 3.31Å; K217-K221 WeakPolarHBondContact O-CB 3.24Å; K217-K221 PolarHBondContact O-N 2.98Å |
| 218 | D | 94.5 | Very high | 89.4 | Confident | 86 Ų | 86 | 110.2 Ų | 110.2 | 46% | 0.46 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -66.3 | -41.5 | 178.7 | -66.4 | -28.9 | 0 | 0 | 0 | 112.2 | E214 K215 N220 K221 Q222 | E214-D218 PolarHBondContact O-N 3.1Å; K215-D218 PolarHBondContact O-N 3.24Å; D218-N220 VanDerWaalsContact C-N 3.34Å; D218-N220 PolarHBondContact O-N 2.87Å; D218-K221 WeakPolarHBondContact O-CB 3.35Å; D218-K221 PolarHBondContact O-N 3.17Å; D218-Q222 WeakPolarHBondContact O-CB 3.34Å; D218-Q222 WeakPolarHBondContact O-CG 3.35Å; D218-Q222 PolarHBondContact O-N 3.14Å |
| 219 | I | 93.1 | Very high | 90 | Very high | 86 Ų | 86 | 106.8 Ų | 106.8 | 44% | 0.441 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -59.4 | -46.8 | 173.1 | -69.6 | 165.6 | 0 | 0 | 0 | 110.1 | V211 K215 K221 Q222 A223 | V211-I219 HydrophobicContact CG1-CD1 3.99Å; V211-I219 HydrophobicContact CG2-CD1 4.5Å; K215-I219 VanDerWaalsContact O-CG1 3.24Å; K215-I219 WeakPolarHBondContact O-CG1 3.46Å; K215-I219 PolarHBondContact O-N 3.27Å; I219-K221 VanDerWaalsContact C-N 3.3Å; I219-K221 PolarHBondContact O-N 3.28Å; I219-Q222 PolarHBondContact O-N 3.4Å; I219-A223 VanDerWaalsContact O-CB 3.28Å; I219-A223 WeakPolarHBondContact O-CB 3.48Å; I219-A223 PolarHBondContact O-N 2.98Å |
| 220 | N | 93.7 | Very high | 90.3 | Very high | 80 Ų | 80 | 104 Ų | 104 | 43% | 0.428 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.5 | -39.4 | 177.1 | -75.6 | -8.8 | 0 | 0 | 0 | 112 | H216 K217 D218 A223 T224 | H216-N220 PolarHBondContact CE1-ND2 3.41Å; H216-N220 PolarHBondContact O-N 3.03Å; K217-N220 PolarHBondContact O-N 3.31Å; D218-N220 VanDerWaalsContact C-N 3.34Å; D218-N220 PolarHBondContact O-N 2.87Å; N220-A223 PolarHBondContact O-N 3.06Å; N220-T224 WeakPolarHBondContact O-CB 3.34Å; N220-T224 WeakPolarHBondContact O-CG2 3.44Å; N220-T224 PolarHBondContact O-N 3.48Å; N220-T224 PolarHBondContact O-OG1 2.83Å |
| 221 | K | 93.3 | Very high | 90.8 | Very high | 153 Ų | 153 | 102.9 Ų | 102.9 | 67% | 0.665 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -65.3 | -42.7 | 176.7 | -172.3 | 177.9 | -179.2 | -177.6 | 0 | 111.5 | K217 D218 I219 T224 K225 | K217-K221 WeakPolarHBondContact O-CB 3.24Å; K217-K221 PolarHBondContact O-N 2.98Å; D218-K221 WeakPolarHBondContact O-CB 3.35Å; D218-K221 PolarHBondContact O-N 3.17Å; I219-K221 VanDerWaalsContact C-N 3.3Å; I219-K221 PolarHBondContact O-N 3.28Å; K221-T224 PolarHBondContact O-OG1 3.33Å; K221-K225 WeakPolarHBondContact O-CB 3.41Å; K221-K225 PolarHBondContact O-N 3.4Å |
| 222 | Q | 93.6 | Very high | 91.1 | Very high | 146 Ų | 146 | 103.3 Ų | 103.3 | 68% | 0.682 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -66.2 | -44.2 | 175.9 | -73.7 | 178.4 | -1.4 | 0 | 0 | 111.6 | D218 I219 T224 K225 | D218-Q222 WeakPolarHBondContact O-CB 3.34Å; D218-Q222 WeakPolarHBondContact O-CG 3.35Å; D218-Q222 PolarHBondContact O-N 3.14Å; I219-Q222 PolarHBondContact O-N 3.4Å; Q222-T224 VanDerWaalsContact C-N 3.32Å; Q222-T224 PolarHBondContact O-N 2.7Å; Q222-K225 WeakPolarHBondContact O-CB 3.28Å; Q222-K225 PolarHBondContact O-N 3.28Å |
