| 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 | 39.8 | Very low | 42.4 | Very low | 247 Ų | 247 | 165.5 Ų | 165.5 | 100% | 1.217 | 84% | 0.84 | S | S | * | * | 0 | 142.8 | 0 | -83.5 | -155.7 | 168.3 | 0 | 0 | 109.6 | |||||
| 2 | G | 44 | Very low | 42.3 | Very low | 64 Ų | 64 | 160.1 Ų | 160.1 | 66% | 0.66 | 83% | 0.828 | S | S | * | * | trans | 75.5 | 109 | 158.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 3 | R | 40.7 | Very low | 42.2 | Very low | 242 Ų | 242 | 163.1 Ų | 163.1 | 91% | 0.913 | 83% | 0.831 | S | S | * | * | 68.2 | 137.9 | 81.8 | -71.7 | 174 | 172.8 | -165.8 | -1.2 | 111.4 | |||||
| 4 | S | 42 | Very low | 42.3 | Very low | 72 Ų | 72 | 163.1 Ų | 163.1 | 50% | 0.503 | 83% | 0.826 | S | S | . | * | cis | 170 | 144.9 | -0.7 | -84.5 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 5 | R | 43.1 | Very low | 42.4 | Very low | 228 Ų | 228 | 159.9 Ų | 159.9 | 86% | 0.86 | 82% | 0.824 | S | S | * | * | trans | 69.5 | 140.5 | 145.9 | -60.6 | 160.8 | 176.5 | 135.9 | -3.2 | 116.4 | ||||
| 6 | S | 43.6 | Very low | 43.1 | Very low | 106 Ų | 106 | 161.3 Ų | 161.3 | 74% | 0.741 | 82% | 0.822 | S | S | * | * | cis | -168 | 132.6 | 42.5 | -49.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 7 | R | 40.3 | Very low | 43.3 | Very low | 239 Ų | 239 | 158.7 Ų | 158.7 | 90% | 0.902 | 82% | 0.822 | S | S | * | * | 55 | 116.1 | 99.2 | -74.9 | -177.1 | 173.7 | 147.6 | -1.5 | 118.2 | |||||
| 8 | S | 42.8 | Very low | 43.3 | Very low | 112 Ų | 112 | 156.4 Ų | 156.4 | 78% | 0.783 | 82% | 0.822 | S | S | * | * | trans | -175.5 | 95.9 | 137.5 | -70.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 9 | T | 40.8 | Very low | 43.4 | Very low | 136 Ų | 136 | 159 Ų | 159 | 83% | 0.834 | 83% | 0.826 | S | S | * | * | 54.3 | 95.7 | 92 | 71.3 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 10 | S | 46.1 | Very low | 43.4 | Very low | 126 Ų | 126 | 160.7 Ų | 160.7 | 88% | 0.881 | 83% | 0.829 | S | S | * | * | trans | -143.9 | 126 | 144.7 | 48.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 11 | R | 43.8 | Very low | 43.6 | Very low | 249 Ų | 249 | 158.2 Ų | 158.2 | 94% | 0.94 | 83% | 0.826 | S | S | * | * | trans | -85.3 | 151.8 | -179.5 | -72.8 | 168.6 | 162.6 | 170.3 | -5.5 | 110.3 | ||||
| 12 | S | 40.8 | Very low | 43.8 | Very low | 100 Ų | 100 | 155.9 Ų | 155.9 | 70% | 0.699 | 81% | 0.809 | S | S | * | * | trans | 131.2 | 126.8 | 158.9 | 169.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 13 | K | 41 | Very low | 43.9 | Very low | 199 Ų | 199 | 163 Ų | 163 | 87% | 0.865 | 82% | 0.822 | S | S | * | * | cis | -160.8 | 158.4 | 12.1 | -105.9 | 163.3 | -168.2 | -179.4 | 0 | 108.1 | ||||
| 14 | H | 43.2 | Very low | 43.7 | Very low | 164 Ų | 164 | 163.1 Ų | 163.1 | 76% | 0.759 | 82% | 0.822 | S | S | * | * | trans | -57.9 | 134.5 | 174.4 | -116.3 | -21.8 | 0 | 0 | 0 | 113.7 | ||||
| 15 | S | 44 | Very low | 43.8 | Very low | 115 Ų | 115 | 165.1 Ų | 165.1 | 80% | 0.804 | 84% | 0.836 | S | S | * | * | trans | -141 | 110.3 | 144.5 | 60.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 16 | K | 54.3 | Low | 43.5 | Very low | 181 Ų | 181 | 164.7 Ų | 164.7 | 79% | 0.787 | 84% | 0.835 | S | S | * | * | trans | -79.8 | 118.4 | 172.2 | -69.1 | -177.2 | 177.9 | 175.2 | 0 | 108.8 | ||||
| 17 | S | 45.6 | Very low | 43.4 | Very low | 118 Ų | 118 | 165.1 Ų | 165.1 | 83% | 0.825 | 84% | 0.838 | S | S | * | * | trans | -164.5 | 148.1 | 153.5 | -174.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 18 | S | 43.2 | Very low | 43.2 | Very low | 118 Ų | 118 | 163.3 Ų | 163.3 | 83% | 0.825 | 83% | 0.831 | S | S | * | * | trans | 99.4 | 118.4 | 161.1 | -156.8 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 19 | K | 45.8 | Very low | 43.1 | Very low | 205 Ų | 205 | 163.9 Ų | 163.9 | 89% | 0.891 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -85.1 | 146.9 | -162.8 | -72 | 158.4 | 171.7 | 167.3 | 0 | 110.7 | S21 | K19-S21 PolarHBondContact O-N 3.3Š|
| 20 | H | 44.1 | Very low | 42.8 | Very low | 192 Ų | 192 | 167.6 Ų | 167.6 | 89% | 0.889 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -46.9 | 128 | 177.2 | -84.4 | -60.7 | 0 | 0 | 0 | 114.6 | ||
| 21 | S | 46.3 | Very low | 42.3 | Very low | 109 Ų | 109 | 166.8 Ų | 166.8 | 76% | 0.762 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 125.3 | 152.9 | 56.8 | 0 | 0 | 0 | 0 | 109.5 | K19 | K19-S21 PolarHBondContact O-N 3.3Š|
| 22 | K | 45.3 | Very low | 42 | Very low | 199 Ų | 199 | 166 Ų | 166 | 87% | 0.865 | 83% | 0.825 | S | S | * | * | trans | -154.1 | 110.1 | 154.1 | -117 | 166.5 | -173.9 | 173.9 | 0 | 110.5 | ||||
| 23 | K | 45.1 | Very low | 41.9 | Very low | 213 Ų | 213 | 168.7 Ų | 168.7 | 93% | 0.926 | 83% | 0.831 | S | S | * | * | trans | -52.9 | 134.8 | 173.3 | -62.5 | -171.2 | 174.9 | -174.6 | 0 | 110.4 | ||||
| 24 | R | 35.6 | Very low | 41.7 | Very low | 245 Ų | 245 | 170.7 Ų | 170.7 | 93% | 0.925 | 83% | 0.833 | S | S | * | * | trans | -136.5 | 91.2 | 171.4 | -159.7 | 177.8 | -171.5 | 176 | 2.5 | 109.9 | ||||
| 25 | S | 45.2 | Very low | 41.6 | Very low | 114 Ų | 114 | 171.8 Ų | 171.8 | 80% | 0.797 | 84% | 0.839 | S | S | * | * | trans | -92.6 | 111.2 | 159.8 | 40.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 26 | R | 35.9 | Very low | 41.2 | Very low | 218 Ų | 218 | 176.7 Ų | 176.7 | 82% | 0.823 | 84% | 0.84 | S | S | * | * | trans | -163.7 | 100 | 154.6 | -126 | 173.3 | 177.7 | 115.4 | -2.8 | 110.4 | ||||
| 27 | S | 43 | Very low | 40.7 | Very low | 115 Ų | 115 | 173.3 Ų | 173.3 | 80% | 0.804 | 84% | 0.839 | S | S | * | * | trans | -54 | 131.1 | 163.6 | 34 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 28 | R | 35.3 | Very low | 40.4 | Very low | 202 Ų | 202 | 176.3 Ų | 176.3 | 76% | 0.762 | 84% | 0.837 | S | S | * | * | trans | -160.6 | 94.7 | 158.3 | -113.3 | 170.6 | -175 | 148.2 | 0.9 | 109.4 | R30 | R28-R30 PolarHBondContact O-N 3.12Š| ||
| 29 | S | 40.2 | Very low | 40.5 | Very low | 123 Ų | 123 | 180.8 Ų | 180.8 | 86% | 0.86 | 84% | 0.842 | S | S | * | * | trans | -46.4 | 123.6 | 162.3 | 9.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 30 | R | 35.3 | Very low | 39.9 | Very low | 214 Ų | 214 | 181.8 Ų | 181.8 | 81% | 0.808 | 84% | 0.84 | S | S | * | * | trans | -144.2 | 105.9 | 161.2 | -76.3 | -165.5 | 173.7 | 140.2 | -3.5 | 110.4 | R28 | R28-R30 PolarHBondContact O-N 3.12Š| ||
| 31 | S | 36.3 | Very low | 39.8 | Very low | 109 Ų | 109 | 178.1 Ų | 178.1 | 76% | 0.762 | 84% | 0.835 | S | S | * | * | trans | -41.9 | 138.4 | 159.4 | -173.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 32 | R | 36.7 | Very low | 39.3 | Very low | 232 Ų | 232 | 181.8 Ų | 181.8 | 88% | 0.875 | 84% | 0.838 | S | S | * | * | trans | -121.5 | 88.3 | 169.9 | -85.5 | -175.2 | 174.7 | 163.7 | -0.8 | 109 | R34 | R32-R34 PolarHBondContact O-N 3.13Š| ||
| 33 | D | 37.8 | Very low | 39 | Very low | 157 Ų | 157 | 177.7 Ų | 177.7 | 84% | 0.84 | 83% | 0.834 | S | S | * | * | trans | -51.7 | 126.3 | 148.7 | -88.7 | -68.1 | 0 | 0 | 0 | 109.8 | ||||
| 34 | R | 38.4 | Very low | 38.9 | Very low | 241 Ų | 241 | 179 Ų | 179 | 91% | 0.909 | 83% | 0.833 | S | S | * | * | trans | -114.3 | 79.2 | 175.9 | -108.4 | -174.1 | 179.7 | 161.5 | -1.4 | 108.5 | R32 | R32-R34 PolarHBondContact O-N 3.13Š| ||
| 35 | E | 40.5 | Very low | 39 | Very low | 187 Ų | 187 | 175.7 Ų | 175.7 | 87% | 0.874 | 83% | 0.828 | S | S | * | * | trans | -143.4 | 110.6 | 154.2 | -80.5 | -151.6 | 161.3 | 0 | 0 | 109.9 | ||||
| 36 | R | 35.7 | Very low | 38.7 | Very low | 219 Ų | 219 | 175.7 Ų | 175.7 | 83% | 0.826 | 83% | 0.828 | S | S | * | * | trans | -164.5 | 107.8 | 141.2 | -141.5 | 161.3 | 177.9 | 174.8 | 0.9 | 111.7 | ||||
| 37 | S | 43.6 | Very low | 39.1 | Very low | 109 Ų | 109 | 174.3 Ų | 174.3 | 76% | 0.762 | 83% | 0.829 | S | S | * | * | trans | -44 | 137.9 | 156.2 | 44.7 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 38 | K | 39.1 | Very low | 38.7 | Very low | 181 Ų | 181 | 180.3 Ų | 180.3 | 79% | 0.787 | 83% | 0.833 | S | S | * | * | trans | -162.9 | 104.4 | 155.6 | -108.5 | 165.2 | -167 | -175.2 | 0 | 111.1 | ||||
| 39 | K | 44.8 | Very low | 38.8 | Very low | 213 Ų | 213 | 178.6 Ų | 178.6 | 93% | 0.926 | 84% | 0.84 | S | S | * | * | trans | -56.6 | 130.8 | 157.3 | -65.5 | -176.2 | 177.2 | -178.9 | 0 | 108.7 | ||||
| 40 | R | 33.3 | Very low | 38.8 | Very low | 226 Ų | 226 | 184.1 Ų | 184.1 | 85% | 0.853 | 84% | 0.842 | S | S | * | * | trans | -155.2 | 108.2 | 157.5 | -161.2 | 168.1 | -179.4 | 170.4 | 0.7 | 110.5 | ||||
| 41 | S | 43 | Very low | 39 | Very low | 114 Ų | 114 | 185.6 Ų | 185.6 | 80% | 0.797 | 85% | 0.847 | S | S | * | * | trans | -53.4 | 134.7 | 166.3 | 36.4 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 42 | K | 36.2 | Very low | 39.1 | Very low | 186 Ų | 186 | 191.7 Ų | 191.7 | 81% | 0.809 | 85% | 0.853 | S | S | * | * | trans | -158.3 | 120 | 153.3 | -127.7 | 170.1 | -179.4 | 178.2 | 0 | 111.3 | ||||
| 43 | S | 38.1 | Very low | 39 | Very low | 114 Ų | 114 | 188.3 Ų | 188.3 | 80% | 0.797 | 85% | 0.848 | S | S | * | * | trans | -45.6 | 138.4 | 174.2 | 47.3 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 44 | R | 42.1 | Very low | 39 | Very low | 240 Ų | 240 | 185.9 Ų | 185.9 | 91% | 0.906 | 84% | 0.843 | S | S | * | * | trans | -123.8 | 94.8 | 165 | -85.1 | -176.5 | 171.8 | 152 | -1.8 | 109.6 | S46 | R44-S46 PolarHBondContact O-N 3.49Š| ||
| 45 | E | 38 | Very low | 38.8 | Very low | 175 Ų | 175 | 185.1 Ų | 185.1 | 82% | 0.818 | 84% | 0.84 | S | S | * | * | trans | 2 | 103.6 | 141.5 | -152.6 | 72.5 | -151.7 | 0 | 0 | 114.8 | K47 | E45-K47 PolarHBondContact O-N 2.91Š| ||
| 46 | S | 39.6 | Very low | 38.7 | Very low | 114 Ų | 114 | 181.4 Ų | 181.4 | 80% | 0.797 | 84% | 0.835 | S | S | * | * | trans | -73.5 | 106.1 | 170.4 | 166.2 | 0 | 0 | 0 | 0 | 109.4 | R44 R48 | R44-S46 PolarHBondContact O-N 3.49Å; S46-R48 PolarHBondContact O-N 3.07Å | ||
| 47 | K | 43.8 | Very low | 38.6 | Very low | 190 Ų | 190 | 183 Ų | 183 | 83% | 0.826 | 84% | 0.841 | S | S | * | * | trans | -62.2 | 118.2 | 174 | -71.5 | -176.6 | 176.1 | 179.3 | 0 | 110.6 | E45 N49 | E45-K47 PolarHBondContact O-N 2.91Å; K47-N49 PolarHBondContact O-N 3.25Å | ||
| 48 | R | 34.9 | Very low | 38.4 | Very low | 240 Ų | 240 | 182.9 Ų | 182.9 | 91% | 0.906 | 84% | 0.84 | S | S | * | * | trans | -49.7 | 111.7 | 164.8 | -77.3 | 174.2 | 169.8 | 176.8 | -4.3 | 111 | S46 R50 | S46-R48 PolarHBondContact O-N 3.07Å; R48-R50 PolarHBondContact O-N 2.68Å | ||
| 49 | N | 37.8 | Very low | 38.3 | Very low | 167 Ų | 167 | 185.8 Ų | 185.8 | 89% | 0.893 | 85% | 0.846 | S | S | * | * | trans | -83.5 | 111.4 | 163.1 | -104.7 | -14.5 | 0 | 0 | 0 | 109.4 | K47 R51 | K47-N49 PolarHBondContact O-N 3.25Å; N49-R51 PolarHBondContact O-N 3.49Å | ||
| 50 | R | 39.2 | Very low | 38.2 | Very low | 239 Ų | 239 | 180.5 Ų | 180.5 | 90% | 0.902 | 84% | 0.836 | S | S | * | * | trans | -72.6 | 114 | 161.1 | -74.1 | 174.7 | 177.6 | 154.1 | -1.8 | 108 | R48 | R48-R50 PolarHBondContact O-N 2.68Š| ||
| 51 | R | 39.1 | Very low | 38.5 | Very low | 245 Ų | 245 | 176.5 Ų | 176.5 | 93% | 0.925 | 84% | 0.837 | S | S | * | * | trans | -143.8 | 110.5 | 148.9 | -110.8 | 177.2 | -178.6 | 179.8 | -1.3 | 109.7 | N49 E53 | N49-R51 PolarHBondContact O-N 3.49Å; R51-E53 PolarHBondContact O-N 3.22Å | ||
| 52 | R | 38.5 | Very low | 38.2 | Very low | 237 Ų | 237 | 177.9 Ų | 177.9 | 89% | 0.894 | 84% | 0.841 | S | S | * | * | trans | -53.1 | 124.5 | 161.7 | -76.6 | 169.6 | 165.9 | 168.5 | -6.3 | 108.3 | ||||
| 53 | E | 35.8 | Very low | 38.2 | Very low | 161 Ų | 161 | 173.6 Ų | 173.6 | 75% | 0.752 | 84% | 0.84 | S | S | * | * | trans | -134.1 | 108.9 | 149.7 | -167.9 | 65.4 | -144.3 | 0 | 0 | 106.6 | R51 | R51-E53 PolarHBondContact O-N 3.22Š| ||
| 54 | S | 37 | Very low | 38.2 | Very low | 106 Ų | 106 | 173.7 Ų | 173.7 | 74% | 0.741 | 84% | 0.841 | S | S | * | * | trans | -85.1 | 108.8 | 177.7 | -35.4 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 55 | R | 34.8 | Very low | 37.9 | Very low | 224 Ų | 224 | 167.4 Ų | 167.4 | 85% | 0.845 | 83% | 0.833 | S | S | * | * | trans | -147.1 | 95.3 | 160.3 | -125 | 168 | -178.2 | 145 | -3.1 | 111.7 | ||||
| 56 | S | 37.7 | Very low | 38 | Very low | 109 Ų | 109 | 170.4 Ų | 170.4 | 76% | 0.762 | 84% | 0.837 | S | S | * | * | trans | -49.6 | 133.6 | 164.8 | 32.2 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 57 | R | 34.2 | Very low | 37.8 | Very low | 253 Ų | 253 | 176 Ų | 176 | 96% | 0.955 | 84% | 0.841 | S | S | * | * | trans | -158 | 100.9 | 143.5 | -110.4 | 168.1 | -172.6 | 157.7 | 1.1 | 110.3 | ||||