| 223 | A | 93.8 | Very high | 91.1 | Very high | 78 Ų | 78 | 108.3 Ų | 108.3 | 65% | 0.645 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -61.9 | -38.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | I219 N220 | I219-A223 VanDerWaalsContact O-CB 3.28Å; I219-A223 WeakPolarHBondContact O-CB 3.48Å; I219-A223 PolarHBondContact O-N 2.98Å; N220-A223 PolarHBondContact O-N 3.06Å |
| 224 | T | 93.3 | Very high | 91.1 | Very high | 86 Ų | 86 | 106.7 Ų | 106.7 | 53% | 0.528 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -86.5 | -10.1 | 179.8 | 54.6 | 0 | 0 | 0 | 0 | 114.1 | N220 K221 Q222 G226 D227 G228 | N220-T224 WeakPolarHBondContact O-CB 3.34Å; N220-T224 WeakPolarHBondContact O-CG2 3.44Å; N220-T224 PolarHBondContact O-N 3.48Å; N220-T224 PolarHBondContact O-OG1 2.83Å; K221-T224 PolarHBondContact O-OG1 3.33Å; Q222-T224 VanDerWaalsContact C-N 3.32Å; Q222-T224 PolarHBondContact O-N 2.7Å; T224-G226 VanDerWaalsContact C-N 3.28Å; T224-G226 PolarHBondContact O-N 3.11Å; T224-D227 PolarHBondContact O-N 3.1Å; T224-G228 PolarHBondContact O-N 3.13Å |
| 225 | K | 90.8 | Very high | 91.1 | Very high | 140 Ų | 140 | 103.9 Ų | 103.9 | 61% | 0.609 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -58.4 | -37.7 | -179.7 | -169.4 | 177.4 | 179.7 | -176.8 | 0 | 112.8 | K221 Q222 N229 | K221-K225 WeakPolarHBondContact O-CB 3.41Å; K221-K225 PolarHBondContact O-N 3.4Å; Q222-K225 WeakPolarHBondContact O-CB 3.28Å; Q222-K225 PolarHBondContact O-N 3.28Å; K225-N229 WeakPolarHBondContact O-CB 3.26Å; K225-N229 VanDerWaalsContact O-CG 3.27Å; K225-N229 PolarHBondContact O-N 3.06Å |
| 226 | G | 90.2 | Very high | 90.7 | Very high | 48 Ų | 48 | 100.2 Ų | 100.2 | 50% | 0.495 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.8 | -41.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | T224 N229 A230 | T224-G226 VanDerWaalsContact C-N 3.28Å; T224-G226 PolarHBondContact O-N 3.11Å; G226-N229 PolarHBondContact O-N 3.34Å; G226-A230 WeakPolarHBondContact O-CB 3.4Å; G226-A230 PolarHBondContact O-N 2.84Å |
| 227 | D | 91.3 | Very high | 89.8 | Confident | 119 Ų | 119 | 101.8 Ų | 101.8 | 64% | 0.636 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -68.6 | -43.8 | 177.7 | -170.3 | 21.5 | 0 | 0 | 0 | 111.2 | T224 N229 A230 F231 | T224-D227 PolarHBondContact O-N 3.1Å; D227-N229 VanDerWaalsContact C-N 3.32Å; D227-N229 PolarHBondContact O-N 3.43Å; D227-A230 PolarHBondContact O-N 3.22Å; D227-A230 VanDerWaalsContact O-N 3.1Å; D227-F231 WeakPolarHBondContact O-CB 3.49Å; D227-F231 PolarHBondContact O-N 2.97Å |
| 228 | G | 88.4 | Confident | 88.4 | Confident | 33 Ų | 33 | 98.6 Ų | 98.6 | 34% | 0.34 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -56.2 | -44.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | T224 F231 Q232 | T224-G228 PolarHBondContact O-N 3.13Å; G228-F231 PolarHBondContact O-N 2.78Å; G228-Q232 WeakPolarHBondContact O-CB 3.4Å; G228-Q232 WeakPolarHBondContact O-CG 3.33Å; G228-Q232 PolarHBondContact O-N 3.43Å |
| 229 | N | 86.5 | Confident | 86.7 | Confident | 69 Ų | 69 | 109.2 Ų | 109.2 | 37% | 0.369 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -67.1 | -35.6 | 175.9 | -73.4 | -12.4 | 0 | 0 | 0 | 112.9 | K225 G226 D227 R233 | K225-N229 WeakPolarHBondContact O-CB 3.26Å; K225-N229 VanDerWaalsContact O-CG 3.27Å; K225-N229 PolarHBondContact O-N 3.06Å; G226-N229 PolarHBondContact O-N 3.34Å; D227-N229 VanDerWaalsContact C-N 3.32Å; D227-N229 PolarHBondContact O-N 3.43Å; N229-R233 WeakPolarHBondContact O-CB 3.42Å; N229-R233 VanDerWaalsContact O-CG 3.26Å; N229-R233 WeakPolarHBondContact O-CG 3.42Å; N229-R233 PolarHBondContact O-N 3.05Å; N229-R233 VanDerWaalsContact O-N 3.13Å; N229-R233 PolarHBondContact O-NE 2.91Å; N229-R233 VanDerWaalsContact O-NE 3.11Å |
| 230 | A | 87.7 | Confident | 86.4 | Confident | 44 Ų | 44 | 110.4 Ų | 110.4 | 36% | 0.364 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -67.9 | -42.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | G226 D227 R233 K234 | G226-A230 WeakPolarHBondContact O-CB 3.4Å; G226-A230 PolarHBondContact O-N 2.84Å; D227-A230 PolarHBondContact O-N 3.22Å; D227-A230 VanDerWaalsContact O-N 3.1Å; A230-R233 PolarHBondContact O-N 3.45Å; A230-K234 WeakPolarHBondContact O-CB 3.5Å; A230-K234 PolarHBondContact O-N 3Å |
| 231 | F | 88.3 | Confident | 86 | Confident | 129 Ų | 129 | 112 Ų | 112 | 57% | 0.566 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -64.3 | -45.5 | 176.4 | -177.4 | -105.1 | 0 | 0 | 0 | 112.5 | D227 G228 R233 K234 L235 | D227-F231 WeakPolarHBondContact O-CB 3.49Å; D227-F231 PolarHBondContact O-N 2.97Å; G228-F231 PolarHBondContact O-N 2.78Å; F231-R233 VanDerWaalsContact C-N 3.35Å; F231-R233 PolarHBondContact O-N 3.45Å; F231-K234 WeakPolarHBondContact O-CB 3.42Å; F231-K234 PolarHBondContact O-N 3.41Å; F231-K234 VanDerWaalsContact O-N 3.16Å; F231-L235 HydrophobicContact CD1-CD1 3.72Å; F231-L235 HydrophobicContact CD2-CD1 4.34Å; F231-L235 HydrophobicContact CE1-CD1 3.15Å; F231-L235 HydrophobicContact CE2-CD1 3.85Å; F231-L235 HydrophobicContact CG-CD1 4.29Å; F231-L235 HydrophobicContact CZ-CD1 3.24Å; F231-L235 PolarHBondContact O-N 3.13Å |
| 232 | Q | 89.9 | Confident | 85.6 | Confident | 76 Ų | 76 | 109.7 Ų | 109.7 | 36% | 0.355 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.6 | -38.2 | 177 | -75.7 | 176.4 | -19.4 | 0 | 0 | 112.7 | G228 L235 G236 M237 N238 | G228-Q232 WeakPolarHBondContact O-CB 3.4Å; G228-Q232 WeakPolarHBondContact O-CG 3.33Å; G228-Q232 PolarHBondContact O-N 3.43Å; Q232-L235 PolarHBondContact O-N 3.16Å; Q232-G236 PolarHBondContact O-N 3Å; Q232-M237 PolarHBondContact O-N 3.07Å; Q232-M237 VanDerWaalsContact O-N 3.15Å; Q232-N238 WeakPolarHBondContact CB-ND2 3.5Å; Q232-N238 PolarHBondContact OE1-ND2 3.15Å |
| 233 | R | 87.6 | Confident | 85.2 | Confident | 165 Ų | 165 | 107.6 Ų | 107.6 | 62% | 0.623 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -63.3 | -41.2 | 172.1 | -77.7 | -177.9 | -71.3 | 172.2 | -1.5 | 111.8 | N229 A230 F231 L235 G236 | N229-R233 WeakPolarHBondContact O-CB 3.42Å; N229-R233 VanDerWaalsContact O-CG 3.26Å; N229-R233 WeakPolarHBondContact O-CG 3.42Å; N229-R233 PolarHBondContact O-N 3.05Å; N229-R233 VanDerWaalsContact O-N 3.13Å; N229-R233 PolarHBondContact O-NE 2.91Å; N229-R233 VanDerWaalsContact O-NE 3.11Å; A230-R233 PolarHBondContact O-N 3.45Å; F231-R233 VanDerWaalsContact C-N 3.35Å; F231-R233 PolarHBondContact O-N 3.45Å; R233-L235 VanDerWaalsContact C-N 3.3Å; R233-L235 PolarHBondContact O-N 3.35Å; R233-G236 PolarHBondContact O-N 3.18Å; R233-G236 VanDerWaalsContact O-N 3.13Å |