| 58 | S | 39.3 | Very low | 37.6 | Very low | 107 Ų | 107 | 175.1 Ų | 175.1 | 75% | 0.748 | 84% | 0.839 | S | S | * | * | trans | -68.9 | 148.4 | 167.6 | -40.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 59 | R | 38 | Very low | 38.1 | Very low | 241 Ų | 241 | 174.9 Ų | 174.9 | 91% | 0.909 | 84% | 0.839 | S | S | * | * | trans | 157.7 | 133.6 | 147.3 | -89.8 | 162.2 | -172 | 173.5 | 1.8 | 107.2 | ||||
| 60 | S | 41.3 | Very low | 38 | Very low | 103 Ų | 103 | 172 Ų | 172 | 72% | 0.72 | 84% | 0.837 | S | S | * | * | cis | -174.4 | 129.8 | -8.5 | 30.6 | 0 | 0 | 0 | 0 | 104.1 | ||||
| 61 | T | 39.1 | Very low | 38.2 | Very low | 142 Ų | 142 | 164.5 Ų | 164.5 | 87% | 0.871 | 83% | 0.827 | S | S | * | * | trans | -70 | 127.5 | 168.3 | 45.2 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 62 | T | 38.4 | Very low | 38.2 | Very low | 143 Ų | 143 | 158.4 Ų | 158.4 | 88% | 0.877 | 82% | 0.822 | S | S | * | * | trans | -136.4 | 117.3 | 151.4 | 41.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 63 | A | 36 | Very low | 38.7 | Very low | 95 Ų | 95 | 152.4 Ų | 152.4 | 79% | 0.785 | 81% | 0.813 | S | S | * | * | trans | -90.4 | 157 | 172.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 64 | S | 37 | Very low | 39.4 | Very low | 117 Ų | 117 | 150.8 Ų | 150.8 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | trans | 72.2 | 113.5 | 150 | -162.2 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 65 | S | 36.2 | Very low | 39.9 | Very low | 107 Ų | 107 | 149.4 Ų | 149.4 | 75% | 0.748 | 80% | 0.799 | S | S | * | * | -154.5 | 111.5 | 125.3 | 65.6 | 0 | 0 | 0 | 0 | 111 | |||||
| 66 | R | 40.5 | Very low | 40.7 | Very low | 238 Ų | 238 | 149.4 Ų | 149.4 | 90% | 0.898 | 80% | 0.799 | S | S | * | * | trans | -53.6 | 134 | 153.4 | -75.6 | 174.9 | 176.8 | 178.6 | -1.7 | 109.2 | ||||
| 67 | R | 35.6 | Very low | 41.7 | Very low | 232 Ų | 232 | 149.6 Ų | 149.6 | 88% | 0.875 | 79% | 0.79 | S | S | * | * | trans | -142.6 | 104.1 | 150.5 | -91 | -179.2 | -177.8 | -171.7 | -0.6 | 106.6 | ||||
| 68 | E | 38.2 | Very low | 42.5 | Very low | 171 Ų | 171 | 141.9 Ų | 141.9 | 80% | 0.799 | 77% | 0.768 | S | S | * | * | 64.6 | 95.9 | 83.7 | -76.1 | -71.8 | 155.7 | 0 | 0 | 111.4 | A70 | E68-A70 PolarHBondContact O-N 3.17Š| |||
| 69 | R | 45.4 | Very low | 43.5 | Very low | 236 Ų | 236 | 144.5 Ų | 144.5 | 89% | 0.891 | 77% | 0.772 | S | S | * | * | trans | -21.9 | 106.4 | 151.5 | -168.2 | 170.7 | -169.4 | 166.9 | 1.1 | 112.7 | A71 | R69-A71 PolarHBondContact O-N 3.16Š| ||
| 70 | A | 36.8 | Very low | 44.1 | Very low | 105 Ų | 105 | 141.9 Ų | 141.9 | 87% | 0.868 | 77% | 0.767 | S | S | * | * | trans | -79.2 | 101.5 | 167.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | E68 | E68-A70 PolarHBondContact O-N 3.17Š| ||
| 71 | A | 43.7 | Very low | 44.8 | Very low | 83 Ų | 83 | 139.8 Ų | 139.8 | 69% | 0.686 | 76% | 0.762 | S | S | * | * | trans | -84 | 134.2 | 161.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | R69 | R69-A71 PolarHBondContact O-N 3.16Š| ||
| 72 | S | 39.3 | Very low | 46 | Very low | 117 Ų | 117 | 142.6 Ų | 142.6 | 82% | 0.818 | 76% | 0.757 | S | S | * | * | trans | 178.5 | 158.5 | 151.7 | -77.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 73 | P | 49.2 | Very low | 46.8 | Very low | 110 Ų | 110 | 139.1 Ų | 139.1 | 71% | 0.714 | 74% | 0.735 | S | S | * | * | cis | -125.3 | 170.1 | 1.8 | 10.7 | 15.8 | 0 | 0 | 0 | 114.1 | E75 | P73-E75 PolarHBondContact O-N 3.06Š| ||
| 74 | P | 49.1 | Very low | 47.5 | Very low | 127 Ų | 127 | 140.5 Ų | 140.5 | 83% | 0.825 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -70 | 127.4 | -172.8 | 29.1 | -34.1 | 0 | 0 | 0 | 112.4 | R76 | P74-R76 PolarHBondContact O-N 3.32Š|
| 75 | E | 47.9 | Very low | 48.6 | Very low | 78 Ų | 78 | 137.7 Ų | 137.7 | 36% | 0.364 | 71% | 0.709 | S | S | . | * | P | Polyproline II helix | trans | -69.1 | 124.8 | 170 | -71.9 | -179.2 | 166.1 | 0 | 0 | 108.7 | P73 I77 T83 R87 | P73-E75 PolarHBondContact O-N 3.06Å; E75-I77 PolarHBondContact O-N 3.48Å; E75-T83 HydrophobicContact CB-CG2 4.14Å; E75-T83 WeakPolarHBondContact OE2-CB 3.23Å; E75-T83 WeakPolarHBondContact OE2-CG2 3.24Å; E75-T83 PolarHBondContact OE2-OG1 3.19Å; E75-R87 IonicContact OE1-NH1 2.63Å; E75-R87 PolarHBondContact OE1-NH1 3.48Å; E75-R87 VanDerWaalsContact OE1-NH1 3.15Å |
| 76 | R | 51.7 | Low | 49.2 | Very low | 224 Ų | 224 | 142 Ų | 142 | 85% | 0.845 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 117.1 | 168.6 | -75.2 | -176.5 | -175.2 | -122.8 | 2.3 | 107.6 | P74 | P74-R76 PolarHBondContact O-N 3.32Š|
| 77 | I | 59.4 | Low | 49.7 | Very low | 113 Ų | 113 | 137.8 Ų | 137.8 | 58% | 0.579 | 70% | 0.698 | S | S | * | * | B | Isolated β-bridge | trans | -93 | 129.3 | -179.9 | -59.9 | 159 | 0 | 0 | 0 | 107.5 | E75 G81 T83 | E75-I77 PolarHBondContact O-N 3.48Å; I77-G81 VanDerWaalsContact CG2-CA 3.4Å; I77-T83 HydrophobicContact CG1-CG2 4.36Å |
| 78 | D | 50.8 | Low | 50.6 | Low | 91 Ų | 91 | 131 Ų | 131 | 49% | 0.487 | 68% | 0.683 | S | S | . | * | P | Polyproline II helix | trans | -76.7 | 165.5 | 173.4 | -165.5 | 2.4 | 0 | 0 | 0 | 110.4 | F80 G81 R82 | D78-F80 PolarHBondContact O-N 3.1Å; D78-G81 PolarHBondContact O-N 2.89Å; D78-R82 PolarHBondContact N-O 2.85Å |
| 79 | I | 58.8 | Low | 51.5 | Low | 162 Ų | 162 | 125.9 Ų | 125.9 | 83% | 0.831 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.1 | -14.4 | -173.4 | -68.6 | 162.9 | 0 | 0 | 0 | 113.8 | ||
| 80 | F | 52 | Low | 52.1 | Low | 185 Ų | 185 | 119.8 Ų | 119.8 | 81% | 0.811 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.8 | 18.3 | 174.6 | -77.4 | -82.7 | 0 | 0 | 0 | 115.8 | D78 R82 | D78-F80 PolarHBondContact O-N 3.1Å; F80-R82 PolarHBondContact O-N 2.84Å |
| 81 | G | 56.4 | Low | 53.2 | Low | 59 Ų | 59 | 117.6 Ų | 117.6 | 61% | 0.608 | 63% | 0.628 | S | S | * | * | S | Bend | trans | 72.9 | 10 | 171 | 0 | 0 | 0 | 0 | 0 | 115.1 | I77 D78 | I77-G81 VanDerWaalsContact CG2-CA 3.4Å; D78-G81 PolarHBondContact O-N 2.89Å |
| 82 | R | 64.1 | Low | 54 | Low | 202 Ų | 202 | 119.3 Ų | 119.3 | 76% | 0.762 | 62% | 0.622 | S | S | * | * | trans | -93.1 | 131.8 | 176.8 | -73.5 | -179.7 | 177.2 | 171.5 | -0.5 | 110.4 | D78 F80 | D78-R82 PolarHBondContact N-O 2.85Å; F80-R82 PolarHBondContact O-N 2.84Å | ||
| 83 | T | 55.2 | Low | 55.1 | Low | 69 Ų | 69 | 120.5 Ų | 120.5 | 42% | 0.423 | 61% | 0.613 | S | S | . | * | B | Isolated β-bridge | trans | -74 | 128.9 | 174.6 | 60.7 | 0 | 0 | 0 | 0 | 109 | E75 I77 S85 | E75-T83 HydrophobicContact CB-CG2 4.14Å; E75-T83 WeakPolarHBondContact OE2-CB 3.23Å; E75-T83 WeakPolarHBondContact OE2-CG2 3.24Å; E75-T83 PolarHBondContact OE2-OG1 3.19Å; I77-T83 HydrophobicContact CG1-CG2 4.36Å; T83-S85 PolarHBondContact O-N 3.08Å |
| 84 | L | 49.9 | Very low | 55.8 | Low | 124 Ų | 124 | 120 Ų | 120 | 65% | 0.649 | 60% | 0.601 | S | S | * | * | trans | -69.7 | 87.1 | 178.1 | -71.9 | 174 | 0 | 0 | 0 | 109.4 | K86 | L84-K86 PolarHBondContact O-N 2.95Š| ||
| 85 | S | 59.3 | Low | 56.6 | Low | 59 Ų | 59 | 122 Ų | 122 | 41% | 0.413 | 59% | 0.592 | S | S | . | * | trans | -59.4 | 110.6 | 176.1 | -175.5 | 0 | 0 | 0 | 0 | 111.1 | T83 R87 T88 | T83-S85 PolarHBondContact O-N 3.08Å; S85-R87 PolarHBondContact OG-N 3.39Å; S85-T88 PolarHBondContact OG-N 2.88Å; S85-T88 PolarHBondContact OG-OG1 2.82Å | ||
| 86 | K | 49.1 | Very low | 57.4 | Low | 196 Ų | 196 | 124.3 Ų | 124.3 | 85% | 0.852 | 60% | 0.601 | S | S | * | * | S | Bend | trans | -108.3 | 33.7 | 143.6 | -72.8 | -174.4 | 177.5 | -179.7 | 0 | 110.2 | L84 | L84-K86 PolarHBondContact O-N 2.95Š|
| 87 | R | 50.9 | Low | 58.2 | Low | 150 Ų | 150 | 117.7 Ų | 117.7 | 57% | 0.566 | 58% | 0.579 | S | S | * | * | S | Bend | trans | -107.1 | -29.4 | -176.4 | -120.9 | 174.8 | -179.1 | 148.1 | -2.6 | 113.4 | E75 S85 A89 L90 D91 | E75-R87 IonicContact OE1-NH1 2.63Å; E75-R87 PolarHBondContact OE1-NH1 3.48Å; E75-R87 VanDerWaalsContact OE1-NH1 3.15Å; S85-R87 PolarHBondContact OG-N 3.39Å; R87-A89 PolarHBondContact O-N 2.87Å; R87-L90 PolarHBondContact O-N 3.47Å; R87-D91 WeakPolarHBondContact O-CB 3.28Å; R87-D91 PolarHBondContact O-N 2.94Å |
| 88 | T | 55.5 | Low | 58.7 | Low | 91 Ų | 91 | 117.1 Ų | 117.1 | 56% | 0.558 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -67.6 | -41.5 | -172.4 | 43.7 | 0 | 0 | 0 | 0 | 114.2 | S85 E92 | S85-T88 PolarHBondContact OG-N 2.88Å; S85-T88 PolarHBondContact OG-OG1 2.82Å; T88-E92 VanDerWaalsContact O-CB 3.32Å; T88-E92 WeakPolarHBondContact O-CB 3.28Å; T88-E92 WeakPolarHBondContact O-CG 3.4Å; T88-E92 PolarHBondContact O-N 2.76Å |
| 89 | A | 57.6 | Low | 59.7 | Low | 63 Ų | 63 | 118.8 Ų | 118.8 | 52% | 0.521 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -76.2 | -27.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114 | R87 K93 | R87-A89 PolarHBondContact O-N 2.87Å; A89-K93 WeakPolarHBondContact O-CB 3.45Å; A89-K93 VanDerWaalsContact O-CG 3.23Å; A89-K93 WeakPolarHBondContact O-CG 3.33Å; A89-K93 PolarHBondContact O-N 3.2Å |
| 90 | L | 57.6 | Low | 60.4 | Low | 107 Ų | 107 | 117.4 Ų | 117.4 | 56% | 0.56 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -84.1 | -37.5 | 175.7 | -70.2 | 177.5 | 0 | 0 | 0 | 111.4 | R87 K93 Q94 | R87-L90 PolarHBondContact O-N 3.47Å; L90-K93 PolarHBondContact O-N 3.46Å; L90-Q94 VanDerWaalsContact O-CB 3.31Å; L90-Q94 WeakPolarHBondContact O-CB 3.1Å; L90-Q94 WeakPolarHBondContact O-CG 3.31Å; L90-Q94 PolarHBondContact O-N 2.89Å |
| 91 | D | 58.9 | Low | 61.4 | Low | 60 Ų | 60 | 115.3 Ų | 115.3 | 32% | 0.321 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -69.2 | -37.4 | 174.6 | -79.2 | -9.4 | 0 | 0 | 0 | 111.9 | R87 Q94 R95 | R87-D91 WeakPolarHBondContact O-CB 3.28Å; R87-D91 PolarHBondContact O-N 2.94Å; D91-Q94 PolarHBondContact O-N 2.98Å; D91-R95 WeakPolarHBondContact O-CB 3.39Å; D91-R95 VanDerWaalsContact O-CG 3.26Å; D91-R95 WeakPolarHBondContact O-CG 3.5Å; D91-R95 PolarHBondContact O-N 2.86Å |
| 92 | E | 60.8 | Low | 62.3 | Low | 118 Ų | 118 | 118.9 Ų | 118.9 | 55% | 0.551 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -67.9 | -37.2 | 173.2 | -78.4 | -176 | -175.7 | 0 | 0 | 112.2 | T88 K96 | T88-E92 VanDerWaalsContact O-CB 3.32Å; T88-E92 WeakPolarHBondContact O-CB 3.28Å; T88-E92 WeakPolarHBondContact O-CG 3.4Å; T88-E92 PolarHBondContact O-N 2.76Å; E92-K96 WeakPolarHBondContact O-CB 3.47Å; E92-K96 VanDerWaalsContact O-CG 3.29Å; E92-K96 WeakPolarHBondContact O-CG 3.37Å; E92-K96 PolarHBondContact O-N 3.33Å |
| 93 | K | 63.5 | Low | 63 | Low | 143 Ų | 143 | 111.2 Ų | 111.2 | 62% | 0.622 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -66.7 | -40.4 | 172.1 | -79.5 | -179.7 | 177.8 | -172.5 | 0 | 111.6 | A89 L90 K96 E97 | A89-K93 WeakPolarHBondContact O-CB 3.45Å; A89-K93 VanDerWaalsContact O-CG 3.23Å; A89-K93 WeakPolarHBondContact O-CG 3.33Å; A89-K93 PolarHBondContact O-N 3.2Å; L90-K93 PolarHBondContact O-N 3.46Å; K93-K96 PolarHBondContact O-N 3.14Å; K93-E97 WeakPolarHBondContact O-CB 3.43Å; K93-E97 PolarHBondContact O-N 3.33Å |
| 94 | Q | 63.3 | Low | 64.2 | Low | 100 Ų | 100 | 113.2 Ų | 113.2 | 47% | 0.467 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68.5 | -36.9 | 175.5 | -76.2 | 176.1 | 0.8 | 0 | 0 | 112.3 | L90 D91 E97 E98 | L90-Q94 VanDerWaalsContact O-CB 3.31Å; L90-Q94 WeakPolarHBondContact O-CB 3.1Å; L90-Q94 WeakPolarHBondContact O-CG 3.31Å; L90-Q94 PolarHBondContact O-N 2.89Å; D91-Q94 PolarHBondContact O-N 2.98Å; Q94-E97 PolarHBondContact O-N 3.26Å; Q94-E98 WeakPolarHBondContact O-CB 3.4Å; Q94-E98 WeakPolarHBondContact O-CG 3.29Å; Q94-E98 PolarHBondContact O-N 3.41Å |
| 95 | R | 64.8 | Low | 65.4 | Low | 167 Ų | 167 | 111.9 Ų | 111.9 | 63% | 0.63 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -66.9 | -42.9 | 173.3 | -76.2 | 177.3 | -175.6 | -169.2 | 2.8 | 111.9 | D91 E98 E99 | D91-R95 WeakPolarHBondContact O-CB 3.39Å; D91-R95 VanDerWaalsContact O-CG 3.26Å; D91-R95 WeakPolarHBondContact O-CG 3.5Å; D91-R95 PolarHBondContact O-N 2.86Å; R95-E98 PolarHBondContact O-N 2.88Å; R95-E99 WeakPolarHBondContact O-CB 3.27Å; R95-E99 VanDerWaalsContact O-CG 3.3Å; R95-E99 WeakPolarHBondContact O-CG 3.47Å; R95-E99 PolarHBondContact O-N 3.34Å |
| 96 | K | 65.3 | Low | 66.3 | Low | 128 Ų | 128 | 113.9 Ų | 113.9 | 56% | 0.557 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.4 | -41.8 | 173 | -73.4 | 175.4 | -178.3 | 177.6 | 0 | 111.7 | E92 K93 E99 E100 | E92-K96 WeakPolarHBondContact O-CB 3.47Å; E92-K96 VanDerWaalsContact O-CG 3.29Å; E92-K96 WeakPolarHBondContact O-CG 3.37Å; E92-K96 PolarHBondContact O-N 3.33Å; K93-K96 PolarHBondContact O-N 3.14Å; K96-E99 PolarHBondContact O-N 3.44Å; K96-E100 WeakPolarHBondContact O-CB 3.44Å; K96-E100 VanDerWaalsContact O-CG 3.31Å; K96-E100 WeakPolarHBondContact O-CG 3.28Å; K96-E100 PolarHBondContact O-N 2.89Å |
| 97 | E | 69.4 | Low | 67.9 | Low | 85 Ų | 85 | 113.2 Ų | 113.2 | 40% | 0.397 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -68 | -34.7 | 175.5 | -168.1 | -177.4 | 169.8 | 0 | 0 | 111.8 | K93 Q94 R101 | K93-E97 WeakPolarHBondContact O-CB 3.43Å; K93-E97 PolarHBondContact O-N 3.33Å; Q94-E97 PolarHBondContact O-N 3.26Å; E97-R101 VanDerWaalsContact O-CB 3.29Å; E97-R101 WeakPolarHBondContact O-CB 3.35Å; E97-R101 WeakPolarHBondContact O-CG 3.45Å; E97-R101 PolarHBondContact O-N 2.86Å; E97-R101 IonicContact OE1-CZ 3.56Å; E97-R101 IonicContact OE1-NE 3.15Å; E97-R101 IonicContact OE1-NH2 3.74Å; E97-R101 PolarHBondContact OE1-NH2 2.93Å |
| 98 | E | 70.1 | Confident | 69.4 | Low | 100 Ų | 100 | 109.5 Ų | 109.5 | 47% | 0.467 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -71.1 | -36.1 | 172.7 | -81.3 | -176.9 | -175.6 | 0 | 0 | 112.5 | Q94 R95 K102 | Q94-E98 WeakPolarHBondContact O-CB 3.4Å; Q94-E98 WeakPolarHBondContact O-CG 3.29Å; Q94-E98 PolarHBondContact O-N 3.41Å; R95-E98 PolarHBondContact O-N 2.88Å; E98-K102 VanDerWaalsContact O-CB 3.29Å; E98-K102 WeakPolarHBondContact O-CB 3.48Å; E98-K102 WeakPolarHBondContact O-CD 3.2Å; E98-K102 WeakPolarHBondContact O-CG 3.37Å; E98-K102 PolarHBondContact O-N 2.83Å |
| 99 | E | 71 | Confident | 70.7 | Confident | 126 Ų | 126 | 113.1 Ų | 113.1 | 59% | 0.589 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -68.1 | -40.8 | 172 | -78 | 174.1 | -177.8 | 0 | 0 | 111.2 | R95 K96 K102 A103 | R95-E99 WeakPolarHBondContact O-CB 3.27Å; R95-E99 VanDerWaalsContact O-CG 3.3Å; R95-E99 WeakPolarHBondContact O-CG 3.47Å; R95-E99 PolarHBondContact O-N 3.34Å; K96-E99 PolarHBondContact O-N 3.44Å; E99-K102 PolarHBondContact O-N 2.88Å; E99-A103 VanDerWaalsContact O-CB 3.27Å; E99-A103 WeakPolarHBondContact O-CB 3.44Å; E99-A103 PolarHBondContact O-N 3.49Å |
| 100 | E | 73 | Confident | 72 | Confident | 133 Ų | 133 | 115 Ų | 115 | 62% | 0.621 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.8 | -43.2 | 171.8 | -76.5 | 176.8 | 178.4 | 0 | 0 | 111.3 | K96 K102 A103 E104 | K96-E100 WeakPolarHBondContact O-CB 3.44Å; K96-E100 VanDerWaalsContact O-CG 3.31Å; K96-E100 WeakPolarHBondContact O-CG 3.28Å; K96-E100 PolarHBondContact O-N 2.89Å; E100-K102 PolarHBondContact O-N 3.33Å; E100-A103 PolarHBondContact O-N 2.99Å; E100-E104 VanDerWaalsContact O-CB 3.26Å; E100-E104 WeakPolarHBondContact O-CB 3.4Å; E100-E104 PolarHBondContact O-N 3.34Å |
| 101 | R | 73.3 | Confident | 73.3 | Confident | 142 Ų | 142 | 114 Ų | 114 | 54% | 0.536 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.6 | -37.2 | 172.9 | -74.3 | 171.4 | -173.9 | -167.7 | 4.9 | 112.2 | E97 M105 | E97-R101 VanDerWaalsContact O-CB 3.29Å; E97-R101 WeakPolarHBondContact O-CB 3.35Å; E97-R101 WeakPolarHBondContact O-CG 3.45Å; E97-R101 PolarHBondContact O-N 2.86Å; E97-R101 IonicContact OE1-CZ 3.56Å; E97-R101 IonicContact OE1-NE 3.15Å; E97-R101 IonicContact OE1-NH2 3.74Å; E97-R101 PolarHBondContact OE1-NH2 2.93Å; R101-M105 VanDerWaalsContact O-CB 3.32Å; R101-M105 WeakPolarHBondContact O-CB 3.46Å; R101-M105 WeakPolarHBondContact O-CG 3.27Å; R101-M105 PolarHBondContact O-N 3.32Å |
| 102 | K | 75.1 | Confident | 74.5 | Confident | 133 Ų | 133 | 118 Ų | 118 | 58% | 0.578 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -68 | -42 | 174.3 | -78.7 | 166.1 | -174 | 164.2 | 0 | 111.3 | E98 E99 E100 M105 E106 | E98-K102 VanDerWaalsContact O-CB 3.29Å; E98-K102 WeakPolarHBondContact O-CB 3.48Å; E98-K102 WeakPolarHBondContact O-CD 3.2Å; E98-K102 WeakPolarHBondContact O-CG 3.37Å; E98-K102 PolarHBondContact O-N 2.83Å; E99-K102 PolarHBondContact O-N 2.88Å; E100-K102 PolarHBondContact O-N 3.33Å; K102-M105 PolarHBondContact O-N 3.26Å; K102-E106 WeakPolarHBondContact O-CB 3.38Å; K102-E106 PolarHBondContact O-N 3.42Å |
| 103 | A | 79.5 | Confident | 75.7 | Confident | 41 Ų | 41 | 118 Ų | 118 | 34% | 0.339 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.6 | -37.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | E99 E100 E106 R107 | E99-A103 VanDerWaalsContact O-CB 3.27Å; E99-A103 WeakPolarHBondContact O-CB 3.44Å; E99-A103 PolarHBondContact O-N 3.49Å; E100-A103 PolarHBondContact O-N 2.99Å; A103-E106 PolarHBondContact O-N 3.49Å; A103-R107 WeakPolarHBondContact O-CB 3.33Å; A103-R107 VanDerWaalsContact O-CG 3.27Å; A103-R107 WeakPolarHBondContact O-CG 3.4Å; A103-R107 PolarHBondContact O-N 3.48Å |
| 104 | E | 80.3 | Confident | 76.7 | Confident | 111 Ų | 111 | 116.3 Ų | 116.3 | 52% | 0.519 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.3 | -43.1 | 173.7 | -168.1 | 179.5 | -175.9 | 0 | 0 | 111.2 | E100 E106 R107 Q108 | E100-E104 VanDerWaalsContact O-CB 3.26Å; E100-E104 WeakPolarHBondContact O-CB 3.4Å; E100-E104 PolarHBondContact O-N 3.34Å; E104-E106 VanDerWaalsContact C-N 3.31Å; E104-E106 PolarHBondContact O-N 3.19Å; E104-R107 WeakPolarHBondContact O-CB 3.3Å; E104-R107 PolarHBondContact O-N 2.88Å; E104-Q108 WeakPolarHBondContact O-CG 3.43Å; E104-Q108 PolarHBondContact O-N 2.97Å |
| 105 | M | 74.3 | Confident | 77.7 | Confident | 96 Ų | 96 | 115.6 Ų | 115.6 | 47% | 0.473 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.7 | -35.5 | 172.8 | -73.5 | -68.8 | -68.4 | 0 | 0 | 112.4 | R101 K102 Q108 R109 | R101-M105 VanDerWaalsContact O-CB 3.32Å; R101-M105 WeakPolarHBondContact O-CB 3.46Å; R101-M105 WeakPolarHBondContact O-CG 3.27Å; R101-M105 PolarHBondContact O-N 3.32Å; K102-M105 PolarHBondContact O-N 3.26Å; M105-Q108 PolarHBondContact O-N 2.87Å; M105-R109 WeakPolarHBondContact O-CB 3.41Å; M105-R109 VanDerWaalsContact O-CG 3.28Å; M105-R109 WeakPolarHBondContact O-CG 3.37Å; M105-R109 PolarHBondContact O-N 3.44Å |
| 106 | E | 79.4 | Confident | 78.8 | Confident | 102 Ų | 102 | 112.6 Ų | 112.6 | 48% | 0.477 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -69 | -40.6 | 174.2 | -163.7 | -169.3 | 146 | 0 | 0 | 111.5 | K102 A103 E104 R109 K110 | K102-E106 WeakPolarHBondContact O-CB 3.38Å; K102-E106 PolarHBondContact O-N 3.42Å; A103-E106 PolarHBondContact O-N 3.49Å; E104-E106 VanDerWaalsContact C-N 3.31Å; E104-E106 PolarHBondContact O-N 3.19Å; E106-R109 PolarHBondContact O-N 2.95Å; E106-K110 WeakPolarHBondContact O-CG 3.32Å; E106-K110 PolarHBondContact O-N 3.38Å; E106-K110 VanDerWaalsContact OE1-CE 3.26Å; E106-K110 WeakPolarHBondContact OE1-CE 3.37Å; E106-K110 IonicContact OE1-NZ 3.32Å; E106-K110 PolarHBondContact OE1-NZ 3.15Å |
| 107 | R | 81.9 | Confident | 79.6 | Confident | 182 Ų | 182 | 112.2 Ų | 112.2 | 69% | 0.687 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.1 | -45.2 | 171.5 | -73.7 | 173.6 | -176.8 | -175.5 | 2.2 | 111.3 | A103 E104 R109 K110 I111 | A103-R107 WeakPolarHBondContact O-CB 3.33Å; A103-R107 VanDerWaalsContact O-CG 3.27Å; A103-R107 WeakPolarHBondContact O-CG 3.4Å; A103-R107 PolarHBondContact O-N 3.48Å; E104-R107 WeakPolarHBondContact O-CB 3.3Å; E104-R107 PolarHBondContact O-N 2.88Å; R107-R109 VanDerWaalsContact C-N 3.31Å; R107-R109 PolarHBondContact O-N 2.87Å; R107-K110 PolarHBondContact O-N 2.86Å; R107-I111 VanDerWaalsContact O-CG1 3.28Å; R107-I111 WeakPolarHBondContact O-CG1 3.31Å; R107-I111 PolarHBondContact O-N 3.36Å |
| 108 | Q | 81.8 | Confident | 80.4 | Confident | 72 Ų | 72 | 113.5 Ų | 113.5 | 34% | 0.336 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.6 | -36.5 | 175.5 | -73 | -178.6 | 12.7 | 0 | 0 | 112.5 | E104 M105 R112 | E104-Q108 WeakPolarHBondContact O-CG 3.43Å; E104-Q108 PolarHBondContact O-N 2.97Å; M105-Q108 PolarHBondContact O-N 2.87Å; Q108-R112 WeakPolarHBondContact O-CB 3.4Å; Q108-R112 VanDerWaalsContact O-CG 3.25Å; Q108-R112 WeakPolarHBondContact O-CG 3.41Å; Q108-R112 PolarHBondContact O-N 2.94Å |
| 109 | R | 84 | Confident | 81.2 | Confident | 166 Ų | 166 | 114.2 Ų | 114.2 | 63% | 0.626 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.9 | -42.3 | 173.9 | -76.9 | 174.9 | -179.7 | -166.9 | 0.7 | 112 | M105 E106 R107 R112 Q113 | M105-R109 WeakPolarHBondContact O-CB 3.41Å; M105-R109 VanDerWaalsContact O-CG 3.28Å; M105-R109 WeakPolarHBondContact O-CG 3.37Å; M105-R109 PolarHBondContact O-N 3.44Å; E106-R109 PolarHBondContact O-N 2.95Å; R107-R109 VanDerWaalsContact C-N 3.31Å; R107-R109 PolarHBondContact O-N 2.87Å; R109-R112 PolarHBondContact O-N 2.91Å; R109-Q113 WeakPolarHBondContact O-CG 3.46Å; R109-Q113 PolarHBondContact O-N 3.44Å |
| 110 | K | 84.8 | Confident | 82.1 | Confident | 104 Ų | 104 | 112.5 Ų | 112.5 | 45% | 0.452 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64 | -43.6 | 176 | -73.4 | 174.4 | -174.7 | 167.4 | 0 | 111.7 | E106 R107 R112 Q113 Q114 | E106-K110 WeakPolarHBondContact O-CG 3.32Å; E106-K110 PolarHBondContact O-N 3.38Å; E106-K110 VanDerWaalsContact OE1-CE 3.26Å; E106-K110 WeakPolarHBondContact OE1-CE 3.37Å; E106-K110 IonicContact OE1-NZ 3.32Å; E106-K110 PolarHBondContact OE1-NZ 3.15Å; R107-K110 PolarHBondContact O-N 2.86Å; K110-R112 PolarHBondContact O-N 2.68Å; K110-Q113 PolarHBondContact O-N 3.36Å; K110-Q114 WeakPolarHBondContact O-CG 3.42Å; K110-Q114 PolarHBondContact O-N 3.48Å |
| 111 | I | 84.7 | Confident | 82.8 | Confident | 84 Ų | 84 | 111.1 Ų | 111.1 | 43% | 0.431 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60 | -46.2 | 174.5 | -67.4 | 163.4 | 0 | 0 | 0 | 110.4 | R107 Q113 Q114 E115 | R107-I111 VanDerWaalsContact O-CG1 3.28Å; R107-I111 WeakPolarHBondContact O-CG1 3.31Å; R107-I111 PolarHBondContact O-N 3.36Å; I111-Q113 VanDerWaalsContact C-N 3.31Å; I111-Q113 PolarHBondContact O-N 2.91Å; I111-Q114 PolarHBondContact O-N 3.32Å; I111-E115 HydrophobicContact CG2-CG 4.35Å; I111-E115 WeakPolarHBondContact CG2-OE1 3.45Å; I111-E115 WeakPolarHBondContact O-CB 3.36Å; I111-E115 VanDerWaalsContact O-CG 3.32Å; I111-E115 WeakPolarHBondContact O-CG 3.36Å; I111-E115 PolarHBondContact O-N 3.26Å |
| 112 | R | 84.8 | Confident | 83.4 | Confident | 146 Ų | 146 | 110.3 Ų | 110.3 | 55% | 0.551 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62.9 | -35.1 | 176.6 | -73.2 | 175.5 | -170.6 | 179.5 | 6.4 | 113.3 | Q108 R109 K110 I116 | Q108-R112 WeakPolarHBondContact O-CB 3.4Å; Q108-R112 VanDerWaalsContact O-CG 3.25Å; Q108-R112 WeakPolarHBondContact O-CG 3.41Å; Q108-R112 PolarHBondContact O-N 2.94Å; R109-R112 PolarHBondContact O-N 2.91Å; K110-R112 PolarHBondContact O-N 2.68Å; R112-I116 WeakPolarHBondContact O-CD1 3.31Å; R112-I116 WeakPolarHBondContact O-CG1 3.35Å; R112-I116 PolarHBondContact O-N 3.28Å; R112-I116 VanDerWaalsContact O-N 3.08Å |
| 113 | Q | 84.6 | Confident | 83.9 | Confident | 116 Ų | 116 | 108.6 Ų | 108.6 | 54% | 0.542 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.8 | -45.8 | 175.3 | -76.2 | 172.7 | -20.5 | 0 | 0 | 110.9 | R109 K110 I111 E115 I116 E117 | R109-Q113 WeakPolarHBondContact O-CG 3.46Å; R109-Q113 PolarHBondContact O-N 3.44Å; K110-Q113 PolarHBondContact O-N 3.36Å; I111-Q113 VanDerWaalsContact C-N 3.31Å; I111-Q113 PolarHBondContact O-N 2.91Å; Q113-E115 PolarHBondContact O-N 3.49Å; Q113-I116 PolarHBondContact O-N 2.88Å; Q113-I116 VanDerWaalsContact O-N 3.15Å; Q113-E117 WeakPolarHBondContact O-CG 3.31Å; Q113-E117 PolarHBondContact O-N 3.29Å |
| 114 | Q | 85 | Confident | 84.3 | Confident | 108 Ų | 108 | 111.6 Ų | 111.6 | 51% | 0.505 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.8 | -44.2 | 174.6 | -70.9 | 173.7 | -30.2 | 0 | 0 | 111.4 | K110 I111 I116 E117 E118 | K110-Q114 WeakPolarHBondContact O-CG 3.42Å; K110-Q114 PolarHBondContact O-N 3.48Å; I111-Q114 PolarHBondContact O-N 3.32Å; Q114-I116 VanDerWaalsContact C-N 3.3Å; Q114-I116 PolarHBondContact O-N 3.17Å; Q114-E117 PolarHBondContact O-N 3.42Å; Q114-E118 VanDerWaalsContact O-CB 3.3Å; Q114-E118 WeakPolarHBondContact O-CB 3.46Å; Q114-E118 VanDerWaalsContact O-CG 3.25Å; Q114-E118 WeakPolarHBondContact O-CG 3.36Å; Q114-E118 PolarHBondContact O-N 2.89Å |
| 115 | E | 85.1 | Confident | 84.6 | Confident | 86 Ų | 86 | 109.4 Ų | 109.4 | 40% | 0.402 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.9 | -34.4 | 175.3 | -74.4 | 175 | -170.2 | 0 | 0 | 113.1 | I111 Q113 K119 | I111-E115 HydrophobicContact CG2-CG 4.35Å; I111-E115 WeakPolarHBondContact CG2-OE1 3.45Å; I111-E115 WeakPolarHBondContact O-CB 3.36Å; I111-E115 VanDerWaalsContact O-CG 3.32Å; I111-E115 WeakPolarHBondContact O-CG 3.36Å; I111-E115 PolarHBondContact O-N 3.26Å; Q113-E115 PolarHBondContact O-N 3.49Å; E115-K119 WeakPolarHBondContact O-CB 3.37Å; E115-K119 WeakPolarHBondContact O-CD 3.39Å; E115-K119 WeakPolarHBondContact O-CG 3.28Å; E115-K119 PolarHBondContact O-N 2.9Å |