| 234 | K | 88.9 | Confident | 84.6 | Confident | 187 Ų | 187 | 109.4 Ų | 109.4 | 81% | 0.813 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -63.7 | -34.3 | 176.3 | -173.4 | 177.9 | -179.8 | -178.7 | 0 | 112.8 | A230 F231 G236 | A230-K234 WeakPolarHBondContact O-CB 3.5Å; A230-K234 PolarHBondContact O-N 3Å; F231-K234 WeakPolarHBondContact O-CB 3.42Å; F231-K234 PolarHBondContact O-N 3.41Å; F231-K234 VanDerWaalsContact O-N 3.16Å; K234-G236 VanDerWaalsContact C-N 3.29Å |
| 235 | L | 88.7 | Confident | 84 | Confident | 87 Ų | 87 | 111 Ų | 111 | 46% | 0.455 | 56% | 0.557 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82 | -3.2 | 175.6 | -91.5 | 150.3 | 0 | 0 | 0 | 114 | F231 Q232 R233 M237 | F231-L235 HydrophobicContact CD1-CD1 3.72Å; F231-L235 HydrophobicContact CD2-CD1 4.34Å; F231-L235 HydrophobicContact CE1-CD1 3.15Å; F231-L235 HydrophobicContact CE2-CD1 3.85Å; F231-L235 HydrophobicContact CG-CD1 4.29Å; F231-L235 HydrophobicContact CZ-CD1 3.24Å; F231-L235 PolarHBondContact O-N 3.13Å; Q232-L235 PolarHBondContact O-N 3.16Å; R233-L235 VanDerWaalsContact C-N 3.3Å; R233-L235 PolarHBondContact O-N 3.35Å; L235-M237 HydrophobicContact CB-CE 4.07Å; L235-M237 HydrophobicContact CB-CG 4.07Å; L235-M237 HydrophobicContact CB-SD 4.02Å; L235-M237 HydrophobicContact CD1-CE 4.33Å; L235-M237 HydrophobicContact CD1-SD 4.5Å; L235-M237 HydrophobicContact CD2-CE 3.84Å; L235-M237 HydrophobicContact CG-CE 4.31Å; L235-M237 PolarHBondContact O-N 3.26Å |
| 236 | G | 81.8 | Confident | 83.6 | Confident | 47 Ų | 47 | 108.9 Ų | 108.9 | 49% | 0.485 | 55% | 0.553 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 68 | 15 | 180 | 0 | 0 | 0 | 0 | 0 | 114.6 | Q232 R233 K234 | Q232-G236 PolarHBondContact O-N 3Å; R233-G236 PolarHBondContact O-N 3.18Å; R233-G236 VanDerWaalsContact O-N 3.13Å; K234-G236 VanDerWaalsContact C-N 3.29Å |
| 237 | M | 77.1 | Confident | 83.1 | Confident | 131 Ų | 131 | 113.6 Ų | 113.6 | 65% | 0.645 | 56% | 0.558 | S | S | * | * | trans | -81.1 | -24 | -177.8 | -67.6 | 171.8 | -179.3 | 0 | 0 | 112.8 | Q232 L235 | Q232-M237 PolarHBondContact O-N 3.07Å; Q232-M237 VanDerWaalsContact O-N 3.15Å; L235-M237 HydrophobicContact CB-CE 4.07Å; L235-M237 HydrophobicContact CB-CG 4.07Å; L235-M237 HydrophobicContact CB-SD 4.02Å; L235-M237 HydrophobicContact CD1-CE 4.33Å; L235-M237 HydrophobicContact CD1-SD 4.5Å; L235-M237 HydrophobicContact CD2-CE 3.84Å; L235-M237 HydrophobicContact CG-CE 4.31Å; L235-M237 PolarHBondContact O-N 3.26Å | ||
| 238 | N | 63.9 | Low | 82.4 | Confident | 81 Ų | 81 | 113.2 Ų | 113.2 | 43% | 0.433 | 55% | 0.551 | S | S | . | * | trans | -112.3 | 87.5 | 172.3 | -63.1 | -7.5 | 0 | 0 | 0 | 108 | Q232 | Q232-N238 WeakPolarHBondContact CB-ND2 3.5Å; Q232-N238 PolarHBondContact OE1-ND2 3.15Å | ||
| 239 | R | 59.7 | Low | 81.8 | Confident | 309 Ų | 309 | 120.5 Ų | 120.5 | 100% | 1.166 | 57% | 0.57 | S | S | * | * | trans | -102 | 0 | 164.4 | -108.4 | -173.6 | -176.6 | -174.5 | 1.8 | 109.3 |
Retrieved 239 of 239 residues in 265.8 ms
(Link to these results)