| 116 | I | 86.6 | Confident | 85.4 | Confident | 103 Ų | 103 | 107.6 Ų | 107.6 | 53% | 0.528 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -72.7 | -43.4 | 176.8 | -71 | 163.5 | 0 | 0 | 0 | 110.1 | R112 Q113 Q114 K119 L120 | R112-I116 WeakPolarHBondContact O-CD1 3.31Å; R112-I116 WeakPolarHBondContact O-CG1 3.35Å; R112-I116 PolarHBondContact O-N 3.28Å; R112-I116 VanDerWaalsContact O-N 3.08Å; Q113-I116 PolarHBondContact O-N 2.88Å; Q113-I116 VanDerWaalsContact O-N 3.15Å; Q114-I116 VanDerWaalsContact C-N 3.3Å; Q114-I116 PolarHBondContact O-N 3.17Å; I116-K119 PolarHBondContact O-N 3Å; I116-L120 HydrophobicContact CG2-CD1 4.19Å; I116-L120 VanDerWaalsContact O-CG 3.3Å; I116-L120 WeakPolarHBondContact O-CG 3.5Å; I116-L120 PolarHBondContact O-N 3.41Å |
| 117 | E | 83.1 | Confident | 85.9 | Confident | 120 Ų | 120 | 109.7 Ų | 109.7 | 56% | 0.561 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.3 | -43.5 | 176.8 | -71.9 | 173.9 | -175.2 | 0 | 0 | 111.3 | Q113 Q114 L120 I121 | Q113-E117 WeakPolarHBondContact O-CG 3.31Å; Q113-E117 PolarHBondContact O-N 3.29Å; Q114-E117 PolarHBondContact O-N 3.42Å; E117-L120 PolarHBondContact O-N 3.1Å; E117-I121 VanDerWaalsContact O-CG1 3.29Å; E117-I121 WeakPolarHBondContact O-CG1 3.37Å; E117-I121 PolarHBondContact O-N 2.94Å |
| 118 | E | 85.8 | Confident | 86.3 | Confident | 112 Ų | 112 | 108.4 Ų | 108.4 | 52% | 0.523 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 174.4 | -75.3 | 174.1 | 178 | 0 | 0 | 111.2 | Q114 L120 I121 E122 | Q114-E118 VanDerWaalsContact O-CB 3.3Å; Q114-E118 WeakPolarHBondContact O-CB 3.46Å; Q114-E118 VanDerWaalsContact O-CG 3.25Å; Q114-E118 WeakPolarHBondContact O-CG 3.36Å; Q114-E118 PolarHBondContact O-N 2.89Å; E118-L120 VanDerWaalsContact C-N 3.32Å; E118-L120 PolarHBondContact O-N 3.37Å; E118-I121 PolarHBondContact O-N 3.41Å; E118-E122 WeakPolarHBondContact O-CB 3.42Å; E118-E122 WeakPolarHBondContact O-CG 3.31Å; E118-E122 PolarHBondContact O-N 3.46Å |
| 119 | K | 87 | Confident | 86.8 | Confident | 115 Ų | 115 | 109.3 Ų | 109.3 | 50% | 0.5 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.4 | -37.8 | 175.1 | -77.2 | 169.1 | -173.9 | 167.9 | 0 | 113 | E115 I116 E122 E123 | E115-K119 WeakPolarHBondContact O-CB 3.37Å; E115-K119 WeakPolarHBondContact O-CD 3.39Å; E115-K119 WeakPolarHBondContact O-CG 3.28Å; E115-K119 PolarHBondContact O-N 2.9Å; I116-K119 PolarHBondContact O-N 3Å; K119-E122 PolarHBondContact O-N 3.25Å; K119-E123 WeakPolarHBondContact O-CB 3.49Å; K119-E123 VanDerWaalsContact O-CG 3.28Å; K119-E123 WeakPolarHBondContact O-CG 3.38Å; K119-E123 PolarHBondContact O-N 2.86Å |
| 120 | L | 89.8 | Confident | 87.1 | Confident | 91 Ų | 91 | 107.9 Ų | 107.9 | 48% | 0.476 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.5 | -39.5 | 176.1 | -73 | 169.4 | 0 | 0 | 0 | 111.5 | I116 E117 E118 E123 E124 | I116-L120 HydrophobicContact CG2-CD1 4.19Å; I116-L120 VanDerWaalsContact O-CG 3.3Å; I116-L120 WeakPolarHBondContact O-CG 3.5Å; I116-L120 PolarHBondContact O-N 3.41Å; E117-L120 PolarHBondContact O-N 3.1Å; E118-L120 VanDerWaalsContact C-N 3.32Å; E118-L120 PolarHBondContact O-N 3.37Å; L120-E123 PolarHBondContact O-N 2.95Å; L120-E124 WeakPolarHBondContact O-CB 3.43Å; L120-E124 WeakPolarHBondContact O-CG 3.36Å; L120-E124 PolarHBondContact O-N 3.39Å |
| 121 | I | 87.6 | Confident | 87.4 | Confident | 103 Ų | 103 | 108.1 Ų | 108.1 | 53% | 0.528 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68.4 | -41.5 | 175.7 | -65.3 | 163.6 | 0 | 0 | 0 | 110.7 | E117 E118 E124 T125 | E117-I121 VanDerWaalsContact O-CG1 3.29Å; E117-I121 WeakPolarHBondContact O-CG1 3.37Å; E117-I121 PolarHBondContact O-N 2.94Å; E118-I121 PolarHBondContact O-N 3.41Å; I121-E124 PolarHBondContact O-N 2.88Å; I121-T125 HydrophobicContact CG2-CG2 4.41Å; I121-T125 WeakPolarHBondContact O-CB 3.39Å; I121-T125 VanDerWaalsContact O-CG2 3.26Å; I121-T125 WeakPolarHBondContact O-CG2 3.3Å; I121-T125 PolarHBondContact O-N 3.45Å; I121-T125 PolarHBondContact O-OG1 2.82Å |
| 122 | E | 85.6 | Confident | 87.7 | Confident | 125 Ų | 125 | 108.8 Ų | 108.8 | 58% | 0.584 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.6 | -43 | 173.8 | -74.4 | 178.8 | 174.9 | 0 | 0 | 111.5 | E118 K119 T125 A126 | E118-E122 WeakPolarHBondContact O-CB 3.42Å; E118-E122 WeakPolarHBondContact O-CG 3.31Å; E118-E122 PolarHBondContact O-N 3.46Å; K119-E122 PolarHBondContact O-N 3.25Å; E122-T125 WeakPolarHBondContact CA-OG1 3.33Å; E122-T125 PolarHBondContact O-N 3.32Å; E122-T125 PolarHBondContact O-OG1 3.49Å; E122-A126 VanDerWaalsContact O-CB 3.22Å; E122-A126 WeakPolarHBondContact O-CB 3.48Å; E122-A126 PolarHBondContact O-N 3.23Å |
| 123 | E | 87 | Confident | 88 | Confident | 98 Ų | 98 | 105.6 Ų | 105.6 | 46% | 0.458 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.4 | -42.6 | 174.7 | -77.4 | -177.7 | -165.1 | 0 | 0 | 112.1 | K119 L120 A126 R127 | K119-E123 WeakPolarHBondContact O-CB 3.49Å; K119-E123 VanDerWaalsContact O-CG 3.28Å; K119-E123 WeakPolarHBondContact O-CG 3.38Å; K119-E123 PolarHBondContact O-N 2.86Å; L120-E123 PolarHBondContact O-N 2.95Å; E123-A126 PolarHBondContact O-N 3.41Å; E123-R127 WeakPolarHBondContact O-CB 3.36Å; E123-R127 VanDerWaalsContact O-CG 3.22Å; E123-R127 WeakPolarHBondContact O-CG 3.47Å; E123-R127 PolarHBondContact O-N 2.83Å; E123-R127 IonicContact OE2-NH2 2.72Å |
| 124 | E | 86.2 | Confident | 88.4 | Confident | 103 Ų | 103 | 102.7 Ų | 102.7 | 48% | 0.481 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.8 | -39.3 | 176.3 | -78.7 | -171.3 | -174.7 | 0 | 0 | 112.3 | L120 I121 R127 R128 | L120-E124 WeakPolarHBondContact O-CB 3.43Å; L120-E124 WeakPolarHBondContact O-CG 3.36Å; L120-E124 PolarHBondContact O-N 3.39Å; I121-E124 PolarHBondContact O-N 2.88Å; E124-R127 PolarHBondContact O-N 3.36Å; E124-R128 WeakPolarHBondContact O-CG 3.34Å; E124-R128 PolarHBondContact O-N 2.88Å; E124-R128 IonicContact OE2-NH2 3.44Å |
| 125 | T | 87.5 | Confident | 88.7 | Confident | 66 Ų | 66 | 102.8 Ų | 102.8 | 41% | 0.405 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -70.2 | -41.2 | 176.4 | 52.8 | 0 | 0 | 0 | 0 | 111.5 | I121 E122 R127 R128 V129 | I121-T125 HydrophobicContact CG2-CG2 4.41Å; I121-T125 WeakPolarHBondContact O-CB 3.39Å; I121-T125 VanDerWaalsContact O-CG2 3.26Å; I121-T125 WeakPolarHBondContact O-CG2 3.3Å; I121-T125 PolarHBondContact O-N 3.45Å; I121-T125 PolarHBondContact O-OG1 2.82Å; E122-T125 WeakPolarHBondContact CA-OG1 3.33Å; E122-T125 PolarHBondContact O-N 3.32Å; E122-T125 PolarHBondContact O-OG1 3.49Å; T125-R127 VanDerWaalsContact C-N 3.34Å; T125-R127 PolarHBondContact O-N 2.93Å; T125-R128 PolarHBondContact O-N 3.47Å; T125-V129 WeakPolarHBondContact O-CG2 3.28Å; T125-V129 PolarHBondContact O-N 2.97Å |
| 126 | A | 90.4 | Very high | 89 | Confident | 57 Ų | 57 | 106.7 Ų | 106.7 | 47% | 0.471 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.2 | -43.8 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | E122 E123 V129 E130 | E122-A126 VanDerWaalsContact O-CB 3.22Å; E122-A126 WeakPolarHBondContact O-CB 3.48Å; E122-A126 PolarHBondContact O-N 3.23Å; E123-A126 PolarHBondContact O-N 3.41Å; A126-V129 PolarHBondContact O-N 3.38Å; A126-E130 WeakPolarHBondContact O-CB 3.44Å; A126-E130 PolarHBondContact O-N 3.05Å |
| 127 | R | 91.6 | Very high | 89.2 | Confident | 146 Ų | 146 | 105.1 Ų | 105.1 | 55% | 0.551 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.9 | -43.7 | 175.3 | -74.8 | 176.1 | -168.5 | -179.4 | 10.9 | 112.6 | E123 E124 T125 V129 E130 E131 | E123-R127 WeakPolarHBondContact O-CB 3.36Å; E123-R127 VanDerWaalsContact O-CG 3.22Å; E123-R127 WeakPolarHBondContact O-CG 3.47Å; E123-R127 PolarHBondContact O-N 2.83Å; E123-R127 IonicContact OE2-NH2 2.72Å; E124-R127 PolarHBondContact O-N 3.36Å; T125-R127 VanDerWaalsContact C-N 3.34Å; T125-R127 PolarHBondContact O-N 2.93Å; R127-V129 VanDerWaalsContact C-N 3.32Å; R127-V129 PolarHBondContact O-N 3.27Å; R127-E130 PolarHBondContact O-N 3.46Å; R127-E131 WeakPolarHBondContact O-CG 3.35Å; R127-E131 PolarHBondContact O-N 2.93Å |
| 128 | R | 90.3 | Very high | 89.4 | Confident | 155 Ų | 155 | 104.9 Ų | 104.9 | 59% | 0.585 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.1 | -39.4 | 176.4 | -72.9 | 175.8 | -169.3 | 167.9 | 10.2 | 112.1 | E124 T125 L132 | E124-R128 WeakPolarHBondContact O-CG 3.34Å; E124-R128 PolarHBondContact O-N 2.88Å; E124-R128 IonicContact OE2-NH2 3.44Å; T125-R128 PolarHBondContact O-N 3.47Å; R128-L132 VanDerWaalsContact O-CG 3.28Å; R128-L132 WeakPolarHBondContact O-CG 3.28Å; R128-L132 PolarHBondContact O-N 3.41Å; R128-L132 VanDerWaalsContact O-N 3.08Å |
| 129 | V | 92.3 | Very high | 89.5 | Confident | 91 Ų | 91 | 104.8 Ų | 104.8 | 55% | 0.552 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.5 | -45.7 | 175.2 | 172.2 | 0 | 0 | 0 | 0 | 110.5 | T125 A126 R127 E131 L132 V133 | T125-V129 WeakPolarHBondContact O-CG2 3.28Å; T125-V129 PolarHBondContact O-N 2.97Å; A126-V129 PolarHBondContact O-N 3.38Å; R127-V129 VanDerWaalsContact C-N 3.32Å; R127-V129 PolarHBondContact O-N 3.27Å; V129-E131 PolarHBondContact O-N 2.95Å; V129-L132 PolarHBondContact O-N 3.37Å; V129-V133 HydrophobicContact CG1-CG2 4.4Å; V129-V133 VanDerWaalsContact O-CG2 3.3Å; V129-V133 WeakPolarHBondContact O-CG2 3.4Å; V129-V133 PolarHBondContact O-N 3.02Å |
| 130 | E | 89.6 | Confident | 89.5 | Confident | 136 Ų | 136 | 104.7 Ų | 104.7 | 64% | 0.636 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -59 | -44.7 | 176.9 | -173.5 | 178.9 | 179.9 | 0 | 0 | 111.8 | A126 R127 L132 V133 A134 | A126-E130 WeakPolarHBondContact O-CB 3.44Å; A126-E130 PolarHBondContact O-N 3.05Å; R127-E130 PolarHBondContact O-N 3.46Å; E130-L132 PolarHBondContact O-N 2.83Å; E130-V133 PolarHBondContact O-N 3.31Å; E130-A134 VanDerWaalsContact O-CB 3.28Å; E130-A134 WeakPolarHBondContact O-CB 3.38Å; E130-A134 PolarHBondContact O-N 3.32Å |
| 131 | E | 90.6 | Very high | 89.4 | Confident | 109 Ų | 109 | 104.5 Ų | 104.5 | 51% | 0.509 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.8 | -40.8 | 176.2 | -75.6 | -179.4 | -165.9 | 0 | 0 | 112.8 | R127 V129 V133 A134 K135 | R127-E131 WeakPolarHBondContact O-CG 3.35Å; R127-E131 PolarHBondContact O-N 2.93Å; V129-E131 PolarHBondContact O-N 2.95Å; E131-V133 VanDerWaalsContact C-N 3.34Å; E131-A134 PolarHBondContact O-N 2.92Å; E131-K135 WeakPolarHBondContact O-CB 3.33Å; E131-K135 VanDerWaalsContact O-CG 3.22Å; E131-K135 WeakPolarHBondContact O-CG 3.36Å; E131-K135 PolarHBondContact O-N 3.15Å |
| 132 | L | 90.5 | Very high | 89.4 | Confident | 98 Ų | 98 | 104.9 Ų | 104.9 | 51% | 0.513 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.3 | -37.7 | 177 | -72.9 | 172.5 | 0 | 0 | 0 | 111.7 | R128 V129 E130 R136 | R128-L132 VanDerWaalsContact O-CG 3.28Å; R128-L132 WeakPolarHBondContact O-CG 3.28Å; R128-L132 PolarHBondContact O-N 3.41Å; R128-L132 VanDerWaalsContact O-N 3.08Å; V129-L132 PolarHBondContact O-N 3.37Å; E130-L132 PolarHBondContact O-N 2.83Å; L132-R136 WeakPolarHBondContact O-CB 3.41Å; L132-R136 WeakPolarHBondContact O-CG 3.45Å; L132-R136 PolarHBondContact O-N 3.41Å |
| 133 | V | 91.9 | Very high | 89.5 | Confident | 79 Ų | 79 | 106.5 Ų | 106.5 | 48% | 0.479 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67 | -47.5 | 174.2 | 171.7 | 0 | 0 | 0 | 0 | 110.2 | V129 E130 E131 K135 R136 V137 | V129-V133 HydrophobicContact CG1-CG2 4.4Å; V129-V133 VanDerWaalsContact O-CG2 3.3Å; V129-V133 WeakPolarHBondContact O-CG2 3.4Å; V129-V133 PolarHBondContact O-N 3.02Å; E130-V133 PolarHBondContact O-N 3.31Å; E131-V133 VanDerWaalsContact C-N 3.34Å; V133-K135 PolarHBondContact O-N 2.87Å; V133-R136 PolarHBondContact O-N 2.83Å; V133-V137 HydrophobicContact CG1-CG2 4.25Å; V133-V137 WeakPolarHBondContact O-CB 3.22Å; V133-V137 VanDerWaalsContact O-CG2 3.28Å; V133-V137 WeakPolarHBondContact O-CG2 3.48Å; V133-V137 PolarHBondContact O-N 3.29Å |
| 134 | A | 92.2 | Very high | 89.7 | Confident | 55 Ų | 55 | 109 Ų | 109 | 46% | 0.455 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -58.7 | -45.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | E130 E131 V137 E138 | E130-A134 VanDerWaalsContact O-CB 3.28Å; E130-A134 WeakPolarHBondContact O-CB 3.38Å; E130-A134 PolarHBondContact O-N 3.32Å; E131-A134 PolarHBondContact O-N 2.92Å; A134-V137 PolarHBondContact O-N 2.86Å; A134-E138 VanDerWaalsContact O-CB 3.27Å; A134-E138 WeakPolarHBondContact O-CB 3.32Å; A134-E138 PolarHBondContact O-N 3.37Å |
| 135 | K | 92.8 | Very high | 89.9 | Confident | 111 Ų | 111 | 107.3 Ų | 107.3 | 48% | 0.483 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.3 | -45.2 | 176.1 | -74.3 | 170 | -175.9 | 168.6 | 0 | 112.3 | E131 V133 E138 E139 | E131-K135 WeakPolarHBondContact O-CB 3.33Å; E131-K135 VanDerWaalsContact O-CG 3.22Å; E131-K135 WeakPolarHBondContact O-CG 3.36Å; E131-K135 PolarHBondContact O-N 3.15Å; V133-K135 PolarHBondContact O-N 2.87Å; K135-E138 PolarHBondContact O-N 2.87Å; K135-E139 VanDerWaalsContact O-CG 3.31Å; K135-E139 WeakPolarHBondContact O-CG 3.3Å; K135-E139 PolarHBondContact O-N 3.28Å |
| 136 | R | 91 | Very high | 90.1 | Very high | 168 Ų | 168 | 108.4 Ų | 108.4 | 63% | 0.634 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.6 | -42.9 | 176.8 | -77.4 | -177.9 | -179.5 | 160.2 | 1.5 | 112.5 | L132 V133 E138 E139 E140 | L132-R136 WeakPolarHBondContact O-CB 3.41Å; L132-R136 WeakPolarHBondContact O-CG 3.45Å; L132-R136 PolarHBondContact O-N 3.41Å; V133-R136 PolarHBondContact O-N 2.83Å; R136-E138 VanDerWaalsContact C-N 3.33Å; R136-E139 PolarHBondContact O-N 3.01Å; R136-E140 WeakPolarHBondContact O-CB 3.27Å; R136-E140 WeakPolarHBondContact O-CG 3.09Å; R136-E140 PolarHBondContact O-N 3.42Å |
| 137 | V | 91.5 | Very high | 90 | Very high | 69 Ų | 69 | 111.6 Ų | 111.6 | 42% | 0.418 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.5 | -40.9 | 176.5 | 170.7 | 0 | 0 | 0 | 0 | 110.7 | V133 A134 E140 L141 | V133-V137 HydrophobicContact CG1-CG2 4.25Å; V133-V137 WeakPolarHBondContact O-CB 3.22Å; V133-V137 VanDerWaalsContact O-CG2 3.28Å; V133-V137 WeakPolarHBondContact O-CG2 3.48Å; V133-V137 PolarHBondContact O-N 3.29Å; A134-V137 PolarHBondContact O-N 2.86Å; V137-E140 PolarHBondContact O-N 2.93Å; V137-L141 HydrophobicContact CG1-CD1 3.94Å; V137-L141 HydrophobicContact CG1-CG 4.31Å; V137-L141 WeakPolarHBondContact O-CB 3.39Å; V137-L141 VanDerWaalsContact O-CG 3.28Å; V137-L141 WeakPolarHBondContact O-CG 3.41Å; V137-L141 PolarHBondContact O-N 3.29Å |
| 138 | E | 86.9 | Confident | 89.9 | Confident | 116 Ų | 116 | 108.7 Ų | 108.7 | 54% | 0.542 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.9 | -43.7 | 177.5 | -173.6 | 169.5 | -160.3 | 0 | 0 | 111.9 | A134 K135 R136 L141 E142 | A134-E138 VanDerWaalsContact O-CB 3.27Å; A134-E138 WeakPolarHBondContact O-CB 3.32Å; A134-E138 PolarHBondContact O-N 3.37Å; K135-E138 PolarHBondContact O-N 2.87Å; R136-E138 VanDerWaalsContact C-N 3.33Å; E138-L141 PolarHBondContact O-N 3.13Å; E138-E142 VanDerWaalsContact O-CB 3.23Å; E138-E142 WeakPolarHBondContact O-CB 3.47Å; E138-E142 PolarHBondContact O-N 2.82Å |
| 139 | E | 87.1 | Confident | 90 | Very high | 109 Ų | 109 | 106.6 Ų | 106.6 | 51% | 0.509 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.6 | -39.2 | 174.2 | -72.6 | 172.7 | -169.1 | 0 | 0 | 112.5 | K135 R136 E142 K143 | K135-E139 VanDerWaalsContact O-CG 3.31Å; K135-E139 WeakPolarHBondContact O-CG 3.3Å; K135-E139 PolarHBondContact O-N 3.28Å; R136-E139 PolarHBondContact O-N 3.01Å; E139-E142 PolarHBondContact O-N 3.39Å; E139-K143 WeakPolarHBondContact O-CG 3.45Å; E139-K143 PolarHBondContact O-N 3.41Å; E139-K143 VanDerWaalsContact O-N 3.15Å |
| 140 | E | 86.7 | Confident | 90.1 | Very high | 113 Ų | 113 | 109.1 Ų | 109.1 | 53% | 0.528 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -68 | -41.7 | 175.7 | -78.1 | -175 | -175.6 | 0 | 0 | 112.2 | R136 V137 R144 | R136-E140 WeakPolarHBondContact O-CB 3.27Å; R136-E140 WeakPolarHBondContact O-CG 3.09Å; R136-E140 PolarHBondContact O-N 3.42Å; V137-E140 PolarHBondContact O-N 2.93Å; E140-R144 PolarHBondContact O-N 2.92Å |
| 141 | L | 89.2 | Confident | 90.3 | Very high | 88 Ų | 88 | 107.3 Ų | 107.3 | 46% | 0.461 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.7 | -43.5 | 173.9 | -73.8 | 175.8 | 0 | 0 | 0 | 109.9 | V137 E138 K143 R144 K145 | V137-L141 HydrophobicContact CG1-CD1 3.94Å; V137-L141 HydrophobicContact CG1-CG 4.31Å; V137-L141 WeakPolarHBondContact O-CB 3.39Å; V137-L141 VanDerWaalsContact O-CG 3.28Å; V137-L141 WeakPolarHBondContact O-CG 3.41Å; V137-L141 PolarHBondContact O-N 3.29Å; E138-L141 PolarHBondContact O-N 3.13Å; L141-K143 VanDerWaalsContact C-N 3.32Å; L141-K143 PolarHBondContact O-N 2.81Å; L141-R144 CarbonylContact O-C 3.32Å; L141-R144 VanDerWaalsContact O-C 3.32Å; L141-R144 WeakPolarHBondContact O-CA 3.31Å; L141-R144 PolarHBondContact O-N 3.12Å; L141-K145 VanDerWaalsContact O-CG 3.3Å; L141-K145 WeakPolarHBondContact O-CG 3.37Å; L141-K145 PolarHBondContact O-N 3.05Å |
| 142 | E | 86.9 | Confident | 90.6 | Very high | 111 Ų | 111 | 105.6 Ų | 105.6 | 52% | 0.519 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.7 | -39.5 | -179.4 | -171 | 155.8 | -111.4 | 0 | 0 | 113.4 | E138 E139 R144 K145 | E138-E142 VanDerWaalsContact O-CB 3.23Å; E138-E142 WeakPolarHBondContact O-CB 3.47Å; E138-E142 PolarHBondContact O-N 2.82Å; E139-E142 PolarHBondContact O-N 3.39Å; E142-R144 PolarHBondContact O-N 3.37Å; E142-K145 HydrophobicContact CB-CD 4.26Å; E142-K145 HydrophobicContact CG-CD 4.34Å; E142-K145 PolarHBondContact O-N 3.01Å; E142-K145 IonicContact OE1-NZ 3Å; E142-K145 PolarHBondContact OE1-NZ 3.35Å |
| 143 | K | 87.4 | Confident | 90.8 | Very high | 159 Ų | 159 | 105.8 Ų | 105.8 | 69% | 0.691 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.8 | -31.1 | 172.1 | -69.9 | 169.4 | -172.9 | 170.3 | 0 | 112.9 | E139 L141 | E139-K143 WeakPolarHBondContact O-CG 3.45Å; E139-K143 PolarHBondContact O-N 3.41Å; E139-K143 VanDerWaalsContact O-N 3.15Å; L141-K143 VanDerWaalsContact C-N 3.32Å; L141-K143 PolarHBondContact O-N 2.81Å |
| 144 | R | 91.4 | Very high | 91 | Very high | 149 Ų | 149 | 110.3 Ų | 110.3 | 56% | 0.562 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -95.7 | -11.8 | 180 | -64.6 | -179.8 | -179.3 | 167.2 | 4.4 | 113.5 | E140 L141 E142 D146 E147 I148 | E140-R144 PolarHBondContact O-N 2.92Å; L141-R144 CarbonylContact O-C 3.32Å; L141-R144 VanDerWaalsContact O-C 3.32Å; L141-R144 WeakPolarHBondContact O-CA 3.31Å; L141-R144 PolarHBondContact O-N 3.12Å; E142-R144 PolarHBondContact O-N 3.37Å; R144-D146 VanDerWaalsContact C-N 3.33Å; R144-D146 PolarHBondContact O-N 3.48Å; R144-E147 PolarHBondContact O-N 3.43Å; R144-E147 VanDerWaalsContact O-N 3.15Å; R144-I148 HydrophobicContact CB-CD1 4.1Å; R144-I148 WeakPolarHBondContact O-CB 3.17Å; R144-I148 VanDerWaalsContact O-CG1 3.25Å; R144-I148 WeakPolarHBondContact O-CG1 3.48Å; R144-I148 PolarHBondContact O-N 2.85Å |
| 145 | K | 91.3 | Very high | 91.2 | Very high | 69 Ų | 69 | 114.6 Ų | 114.6 | 30% | 0.3 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -56.7 | -49.8 | -177.4 | -84.7 | 174.1 | -153.6 | 168.2 | 0 | 109.5 | L141 E142 E147 I148 E149 | L141-K145 VanDerWaalsContact O-CG 3.3Å; L141-K145 WeakPolarHBondContact O-CG 3.37Å; L141-K145 PolarHBondContact O-N 3.05Å; E142-K145 HydrophobicContact CB-CD 4.26Å; E142-K145 HydrophobicContact CG-CD 4.34Å; E142-K145 PolarHBondContact O-N 3.01Å; E142-K145 IonicContact OE1-NZ 3Å; E142-K145 PolarHBondContact OE1-NZ 3.35Å; K145-E147 VanDerWaalsContact C-N 3.3Å; K145-E147 PolarHBondContact O-N 3.25Å; K145-I148 PolarHBondContact O-N 2.83Å; K145-E149 VanDerWaalsContact O-CB 3.28Å; K145-E149 WeakPolarHBondContact O-CB 3.49Å; K145-E149 VanDerWaalsContact O-CG 3.25Å; K145-E149 WeakPolarHBondContact O-CG 3.33Å; K145-E149 PolarHBondContact O-N 3.05Å |
| 146 | D | 90 | Very high | 91.4 | Very high | 88 Ų | 88 | 112.3 Ų | 112.3 | 47% | 0.471 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60 | -38.1 | 179.5 | -72.6 | -0 | 0 | 0 | 0 | 113.3 | R144 R150 | R144-D146 VanDerWaalsContact C-N 3.33Å; R144-D146 PolarHBondContact O-N 3.48Å; D146-R150 WeakPolarHBondContact O-CB 3.48Å; D146-R150 WeakPolarHBondContact O-CD 3.24Å; D146-R150 WeakPolarHBondContact O-CG 3.44Å; D146-R150 PolarHBondContact O-N 3.24Å; D146-R150 IonicContact OD2-NH2 2.68Å |
| 147 | E | 90.1 | Very high | 91.6 | Very high | 125 Ų | 125 | 108.8 Ų | 108.8 | 58% | 0.584 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -70.3 | -45.1 | 178 | -65.8 | 179.8 | 174.7 | 0 | 0 | 111.2 | R144 K145 R150 E151 | R144-E147 PolarHBondContact O-N 3.43Å; R144-E147 VanDerWaalsContact O-N 3.15Å; K145-E147 VanDerWaalsContact C-N 3.3Å; K145-E147 PolarHBondContact O-N 3.25Å; E147-R150 PolarHBondContact O-N 2.98Å; E147-E151 PolarHBondContact O-N 3.28Å |
| 148 | I | 89.4 | Confident | 91.8 | Very high | 85 Ų | 85 | 110.7 Ų | 110.7 | 44% | 0.436 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.6 | -45.9 | 176.4 | -66.9 | 165.8 | 0 | 0 | 0 | 110.1 | R144 K145 E151 V152 | R144-I148 HydrophobicContact CB-CD1 4.1Å; R144-I148 WeakPolarHBondContact O-CB 3.17Å; R144-I148 VanDerWaalsContact O-CG1 3.25Å; R144-I148 WeakPolarHBondContact O-CG1 3.48Å; R144-I148 PolarHBondContact O-N 2.85Å; K145-I148 PolarHBondContact O-N 2.83Å; I148-E151 PolarHBondContact O-N 2.85Å; I148-V152 HydrophobicContact CG2-CG2 4.26Å; I148-V152 WeakPolarHBondContact O-CB 3.36Å; I148-V152 VanDerWaalsContact O-CG2 3.25Å; I148-V152 WeakPolarHBondContact O-CG2 3.46Å; I148-V152 PolarHBondContact O-N 3.47Å |
| 149 | E | 92.4 | Very high | 92.2 | Very high | 111 Ų | 111 | 107.4 Ų | 107.4 | 52% | 0.519 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.7 | -45.1 | 178.4 | -77 | 179.8 | -168.6 | 0 | 0 | 111.2 | K145 E151 V152 L153 | K145-E149 VanDerWaalsContact O-CB 3.28Å; K145-E149 WeakPolarHBondContact O-CB 3.49Å; K145-E149 VanDerWaalsContact O-CG 3.25Å; K145-E149 WeakPolarHBondContact O-CG 3.33Å; K145-E149 PolarHBondContact O-N 3.05Å; E149-E151 VanDerWaalsContact C-N 3.33Å; E149-E151 PolarHBondContact O-N 3.44Å; E149-V152 PolarHBondContact O-N 2.83Å; E149-L153 WeakPolarHBondContact O-CB 3.28Å; E149-L153 WeakPolarHBondContact O-CG 3.24Å; E149-L153 PolarHBondContact O-N 3.34Å |
| 150 | R | 94.4 | Very high | 92.6 | Very high | 144 Ų | 144 | 107.5 Ų | 107.5 | 54% | 0.543 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.3 | -42.1 | 174.8 | -74.3 | 172.3 | -157.1 | 129 | 3.8 | 112 | D146 E147 R154 | D146-R150 WeakPolarHBondContact O-CB 3.48Å; D146-R150 WeakPolarHBondContact O-CD 3.24Å; D146-R150 WeakPolarHBondContact O-CG 3.44Å; D146-R150 PolarHBondContact O-N 3.24Å; D146-R150 IonicContact OD2-NH2 2.68Å; E147-R150 PolarHBondContact O-N 2.98Å; R150-R154 WeakPolarHBondContact O-CB 3.27Å; R150-R154 WeakPolarHBondContact O-CG 3.41Å; R150-R154 PolarHBondContact O-N 2.92Å |
| 151 | E | 93.4 | Very high | 93.1 | Very high | 98 Ų | 98 | 108.7 Ų | 108.7 | 46% | 0.458 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.1 | -42 | 179.2 | -169.6 | 176.3 | -164.1 | 0 | 0 | 112.1 | E147 I148 E149 L153 R154 R155 | E147-E151 PolarHBondContact O-N 3.28Å; I148-E151 PolarHBondContact O-N 2.85Å; E149-E151 VanDerWaalsContact C-N 3.33Å; E149-E151 PolarHBondContact O-N 3.44Å; E151-L153 VanDerWaalsContact C-N 3.35Å; E151-R154 PolarHBondContact O-N 2.67Å; E151-R155 VanDerWaalsContact CD-NH2 3.26Å; E151-R155 WeakPolarHBondContact O-CG 3.38Å; E151-R155 PolarHBondContact O-N 2.94Å; E151-R155 IonicContact OE1-CZ 2.67Å; E151-R155 IonicContact OE1-NE 3.24Å; E151-R155 IonicContact OE1-NH2 3.56Å; E151-R155 PolarHBondContact OE1-NH2 2.92Å; E151-R155 IonicContact OE2-NH2 3.72Å |
| 152 | V | 95.4 | Very high | 93.4 | Very high | 73 Ų | 73 | 108.7 Ų | 108.7 | 44% | 0.442 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.5 | -46.5 | 174.2 | 169.8 | 0 | 0 | 0 | 0 | 110.3 | I148 E149 R154 R155 V156 | I148-V152 HydrophobicContact CG2-CG2 4.26Å; I148-V152 WeakPolarHBondContact O-CB 3.36Å; I148-V152 VanDerWaalsContact O-CG2 3.25Å; I148-V152 WeakPolarHBondContact O-CG2 3.46Å; I148-V152 PolarHBondContact O-N 3.47Å; E149-V152 PolarHBondContact O-N 2.83Å; V152-R154 PolarHBondContact O-N 2.87Å; V152-R155 PolarHBondContact O-N 3.42Å; V152-V156 HydrophobicContact CG1-CG2 4.35Å; V152-V156 WeakPolarHBondContact O-CB 3.43Å; V152-V156 VanDerWaalsContact O-CG2 3.25Å; V152-V156 WeakPolarHBondContact O-CG2 3.29Å; V152-V156 PolarHBondContact O-N 2.96Å |
| 153 | L | 95.4 | Very high | 93.7 | Very high | 102 Ų | 102 | 109.1 Ų | 109.1 | 53% | 0.534 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.9 | -45.3 | 176.5 | -73.5 | 172.6 | 0 | 0 | 0 | 111.3 | E149 E151 R155 V156 E157 | E149-L153 WeakPolarHBondContact O-CB 3.28Å; E149-L153 WeakPolarHBondContact O-CG 3.24Å; E149-L153 PolarHBondContact O-N 3.34Å; E151-L153 VanDerWaalsContact C-N 3.35Å; L153-R155 PolarHBondContact O-N 2.83Å; L153-V156 PolarHBondContact O-N 3.38Å; L153-E157 WeakPolarHBondContact O-CB 3.36Å; L153-E157 VanDerWaalsContact O-CG 3.31Å; L153-E157 WeakPolarHBondContact O-CG 3.4Å; L153-E157 PolarHBondContact O-N 3.28Å |
| 154 | R | 96.8 | Very high | 94 | Very high | 174 Ų | 174 | 106.9 Ų | 106.9 | 66% | 0.657 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -58 | -49.2 | 175.4 | -79.2 | -177.5 | 178.8 | -179.3 | 1.1 | 112.4 | R150 E151 V152 V156 E157 E158 | R150-R154 WeakPolarHBondContact O-CB 3.27Å; R150-R154 WeakPolarHBondContact O-CG 3.41Å; R150-R154 PolarHBondContact O-N 2.92Å; E151-R154 PolarHBondContact O-N 2.67Å; V152-R154 PolarHBondContact O-N 2.87Å; R154-V156 VanDerWaalsContact C-N 3.31Å; R154-V156 PolarHBondContact O-N 3.48Å; R154-E157 PolarHBondContact O-N 3.45Å; R154-E158 WeakPolarHBondContact O-CB 3.34Å; R154-E158 VanDerWaalsContact O-CG 3.31Å; R154-E158 WeakPolarHBondContact O-CG 3.46Å; R154-E158 PolarHBondContact O-N 3.11Å |
| 155 | R | 95.8 | Very high | 94.3 | Very high | 145 Ų | 145 | 107.6 Ų | 107.6 | 55% | 0.547 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.6 | -38.7 | 178.5 | -70.4 | 178.7 | -175.2 | 158 | 0 | 112.1 | E151 V152 L153 A159 | E151-R155 VanDerWaalsContact CD-NH2 3.26Å; E151-R155 WeakPolarHBondContact O-CG 3.38Å; E151-R155 PolarHBondContact O-N 2.94Å; E151-R155 IonicContact OE1-CZ 2.67Å; E151-R155 IonicContact OE1-NE 3.24Å; E151-R155 IonicContact OE1-NH2 3.56Å; E151-R155 PolarHBondContact OE1-NH2 2.92Å; E151-R155 IonicContact OE2-NH2 3.72Å; V152-R155 PolarHBondContact O-N 3.42Å; L153-R155 PolarHBondContact O-N 2.83Å; R155-A159 VanDerWaalsContact O-CB 3.29Å; R155-A159 WeakPolarHBondContact O-CB 3.49Å; R155-A159 PolarHBondContact O-N 3.13Å |
| 156 | V | 97 | Very high | 94.5 | Very high | 63 Ų | 63 | 109.5 Ų | 109.5 | 38% | 0.382 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.6 | -42.4 | 176.4 | 169.8 | 0 | 0 | 0 | 0 | 111.1 | V152 L153 R154 A159 K160 | V152-V156 HydrophobicContact CG1-CG2 4.35Å; V152-V156 WeakPolarHBondContact O-CB 3.43Å; V152-V156 VanDerWaalsContact O-CG2 3.25Å; V152-V156 WeakPolarHBondContact O-CG2 3.29Å; V152-V156 PolarHBondContact O-N 2.96Å; L153-V156 PolarHBondContact O-N 3.38Å; R154-V156 VanDerWaalsContact C-N 3.31Å; R154-V156 PolarHBondContact O-N 3.48Å; V156-A159 PolarHBondContact O-N 3Å; V156-K160 HydrophobicContact CG1-CD 4.16Å; V156-K160 HydrophobicContact CG1-CG 4.47Å; V156-K160 WeakPolarHBondContact O-CB 3.33Å; V156-K160 VanDerWaalsContact O-CG 3.27Å; V156-K160 WeakPolarHBondContact O-CG 3.34Å; V156-K160 PolarHBondContact O-N 3.42Å |
| 157 | E | 95.3 | Very high | 94.8 | Very high | 93 Ų | 93 | 110.6 Ų | 110.6 | 44% | 0.435 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.7 | -42.4 | 175.6 | -75.6 | 177.6 | -172 | 0 | 0 | 111.9 | L153 R154 K160 R161 | L153-E157 WeakPolarHBondContact O-CB 3.36Å; L153-E157 VanDerWaalsContact O-CG 3.31Å; L153-E157 WeakPolarHBondContact O-CG 3.4Å; L153-E157 PolarHBondContact O-N 3.28Å; R154-E157 PolarHBondContact O-N 3.45Å; E157-K160 PolarHBondContact O-N 2.9Å; E157-R161 WeakPolarHBondContact O-CB 3.3Å; E157-R161 VanDerWaalsContact O-CG 3.25Å; E157-R161 WeakPolarHBondContact O-CG 3.3Å; E157-R161 PolarHBondContact O-N 2.85Å |
| 158 | E | 95.8 | Very high | 95.1 | Very high | 110 Ų | 110 | 109.7 Ų | 109.7 | 51% | 0.514 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.9 | -46.5 | 174.7 | -74.7 | 172.5 | -177.7 | 0 | 0 | 111.3 | R154 K160 R161 I162 | R154-E158 WeakPolarHBondContact O-CB 3.34Å; R154-E158 VanDerWaalsContact O-CG 3.31Å; R154-E158 WeakPolarHBondContact O-CG 3.46Å; R154-E158 PolarHBondContact O-N 3.11Å; E158-K160 PolarHBondContact O-N 3.36Å; E158-R161 PolarHBondContact O-N 2.87Å; E158-I162 VanDerWaalsContact O-CG1 3.29Å; E158-I162 WeakPolarHBondContact O-CG1 3.44Å; E158-I162 PolarHBondContact O-N 3.38Å |
| 159 | A | 94.6 | Very high | 95.4 | Very high | 47 Ų | 47 | 110.2 Ų | 110.2 | 39% | 0.388 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.8 | -44.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | R155 V156 I162 M163 | R155-A159 VanDerWaalsContact O-CB 3.29Å; R155-A159 WeakPolarHBondContact O-CB 3.49Å; R155-A159 PolarHBondContact O-N 3.13Å; V156-A159 PolarHBondContact O-N 3Å; A159-I162 PolarHBondContact O-N 2.85Å; A159-M163 WeakPolarHBondContact O-CG 3.49Å; A159-M163 PolarHBondContact O-N 2.72Å |
| 160 | K | 96.1 | Very high | 95.5 | Very high | 111 Ų | 111 | 110.3 Ų | 110.3 | 48% | 0.483 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.9 | -46.7 | 174.3 | -77.3 | 176.1 | -179 | 178.7 | 0 | 111.4 | V156 E157 E158 I162 M163 E164 | V156-K160 HydrophobicContact CG1-CD 4.16Å; V156-K160 HydrophobicContact CG1-CG 4.47Å; V156-K160 WeakPolarHBondContact O-CB 3.33Å; V156-K160 VanDerWaalsContact O-CG 3.27Å; V156-K160 WeakPolarHBondContact O-CG 3.34Å; V156-K160 PolarHBondContact O-N 3.42Å; E157-K160 PolarHBondContact O-N 2.9Å; E158-K160 PolarHBondContact O-N 3.36Å; K160-I162 VanDerWaalsContact C-N 3.3Å; K160-I162 PolarHBondContact O-N 3.27Å; K160-M163 PolarHBondContact O-N 3.34Å; K160-E164 WeakPolarHBondContact O-CB 3.28Å; K160-E164 VanDerWaalsContact O-CG 3.27Å; K160-E164 WeakPolarHBondContact O-CG 3.36Å; K160-E164 PolarHBondContact O-N 3.36Å |
| 161 | R | 97.2 | Very high | 95.6 | Very high | 138 Ų | 138 | 106.8 Ų | 106.8 | 52% | 0.521 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.3 | -33.7 | 178.5 | -76.1 | 176.3 | -176.9 | 174.2 | 5.6 | 113.1 | E157 E158 R165 | E157-R161 WeakPolarHBondContact O-CB 3.3Å; E157-R161 VanDerWaalsContact O-CG 3.25Å; E157-R161 WeakPolarHBondContact O-CG 3.3Å; E157-R161 PolarHBondContact O-N 2.85Å; E158-R161 PolarHBondContact O-N 2.87Å; R161-R165 VanDerWaalsContact O-CB 3.3Å; R161-R165 WeakPolarHBondContact O-CB 3.35Å; R161-R165 VanDerWaalsContact O-CG 3.3Å; R161-R165 WeakPolarHBondContact O-CG 3.39Å; R161-R165 PolarHBondContact O-N 3.47Å; R161-R165 VanDerWaalsContact O-N 3.1Å; R161-R165 PolarHBondContact O-NE 2.96Å; R161-R165 VanDerWaalsContact O-NE 3.16Å |
| 162 | I | 96.3 | Very high | 95.7 | Very high | 88 Ų | 88 | 107.5 Ų | 107.5 | 45% | 0.451 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -69.7 | -48.8 | 175.2 | -69.1 | 164.9 | 0 | 0 | 0 | 109.4 | E158 A159 K160 E164 R165 Q166 | E158-I162 VanDerWaalsContact O-CG1 3.29Å; E158-I162 WeakPolarHBondContact O-CG1 3.44Å; E158-I162 PolarHBondContact O-N 3.38Å; A159-I162 PolarHBondContact O-N 2.85Å; K160-I162 VanDerWaalsContact C-N 3.3Å; K160-I162 PolarHBondContact O-N 3.27Å; I162-E164 PolarHBondContact O-N 3.42Å; I162-R165 PolarHBondContact O-N 3.29Å; I162-Q166 WeakPolarHBondContact O-CG 3.43Å; I162-Q166 PolarHBondContact O-N 2.91Å |
| 163 | M | 92.7 | Very high | 95.8 | Very high | 119 Ų | 119 | 111.2 Ų | 111.2 | 59% | 0.586 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.6 | -43.6 | 177.8 | -72.1 | -165.9 | -65.2 | 0 | 0 | 112.3 | A159 K160 Q166 L167 | A159-M163 WeakPolarHBondContact O-CG 3.49Å; A159-M163 PolarHBondContact O-N 2.72Å; K160-M163 PolarHBondContact O-N 3.34Å; M163-Q166 PolarHBondContact O-N 3.34Å; M163-L167 WeakPolarHBondContact O-CB 3.29Å; M163-L167 PolarHBondContact O-N 3.48Å |
| 164 | E | 94.5 | Very high | 95.8 | Very high | 113 Ų | 113 | 112.2 Ų | 112.2 | 53% | 0.528 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63 | -42.6 | 177.4 | -76.3 | 171.3 | -174.4 | 0 | 0 | 111.7 | K160 I162 L167 L168 | K160-E164 WeakPolarHBondContact O-CB 3.28Å; K160-E164 VanDerWaalsContact O-CG 3.27Å; K160-E164 WeakPolarHBondContact O-CG 3.36Å; K160-E164 PolarHBondContact O-N 3.36Å; I162-E164 PolarHBondContact O-N 3.42Å; E164-L167 PolarHBondContact O-N 2.88Å; E164-L168 WeakPolarHBondContact O-CB 3.43Å; E164-L168 VanDerWaalsContact O-CG 3.3Å; E164-L168 WeakPolarHBondContact O-CG 3.3Å; E164-L168 PolarHBondContact O-N 3.49Å |
| 165 | R | 97 | Very high | 95.7 | Very high | 163 Ų | 163 | 111.4 Ų | 111.4 | 62% | 0.615 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.5 | -46.3 | 175.5 | -84 | -176.2 | -91.5 | -176.1 | -7.4 | 112.1 | R161 I162 L167 L168 E169 | R161-R165 VanDerWaalsContact O-CB 3.3Å; R161-R165 WeakPolarHBondContact O-CB 3.35Å; R161-R165 VanDerWaalsContact O-CG 3.3Å; R161-R165 WeakPolarHBondContact O-CG 3.39Å; R161-R165 PolarHBondContact O-N 3.47Å; R161-R165 VanDerWaalsContact O-N 3.1Å; R161-R165 PolarHBondContact O-NE 2.96Å; R161-R165 VanDerWaalsContact O-NE 3.16Å; I162-R165 PolarHBondContact O-N 3.29Å; R165-L167 VanDerWaalsContact C-N 3.34Å; R165-L167 PolarHBondContact O-N 2.98Å; R165-L168 PolarHBondContact O-N 3.41Å; R165-E169 WeakPolarHBondContact O-CB 3.27Å; R165-E169 PolarHBondContact O-N 3.44Å |
| 166 | Q | 95.9 | Very high | 95.8 | Very high | 110 Ų | 110 | 110.6 Ų | 110.6 | 51% | 0.514 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.7 | -44.7 | 176.7 | -73.1 | 175.5 | -23.5 | 0 | 0 | 111.3 | I162 M163 L168 E169 E170 | I162-Q166 WeakPolarHBondContact O-CG 3.43Å; I162-Q166 PolarHBondContact O-N 2.91Å; M163-Q166 PolarHBondContact O-N 3.34Å; Q166-L168 PolarHBondContact O-N 3.47Å; Q166-E169 PolarHBondContact O-N 2.91Å; Q166-E170 WeakPolarHBondContact O-CB 3.25Å; Q166-E170 WeakPolarHBondContact O-CG 3.31Å; Q166-E170 PolarHBondContact O-N 2.92Å |
| 167 | L | 95.4 | Very high | 95.7 | Very high | 110 Ų | 110 | 110.4 Ų | 110.4 | 58% | 0.576 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.8 | -42.9 | 178.4 | -172.4 | 72.1 | 0 | 0 | 0 | 112 | M163 E164 R165 L171 | M163-L167 WeakPolarHBondContact O-CB 3.29Å; M163-L167 PolarHBondContact O-N 3.48Å; E164-L167 PolarHBondContact O-N 2.88Å; R165-L167 VanDerWaalsContact C-N 3.34Å; R165-L167 PolarHBondContact O-N 2.98Å; L167-L171 WeakPolarHBondContact O-CB 3.36Å; L167-L171 PolarHBondContact O-N 2.97Å |
| 168 | L | 96.2 | Very high | 95.7 | Very high | 107 Ų | 107 | 112 Ų | 112 | 56% | 0.56 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.8 | -44.1 | 176.5 | -73.1 | 173 | 0 | 0 | 0 | 111.6 | E164 R165 Q166 E170 L171 E172 | E164-L168 WeakPolarHBondContact O-CB 3.43Å; E164-L168 VanDerWaalsContact O-CG 3.3Å; E164-L168 WeakPolarHBondContact O-CG 3.3Å; E164-L168 PolarHBondContact O-N 3.49Å; R165-L168 PolarHBondContact O-N 3.41Å; Q166-L168 PolarHBondContact O-N 3.47Å; L168-E170 PolarHBondContact O-N 3.1Å; L168-L171 PolarHBondContact O-N 2.92Å; L168-E172 WeakPolarHBondContact O-CB 3.49Å; L168-E172 WeakPolarHBondContact O-CG 3.31Å; L168-E172 PolarHBondContact O-N 3.34Å |
| 169 | E | 96.3 | Very high | 95.8 | Very high | 95 Ų | 95 | 111.5 Ų | 111.5 | 44% | 0.444 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.1 | -40.8 | 178.1 | -168.8 | -174 | 158.8 | 0 | 0 | 111.8 | R165 Q166 L171 E172 R173 | R165-E169 WeakPolarHBondContact O-CB 3.27Å; R165-E169 PolarHBondContact O-N 3.44Å; Q166-E169 PolarHBondContact O-N 2.91Å; E169-L171 VanDerWaalsContact C-N 3.34Å; E169-E172 PolarHBondContact O-N 3.16Å; E169-R173 WeakPolarHBondContact O-CB 3.4Å; E169-R173 PolarHBondContact O-N 2.91Å; E169-R173 IonicContact OE1-CZ 3.44Å; E169-R173 VanDerWaalsContact OE1-CZ 3.24Å; E169-R173 IonicContact OE1-NH1 2.71Å; E169-R173 PolarHBondContact OE1-NH1 3.32Å; E169-R173 IonicContact OE1-NH2 3.91Å; E169-R173 PolarHBondContact OE1-NH2 2.86Å |
| 170 | E | 95 | Very high | 95.9 | Very high | 113 Ų | 113 | 111.9 Ų | 111.9 | 53% | 0.528 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.3 | -42.1 | 174 | -76.3 | 179.4 | -179 | 0 | 0 | 111.8 | Q166 L168 R173 Q174 | Q166-E170 WeakPolarHBondContact O-CB 3.25Å; Q166-E170 WeakPolarHBondContact O-CG 3.31Å; Q166-E170 PolarHBondContact O-N 2.92Å; L168-E170 PolarHBondContact O-N 3.1Å; E170-R173 PolarHBondContact O-N 3.39Å; E170-Q174 WeakPolarHBondContact O-CB 3.32Å; E170-Q174 VanDerWaalsContact O-CG 3.28Å; E170-Q174 WeakPolarHBondContact O-CG 3.34Å; E170-Q174 PolarHBondContact O-N 3.47Å |
| 171 | L | 96 | Very high | 95.8 | Very high | 70 Ų | 70 | 108.8 Ų | 108.8 | 37% | 0.366 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -70 | -39.2 | -179.5 | -149.5 | 156.1 | 0 | 0 | 0 | 111.4 | L167 L168 E169 Q174 R175 | L167-L171 WeakPolarHBondContact O-CB 3.36Å; L167-L171 PolarHBondContact O-N 2.97Å; L168-L171 PolarHBondContact O-N 2.92Å; E169-L171 VanDerWaalsContact C-N 3.34Å; L171-Q174 PolarHBondContact O-N 3.21Å; L171-R175 HydrophobicContact CD2-CG 4.29Å; L171-R175 VanDerWaalsContact CD2-CZ 3.45Å; L171-R175 VanDerWaalsContact CD2-NE 3.33Å; L171-R175 WeakPolarHBondContact O-CG 3.42Å; L171-R175 PolarHBondContact O-N 2.85Å |
| 172 | E | 95.1 | Very high | 95.7 | Very high | 113 Ų | 113 | 108 Ų | 108 | 53% | 0.528 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.1 | -44.7 | 172.2 | -74.9 | -178.4 | 179 | 0 | 0 | 111.9 | L168 E169 Q174 R175 Q176 | L168-E172 WeakPolarHBondContact O-CB 3.49Å; L168-E172 WeakPolarHBondContact O-CG 3.31Å; L168-E172 PolarHBondContact O-N 3.34Å; E169-E172 PolarHBondContact O-N 3.16Å; E172-Q174 VanDerWaalsContact C-N 3.33Å; E172-Q174 PolarHBondContact O-N 3.04Å; E172-R175 PolarHBondContact O-N 2.93Å; E172-Q176 WeakPolarHBondContact O-CB 3.25Å; E172-Q176 WeakPolarHBondContact O-CG 3.43Å; E172-Q176 PolarHBondContact O-N 3.32Å |
| 173 | R | 96.9 | Very high | 95.8 | Very high | 152 Ų | 152 | 110.1 Ų | 110.1 | 57% | 0.574 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -58.4 | -44.8 | 173.4 | -87.9 | -161 | -179.6 | 92.3 | 9.9 | 111.9 | E169 E170 Q176 A177 | E169-R173 WeakPolarHBondContact O-CB 3.4Å; E169-R173 PolarHBondContact O-N 2.91Å; E169-R173 IonicContact OE1-CZ 3.44Å; E169-R173 VanDerWaalsContact OE1-CZ 3.24Å; E169-R173 IonicContact OE1-NH1 2.71Å; E169-R173 PolarHBondContact OE1-NH1 3.32Å; E169-R173 IonicContact OE1-NH2 3.91Å; E169-R173 PolarHBondContact OE1-NH2 2.86Å; E170-R173 PolarHBondContact O-N 3.39Å; R173-Q176 PolarHBondContact O-N 3.48Å; R173-A177 VanDerWaalsContact O-CB 3.28Å; R173-A177 WeakPolarHBondContact O-CB 3.43Å; R173-A177 PolarHBondContact O-N 3.39Å |
| 174 | Q | 95.1 | Very high | 95.9 | Very high | 122 Ų | 122 | 106.6 Ų | 106.6 | 57% | 0.57 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.2 | -46.4 | 177.8 | -75.8 | 175.1 | 4 | 0 | 0 | 111.4 | E170 L171 E172 Q176 A177 E178 | E170-Q174 WeakPolarHBondContact O-CB 3.32Å; E170-Q174 VanDerWaalsContact O-CG 3.28Å; E170-Q174 WeakPolarHBondContact O-CG 3.34Å; E170-Q174 PolarHBondContact O-N 3.47Å; L171-Q174 PolarHBondContact O-N 3.21Å; E172-Q174 VanDerWaalsContact C-N 3.33Å; E172-Q174 PolarHBondContact O-N 3.04Å; Q174-Q176 PolarHBondContact O-N 3.48Å; Q174-A177 PolarHBondContact O-N 3.4Å; Q174-E178 WeakPolarHBondContact O-CG 3.38Å; Q174-E178 PolarHBondContact O-N 3.33Å |
| 175 | R | 96.6 | Very high | 96.1 | Very high | 157 Ų | 157 | 109.7 Ų | 109.7 | 59% | 0.592 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -60.8 | -44.6 | 176.1 | -74.5 | 176.4 | 177.4 | 169.1 | 2 | 112.3 | L171 E172 A177 E178 L179 | L171-R175 HydrophobicContact CD2-CG 4.29Å; L171-R175 VanDerWaalsContact CD2-CZ 3.45Å; L171-R175 VanDerWaalsContact CD2-NE 3.33Å; L171-R175 WeakPolarHBondContact O-CG 3.42Å; L171-R175 PolarHBondContact O-N 2.85Å; E172-R175 PolarHBondContact O-N 2.93Å; R175-A177 VanDerWaalsContact C-N 3.34Å; R175-E178 PolarHBondContact O-N 2.92Å; R175-L179 WeakPolarHBondContact O-CB 3.36Å; R175-L179 WeakPolarHBondContact O-CG 3.12Å; R175-L179 PolarHBondContact O-N 3.37Å |
| 176 | Q | 95.8 | Very high | 96 | Very high | 128 Ų | 128 | 106.6 Ų | 106.6 | 60% | 0.598 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.7 | -41.4 | 177.2 | -72.6 | 177.8 | 5.4 | 0 | 0 | 111.5 | E172 R173 Q174 L179 A180 | E172-Q176 WeakPolarHBondContact O-CB 3.25Å; E172-Q176 WeakPolarHBondContact O-CG 3.43Å; E172-Q176 PolarHBondContact O-N 3.32Å; R173-Q176 PolarHBondContact O-N 3.48Å; Q174-Q176 PolarHBondContact O-N 3.48Å; Q176-L179 PolarHBondContact O-N 2.94Å; Q176-A180 VanDerWaalsContact O-CB 3.24Å; Q176-A180 WeakPolarHBondContact O-CB 3.47Å; Q176-A180 PolarHBondContact O-N 3.26Å |
| 177 | A | 96.3 | Very high | 95.9 | Very high | 60 Ų | 60 | 107.4 Ų | 107.4 | 50% | 0.496 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.9 | -40.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | R173 Q174 R175 A180 A181 | R173-A177 VanDerWaalsContact O-CB 3.28Å; R173-A177 WeakPolarHBondContact O-CB 3.43Å; R173-A177 PolarHBondContact O-N 3.39Å; Q174-A177 PolarHBondContact O-N 3.4Å; R175-A177 VanDerWaalsContact C-N 3.34Å; A177-A180 PolarHBondContact O-N 2.82Å; A177-A181 VanDerWaalsContact O-CB 3.24Å; A177-A181 WeakPolarHBondContact O-CB 3.27Å; A177-A181 PolarHBondContact O-N 3.26Å |
| 178 | E | 95.4 | Very high | 95.9 | Very high | 125 Ų | 125 | 107.4 Ų | 107.4 | 58% | 0.584 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.7 | -45.8 | 175 | -75.9 | -178.5 | 173.3 | 0 | 0 | 111.9 | Q174 R175 A181 Q182 | Q174-E178 WeakPolarHBondContact O-CG 3.38Å; Q174-E178 PolarHBondContact O-N 3.33Å; R175-E178 PolarHBondContact O-N 2.92Å; E178-A181 PolarHBondContact O-N 2.85Å; E178-Q182 WeakPolarHBondContact O-CG 3.32Å; E178-Q182 PolarHBondContact O-N 3.36Å |
| 179 | L | 96.6 | Very high | 95.9 | Very high | 100 Ų | 100 | 107.4 Ų | 107.4 | 52% | 0.524 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.7 | -41.6 | 176.7 | -71.2 | 173.8 | 0 | 0 | 0 | 111.8 | R175 Q176 Q182 K183 | R175-L179 WeakPolarHBondContact O-CB 3.36Å; R175-L179 WeakPolarHBondContact O-CG 3.12Å; R175-L179 PolarHBondContact O-N 3.37Å; Q176-L179 PolarHBondContact O-N 2.94Å; L179-Q182 PolarHBondContact O-N 2.99Å; L179-K183 WeakPolarHBondContact O-CG 3.25Å; L179-K183 PolarHBondContact O-N 3.45Å |
| 180 | A | 96.4 | Very high | 95.9 | Very high | 56 Ų | 56 | 107.5 Ų | 107.5 | 46% | 0.463 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64 | -42.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q176 A177 Q182 K183 A184 | Q176-A180 VanDerWaalsContact O-CB 3.24Å; Q176-A180 WeakPolarHBondContact O-CB 3.47Å; Q176-A180 PolarHBondContact O-N 3.26Å; A177-A180 PolarHBondContact O-N 2.82Å; A180-Q182 VanDerWaalsContact C-N 3.34Å; A180-Q182 PolarHBondContact O-N 3.48Å; A180-K183 PolarHBondContact O-N 2.78Å; A180-A184 WeakPolarHBondContact O-CB 3.48Å; A180-A184 PolarHBondContact O-N 3.24Å |
| 181 | A | 95.9 | Very high | 96 | Very high | 46 Ų | 46 | 104.3 Ų | 104.3 | 38% | 0.38 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65 | -36.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A177 E178 R185 | A177-A181 VanDerWaalsContact O-CB 3.24Å; A177-A181 WeakPolarHBondContact O-CB 3.27Å; A177-A181 PolarHBondContact O-N 3.26Å; E178-A181 PolarHBondContact O-N 2.85Å; A181-R185 VanDerWaalsContact O-CG 3.27Å; A181-R185 WeakPolarHBondContact O-CG 3.2Å; A181-R185 PolarHBondContact O-N 2.9Å; A181-R185 VanDerWaalsContact O-N 3.11Å |
| 182 | Q | 95.1 | Very high | 96 | Very high | 121 Ų | 121 | 106.1 Ų | 106.1 | 57% | 0.565 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.7 | -46.3 | 173.4 | -75.1 | 178.4 | 14.9 | 0 | 0 | 111.6 | E178 L179 A180 R185 E186 | E178-Q182 WeakPolarHBondContact O-CG 3.32Å; E178-Q182 PolarHBondContact O-N 3.36Å; L179-Q182 PolarHBondContact O-N 2.99Å; A180-Q182 VanDerWaalsContact C-N 3.34Å; A180-Q182 PolarHBondContact O-N 3.48Å; Q182-R185 PolarHBondContact O-N 2.93Å; Q182-E186 PolarHBondContact O-N 3.37Å |
| 183 | K | 96.5 | Very high | 96.1 | Very high | 133 Ų | 133 | 108.5 Ų | 108.5 | 58% | 0.578 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.7 | -45.4 | 176.4 | -74.2 | -179.8 | 178.8 | -174 | 0 | 112.2 | L179 A180 R185 E186 E187 | L179-K183 WeakPolarHBondContact O-CG 3.25Å; L179-K183 PolarHBondContact O-N 3.45Å; A180-K183 PolarHBondContact O-N 2.78Å; K183-R185 VanDerWaalsContact C-N 3.31Å; K183-R185 PolarHBondContact O-N 2.82Å; K183-E186 WeakPolarHBondContact O-CB 3.25Å; K183-E186 PolarHBondContact O-N 2.84Å; K183-E186 VanDerWaalsContact O-N 3.13Å; K183-E187 WeakPolarHBondContact O-CB 3.28Å; K183-E187 WeakPolarHBondContact O-CG 3.28Å; K183-E187 PolarHBondContact O-N 3.27Å |
| 184 | A | 96.7 | Very high | 96.1 | Very high | 44 Ų | 44 | 107.4 Ų | 107.4 | 36% | 0.364 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.8 | -41.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A180 E187 E188 | A180-A184 WeakPolarHBondContact O-CB 3.48Å; A180-A184 PolarHBondContact O-N 3.24Å; A184-E187 PolarHBondContact O-N 3.47Å; A184-E188 WeakPolarHBondContact O-CG 3.36Å; A184-E188 PolarHBondContact O-N 3.02Å |
| 185 | R | 96.6 | Very high | 96.1 | Very high | 179 Ų | 179 | 107.4 Ų | 107.4 | 68% | 0.675 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.4 | -41.4 | 174.4 | -72.9 | 174.2 | -176.3 | -176.8 | 3.7 | 112.4 | A181 Q182 K183 E188 E189 | A181-R185 VanDerWaalsContact O-CG 3.27Å; A181-R185 WeakPolarHBondContact O-CG 3.2Å; A181-R185 PolarHBondContact O-N 2.9Å; A181-R185 VanDerWaalsContact O-N 3.11Å; Q182-R185 PolarHBondContact O-N 2.93Å; K183-R185 VanDerWaalsContact C-N 3.31Å; K183-R185 PolarHBondContact O-N 2.82Å; R185-E188 PolarHBondContact O-N 2.74Å; R185-E189 WeakPolarHBondContact O-CG 3.39Å; R185-E189 PolarHBondContact O-N 2.63Å |
| 186 | E | 95 | Very high | 96.1 | Very high | 98 Ų | 98 | 105 Ų | 105 | 46% | 0.458 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.5 | -42 | 177 | -170.4 | -172.9 | 157.7 | 0 | 0 | 111.4 | Q182 K183 E189 K190 | Q182-E186 PolarHBondContact O-N 3.37Å; K183-E186 WeakPolarHBondContact O-CB 3.25Å; K183-E186 PolarHBondContact O-N 2.84Å; K183-E186 VanDerWaalsContact O-N 3.13Å; E186-E189 PolarHBondContact O-N 3.3Å; E186-K190 HydrophobicContact CG-CD 4.43Å; E186-K190 WeakPolarHBondContact O-CB 3.3Å; E186-K190 VanDerWaalsContact O-CG 3.32Å; E186-K190 WeakPolarHBondContact O-CG 3.25Å; E186-K190 PolarHBondContact O-N 2.91Å; E186-K190 WeakPolarHBondContact OE1-CE 3.45Å; E186-K190 IonicContact OE1-NZ 2.68Å; E186-K190 PolarHBondContact OE1-NZ 3.3Å |
| 187 | E | 95.7 | Very high | 96.1 | Very high | 127 Ų | 127 | 104.3 Ų | 104.3 | 59% | 0.593 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.6 | -43.4 | 175.4 | -74.4 | 173.2 | -176.6 | 0 | 0 | 111.8 | K183 A184 E189 K190 S191 | K183-E187 WeakPolarHBondContact O-CB 3.28Å; K183-E187 WeakPolarHBondContact O-CG 3.28Å; K183-E187 PolarHBondContact O-N 3.27Å; A184-E187 PolarHBondContact O-N 3.47Å; E187-E189 VanDerWaalsContact C-N 3.32Å; E187-E189 PolarHBondContact O-N 3.41Å; E187-K190 PolarHBondContact O-N 3.23Å; E187-S191 PolarHBondContact O-N 3.15Å |
| 188 | E | 95.1 | Very high | 96.2 | Very high | 109 Ų | 109 | 107.6 Ų | 107.6 | 51% | 0.509 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.1 | -36.1 | 173.2 | -76.1 | -176.6 | -166.4 | 0 | 0 | 112.8 | A184 R185 S191 K192 | A184-E188 WeakPolarHBondContact O-CG 3.36Å; A184-E188 PolarHBondContact O-N 3.02Å; R185-E188 PolarHBondContact O-N 2.74Å; E188-S191 PolarHBondContact O-OG 3.4Å; E188-S191 VanDerWaalsContact O-OG 3.05Å; E188-K192 WeakPolarHBondContact O-CB 3.39Å; E188-K192 VanDerWaalsContact O-CD 3.31Å; E188-K192 WeakPolarHBondContact O-CD 3.38Å; E188-K192 WeakPolarHBondContact O-CG 3.49Å; E188-K192 PolarHBondContact O-N 2.69Å; E188-K192 VanDerWaalsContact O-N 3.12Å; E188-K192 IonicContact OE2-NZ 3.73Å |
| 189 | E | 95.1 | Very high | 96.3 | Very high | 107 Ų | 107 | 106.6 Ų | 106.6 | 50% | 0.5 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -70 | -38.8 | 174.2 | -77.9 | -167.5 | -172.4 | 0 | 0 | 111.8 | R185 E186 E187 K192 R193 | R185-E189 WeakPolarHBondContact O-CG 3.39Å; R185-E189 PolarHBondContact O-N 2.63Å; E186-E189 PolarHBondContact O-N 3.3Å; E187-E189 VanDerWaalsContact C-N 3.32Å; E187-E189 PolarHBondContact O-N 3.41Å; E189-K192 PolarHBondContact O-N 3.33Å; E189-R193 VanDerWaalsContact O-CG 3.27Å; E189-R193 WeakPolarHBondContact O-CG 3.23Å; E189-R193 PolarHBondContact O-N 3.23Å; E189-R193 IonicContact OE2-NH2 3.73Å |
| 190 | K | 97 | Very high | 96.2 | Very high | 98 Ų | 98 | 107 Ų | 107 | 43% | 0.426 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.7 | -47.2 | 174.8 | -76.5 | 174.3 | -177.7 | 168.4 | 0 | 111.1 | E186 E187 K192 R193 E194 | E186-K190 HydrophobicContact CG-CD 4.43Å; E186-K190 WeakPolarHBondContact O-CB 3.3Å; E186-K190 VanDerWaalsContact O-CG 3.32Å; E186-K190 WeakPolarHBondContact O-CG 3.25Å; E186-K190 PolarHBondContact O-N 2.91Å; E186-K190 WeakPolarHBondContact OE1-CE 3.45Å; E186-K190 IonicContact OE1-NZ 2.68Å; E186-K190 PolarHBondContact OE1-NZ 3.3Å; E187-K190 PolarHBondContact O-N 3.23Å; K190-K192 VanDerWaalsContact C-N 3.31Å; K190-K192 PolarHBondContact O-N 3.4Å; K190-R193 WeakPolarHBondContact O-CB 3.28Å; K190-R193 PolarHBondContact O-N 2.92Å; K190-E194 WeakPolarHBondContact O-CG 3.31Å; K190-E194 PolarHBondContact O-N 2.99Å |
| 191 | S | 96.4 | Very high | 96.2 | Very high | 45 Ų | 45 | 108.6 Ų | 108.6 | 32% | 0.315 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.7 | -41.9 | 178 | 74.2 | 0 | 0 | 0 | 0 | 111.4 | E187 E188 R193 E194 E195 | E187-S191 PolarHBondContact O-N 3.15Å; E188-S191 PolarHBondContact O-OG 3.4Å; E188-S191 VanDerWaalsContact O-OG 3.05Å; S191-R193 VanDerWaalsContact C-N 3.33Å; S191-R193 PolarHBondContact O-N 2.83Å; S191-E194 PolarHBondContact O-N 3.42Å; S191-E195 WeakPolarHBondContact O-CB 3.3Å; S191-E195 VanDerWaalsContact O-CG 3.3Å; S191-E195 WeakPolarHBondContact O-CG 3.28Å; S191-E195 PolarHBondContact O-N 3.44Å |
| 192 | K | 96.8 | Very high | 96.3 | Very high | 109 Ų | 109 | 110.6 Ų | 110.6 | 47% | 0.474 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.3 | -38.5 | 174 | -72.8 | 165.8 | -167.6 | 157.9 | 0 | 112.3 | E188 E189 K190 L196 | E188-K192 WeakPolarHBondContact O-CB 3.39Å; E188-K192 VanDerWaalsContact O-CD 3.31Å; E188-K192 WeakPolarHBondContact O-CD 3.38Å; E188-K192 WeakPolarHBondContact O-CG 3.49Å; E188-K192 PolarHBondContact O-N 2.69Å; E188-K192 VanDerWaalsContact O-N 3.12Å; E188-K192 IonicContact OE2-NZ 3.73Å; E189-K192 PolarHBondContact O-N 3.33Å; K190-K192 VanDerWaalsContact C-N 3.31Å; K190-K192 PolarHBondContact O-N 3.4Å; K192-L196 WeakPolarHBondContact O-CB 3.35Å; K192-L196 WeakPolarHBondContact O-CG 3.46Å; K192-L196 PolarHBondContact O-N 2.91Å |
| 193 | R | 96.7 | Very high | 96.4 | Very high | 163 Ų | 163 | 108.8 Ų | 108.8 | 62% | 0.615 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -67.5 | -44.7 | 176.5 | -73.8 | 174.4 | -167.4 | -172.5 | 9.2 | 111.5 | E189 K190 S191 E195 L196 E197 | E189-R193 VanDerWaalsContact O-CG 3.27Å; E189-R193 WeakPolarHBondContact O-CG 3.23Å; E189-R193 PolarHBondContact O-N 3.23Å; E189-R193 IonicContact OE2-NH2 3.73Å; K190-R193 WeakPolarHBondContact O-CB 3.28Å; K190-R193 PolarHBondContact O-N 2.92Å; S191-R193 VanDerWaalsContact C-N 3.33Å; S191-R193 PolarHBondContact O-N 2.83Å; R193-E195 VanDerWaalsContact C-N 3.34Å; R193-L196 PolarHBondContact O-N 2.84Å; R193-E197 WeakPolarHBondContact O-CB 3.22Å; R193-E197 PolarHBondContact O-N 3.35Å |
| 194 | E | 96.3 | Very high | 96.4 | Very high | 128 Ų | 128 | 107.3 Ų | 107.3 | 60% | 0.598 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.4 | -41.2 | 176.4 | -71.3 | 172.5 | -171.1 | 0 | 0 | 111.4 | K190 S191 E197 K198 | K190-E194 WeakPolarHBondContact O-CG 3.31Å; K190-E194 PolarHBondContact O-N 2.99Å; S191-E194 PolarHBondContact O-N 3.42Å; E194-E197 PolarHBondContact O-N 3.32Å; E194-K198 WeakPolarHBondContact O-CB 3.27Å; E194-K198 PolarHBondContact O-N 3.35Å |
| 195 | E | 96.4 | Very high | 96.4 | Very high | 122 Ų | 122 | 112.7 Ų | 112.7 | 57% | 0.57 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.8 | -44.6 | 173.8 | -76.9 | 174.2 | -167.4 | 0 | 0 | 111.8 | S191 R193 K198 I199 | S191-E195 WeakPolarHBondContact O-CB 3.3Å; S191-E195 VanDerWaalsContact O-CG 3.3Å; S191-E195 WeakPolarHBondContact O-CG 3.28Å; S191-E195 PolarHBondContact O-N 3.44Å; R193-E195 VanDerWaalsContact C-N 3.34Å; E195-K198 PolarHBondContact O-N 3.15Å; E195-I199 VanDerWaalsContact O-CG1 3.28Å; E195-I199 WeakPolarHBondContact O-CG1 3.33Å; E195-I199 PolarHBondContact O-N 3.45Å |
| 196 | L | 96.4 | Very high | 96.4 | Very high | 107 Ų | 107 | 110.6 Ų | 110.6 | 56% | 0.56 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.5 | -42.4 | 176.1 | -73.2 | 172.4 | 0 | 0 | 0 | 112 | K192 R193 I199 L200 | K192-L196 WeakPolarHBondContact O-CB 3.35Å; K192-L196 WeakPolarHBondContact O-CG 3.46Å; K192-L196 PolarHBondContact O-N 2.91Å; R193-L196 PolarHBondContact O-N 2.84Å; L196-I199 PolarHBondContact O-N 2.94Å; L196-L200 WeakPolarHBondContact O-CG 3.28Å; L196-L200 PolarHBondContact O-N 3.38Å |
| 197 | E | 96.1 | Very high | 96.5 | Very high | 113 Ų | 113 | 109.6 Ų | 109.6 | 53% | 0.528 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.2 | -45.2 | 176.4 | -174.9 | 168.6 | -159 | 0 | 0 | 110.8 | R193 E194 I199 L200 E201 | R193-E197 WeakPolarHBondContact O-CB 3.22Å; R193-E197 PolarHBondContact O-N 3.35Å; E194-E197 PolarHBondContact O-N 3.32Å; E197-I199 VanDerWaalsContact C-N 3.34Å; E197-I199 PolarHBondContact O-N 2.78Å; E197-L200 PolarHBondContact O-N 3.34Å; E197-L200 VanDerWaalsContact O-N 3.13Å; E197-E201 WeakPolarHBondContact O-CG 3.42Å; E197-E201 PolarHBondContact O-N 2.97Å |
| 198 | K | 97.8 | Very high | 96.5 | Very high | 130 Ų | 130 | 106.1 Ų | 106.1 | 57% | 0.565 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -59.4 | -42.6 | 175 | -170.9 | 177.7 | -179.3 | -178.4 | 0 | 112.4 | E194 E195 L200 E201 E202 | E194-K198 WeakPolarHBondContact O-CB 3.27Å; E194-K198 PolarHBondContact O-N 3.35Å; E195-K198 PolarHBondContact O-N 3.15Å; K198-L200 VanDerWaalsContact C-N 3.35Å; K198-E201 PolarHBondContact O-N 3.46Å; K198-E202 WeakPolarHBondContact O-CB 3.33Å; K198-E202 WeakPolarHBondContact O-CG 3.41Å; K198-E202 PolarHBondContact O-N 3.25Å |
| 199 | I | 96.9 | Very high | 96.6 | Very high | 103 Ų | 103 | 106.3 Ų | 106.3 | 53% | 0.528 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.4 | -42.1 | 175.8 | -69.3 | 164.9 | 0 | 0 | 0 | 111 | E195 L196 E197 E202 N203 | E195-I199 VanDerWaalsContact O-CG1 3.28Å; E195-I199 WeakPolarHBondContact O-CG1 3.33Å; E195-I199 PolarHBondContact O-N 3.45Å; L196-I199 PolarHBondContact O-N 2.94Å; E197-I199 VanDerWaalsContact C-N 3.34Å; E197-I199 PolarHBondContact O-N 2.78Å; I199-E202 PolarHBondContact O-N 3.32Å; I199-N203 WeakPolarHBondContact O-CB 3.36Å; I199-N203 PolarHBondContact O-N 3.35Å |
| 200 | L | 95.6 | Very high | 96.7 | Very high | 109 Ų | 109 | 103.6 Ų | 103.6 | 57% | 0.571 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -66.1 | -42 | 177.6 | -71.3 | 174.5 | 0 | 0 | 0 | 111.6 | L196 E197 K198 N203 N204 | L196-L200 WeakPolarHBondContact O-CG 3.28Å; L196-L200 PolarHBondContact O-N 3.38Å; E197-L200 PolarHBondContact O-N 3.34Å; E197-L200 VanDerWaalsContact O-N 3.13Å; K198-L200 VanDerWaalsContact C-N 3.35Å; L200-N203 PolarHBondContact O-N 2.87Å; L200-N204 WeakPolarHBondContact O-CB 3.26Å; L200-N204 VanDerWaalsContact O-CG 3.23Å; L200-N204 PolarHBondContact O-N 3.43Å; L200-N204 PolarHBondContact O-ND2 3.45Å |
| 201 | E | 96.6 | Very high | 96.6 | Very high | 90 Ų | 90 | 105 Ų | 105 | 42% | 0.421 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.4 | -47.3 | 173.9 | -75.6 | -171.4 | -179.6 | 0 | 0 | 111.8 | E197 K198 N203 N204 R205 | E197-E201 WeakPolarHBondContact O-CG 3.42Å; E197-E201 PolarHBondContact O-N 2.97Å; K198-E201 PolarHBondContact O-N 3.46Å; E201-N203 VanDerWaalsContact C-N 3.29Å; E201-N203 PolarHBondContact O-N 3.47Å; E201-N204 PolarHBondContact O-N 3.44Å; E201-R205 WeakPolarHBondContact O-CB 3.22Å; E201-R205 VanDerWaalsContact O-CG 3.31Å; E201-R205 WeakPolarHBondContact O-CG 3.4Å; E201-R205 PolarHBondContact O-N 3.07Å; E201-R205 IonicContact OE2-NH2 3.41Å |
| 202 | E | 97.1 | Very high | 96.6 | Very high | 88 Ų | 88 | 105.6 Ų | 105.6 | 41% | 0.411 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.4 | -37.3 | 176.8 | -74.6 | 179.6 | -167.7 | 0 | 0 | 111.9 | K198 I199 K206 | K198-E202 WeakPolarHBondContact O-CB 3.33Å; K198-E202 WeakPolarHBondContact O-CG 3.41Å; K198-E202 PolarHBondContact O-N 3.25Å; I199-E202 PolarHBondContact O-N 3.32Å; E202-K206 VanDerWaalsContact O-CG 3.31Å; E202-K206 WeakPolarHBondContact O-CG 3.32Å; E202-K206 PolarHBondContact O-N 2.82Å |
| 203 | N | 97.3 | Very high | 96.6 | Very high | 83 Ų | 83 | 106.6 Ų | 106.6 | 44% | 0.444 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.6 | -47 | 175.2 | -165 | -84 | 0 | 0 | 0 | 111.5 | I199 L200 E201 R205 K206 I207 | I199-N203 WeakPolarHBondContact O-CB 3.36Å; I199-N203 PolarHBondContact O-N 3.35Å; L200-N203 PolarHBondContact O-N 2.87Å; E201-N203 VanDerWaalsContact C-N 3.29Å; E201-N203 PolarHBondContact O-N 3.47Å; N203-R205 VanDerWaalsContact C-N 3.32Å; N203-R205 PolarHBondContact O-N 2.92Å; N203-K206 WeakPolarHBondContact O-CB 3.22Å; N203-K206 PolarHBondContact O-N 3.08Å; N203-K206 VanDerWaalsContact O-N 3.15Å; N203-I207 WeakPolarHBondContact O-CG1 3.33Å; N203-I207 PolarHBondContact O-N 3.47Å; N203-I207 VanDerWaalsContact OD1-CD1 3.28Å; N203-I207 WeakPolarHBondContact OD1-CD1 3.35Å |
| 204 | N | 96.1 | Very high | 96.5 | Very high | 101 Ų | 101 | 103.6 Ų | 103.6 | 54% | 0.54 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.8 | -40.4 | 176.6 | -74.3 | -25.3 | 0 | 0 | 0 | 111.7 | L200 E201 I207 A208 | L200-N204 WeakPolarHBondContact O-CB 3.26Å; L200-N204 VanDerWaalsContact O-CG 3.23Å; L200-N204 PolarHBondContact O-N 3.43Å; L200-N204 PolarHBondContact O-ND2 3.45Å; E201-N204 PolarHBondContact O-N 3.44Å; N204-I207 PolarHBondContact O-N 2.9Å; N204-A208 WeakPolarHBondContact O-CB 3.42Å; N204-A208 PolarHBondContact O-N 3.46Å |
| 205 | R | 97.3 | Very high | 96.5 | Very high | 158 Ų | 158 | 99.6 Ų | 99.6 | 60% | 0.596 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.4 | -46.3 | 173.1 | -75.1 | 178.9 | -168.5 | -173.3 | 7.5 | 111.5 | E201 N203 I207 A208 E209 | E201-R205 WeakPolarHBondContact O-CB 3.22Å; E201-R205 VanDerWaalsContact O-CG 3.31Å; E201-R205 WeakPolarHBondContact O-CG 3.4Å; E201-R205 PolarHBondContact O-N 3.07Å; E201-R205 IonicContact OE2-NH2 3.41Å; N203-R205 VanDerWaalsContact C-N 3.32Å; N203-R205 PolarHBondContact O-N 2.92Å; R205-I207 VanDerWaalsContact C-N 3.32Å; R205-I207 PolarHBondContact O-N 3.24Å; R205-A208 PolarHBondContact O-N 3.29Å; R205-E209 WeakPolarHBondContact O-CB 3.36Å; R205-E209 WeakPolarHBondContact O-CG 3.43Å; R205-E209 PolarHBondContact O-N 2.78Å |
| 206 | K | 97.5 | Very high | 96.4 | Very high | 135 Ų | 135 | 98.2 Ų | 98.2 | 59% | 0.587 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.5 | -39.6 | 176.7 | -72.7 | 171.1 | -173.5 | 173.3 | 0 | 112.3 | E202 N203 A210 | E202-K206 VanDerWaalsContact O-CG 3.31Å; E202-K206 WeakPolarHBondContact O-CG 3.32Å; E202-K206 PolarHBondContact O-N 2.82Å; N203-K206 WeakPolarHBondContact O-CB 3.22Å; N203-K206 PolarHBondContact O-N 3.08Å; N203-K206 VanDerWaalsContact O-N 3.15Å; K206-A210 VanDerWaalsContact O-CB 3.3Å; K206-A210 WeakPolarHBondContact O-CB 3.25Å; K206-A210 PolarHBondContact O-N 2.97Å |
| 207 | I | 96.6 | Very high | 96.3 | Very high | 77 Ų | 77 | 98.6 Ų | 98.6 | 40% | 0.395 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.7 | -47.3 | 175.3 | -67.7 | 169.2 | 0 | 0 | 0 | 110.3 | N203 N204 R205 E209 A210 Q211 | N203-I207 WeakPolarHBondContact O-CG1 3.33Å; N203-I207 PolarHBondContact O-N 3.47Å; N203-I207 VanDerWaalsContact OD1-CD1 3.28Å; N203-I207 WeakPolarHBondContact OD1-CD1 3.35Å; N204-I207 PolarHBondContact O-N 2.9Å; R205-I207 VanDerWaalsContact C-N 3.32Å; R205-I207 PolarHBondContact O-N 3.24Å; I207-E209 PolarHBondContact O-N 3.46Å; I207-A210 PolarHBondContact O-N 3.28Å; I207-Q211 HydrophobicContact CG2-CG 4.42Å; I207-Q211 WeakPolarHBondContact O-CB 3.44Å; I207-Q211 WeakPolarHBondContact O-CG 3.28Å; I207-Q211 PolarHBondContact O-N 2.86Å |
| 208 | A | 96.1 | Very high | 96.2 | Very high | 54 Ų | 54 | 99.6 Ų | 99.6 | 45% | 0.446 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62 | -43.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | N204 R205 Q211 A212 | N204-A208 WeakPolarHBondContact O-CB 3.42Å; N204-A208 PolarHBondContact O-N 3.46Å; R205-A208 PolarHBondContact O-N 3.29Å; A208-Q211 PolarHBondContact O-N 3.29Å; A208-A212 VanDerWaalsContact O-CB 3.31Å; A208-A212 WeakPolarHBondContact O-CB 3.36Å; A208-A212 PolarHBondContact O-N 3.3Å |
| 209 | E | 96.5 | Very high | 96.1 | Very high | 113 Ų | 113 | 98.7 Ų | 98.7 | 53% | 0.528 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.9 | -41.8 | 174.8 | -75.6 | 176.7 | -166.3 | 0 | 0 | 112.1 | R205 I207 A212 K213 | R205-E209 WeakPolarHBondContact O-CB 3.36Å; R205-E209 WeakPolarHBondContact O-CG 3.43Å; R205-E209 PolarHBondContact O-N 2.78Å; I207-E209 PolarHBondContact O-N 3.46Å; E209-A212 PolarHBondContact O-N 2.89Å; E209-K213 WeakPolarHBondContact O-CG 3.15Å; E209-K213 PolarHBondContact O-N 3.45Å |
| 210 | A | 96.4 | Very high | 96 | Very high | 50 Ų | 50 | 100.8 Ų | 100.8 | 41% | 0.413 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.4 | -43.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | K206 I207 K213 L214 | K206-A210 VanDerWaalsContact O-CB 3.3Å; K206-A210 WeakPolarHBondContact O-CB 3.25Å; K206-A210 PolarHBondContact O-N 2.97Å; I207-A210 PolarHBondContact O-N 3.28Å; A210-K213 PolarHBondContact O-N 3Å; A210-L214 WeakPolarHBondContact O-CG 3.34Å; A210-L214 PolarHBondContact O-N 2.91Å |
| 211 | Q | 95.1 | Very high | 95.9 | Very high | 126 Ų | 126 | 100 Ų | 100 | 59% | 0.589 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.9 | -41.2 | 174.9 | -73 | 177.4 | -6.1 | 0 | 0 | 111.9 | I207 A208 L214 A215 | I207-Q211 HydrophobicContact CG2-CG 4.42Å; I207-Q211 WeakPolarHBondContact O-CB 3.44Å; I207-Q211 WeakPolarHBondContact O-CG 3.28Å; I207-Q211 PolarHBondContact O-N 2.86Å; A208-Q211 PolarHBondContact O-N 3.29Å; Q211-L214 PolarHBondContact O-N 2.91Å; Q211-A215 WeakPolarHBondContact O-CB 3.3Å; Q211-A215 PolarHBondContact O-N 2.86Å |
| 212 | A | 96.8 | Very high | 95.8 | Very high | 59 Ų | 59 | 100 Ų | 100 | 49% | 0.488 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.1 | -42.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A208 E209 A215 E216 | A208-A212 VanDerWaalsContact O-CB 3.31Å; A208-A212 WeakPolarHBondContact O-CB 3.36Å; A208-A212 PolarHBondContact O-N 3.3Å; E209-A212 PolarHBondContact O-N 2.89Å; A212-A215 PolarHBondContact O-N 3.43Å; A212-E216 WeakPolarHBondContact O-CB 3.3Å; A212-E216 PolarHBondContact O-N 2.84Å |
| 213 | K | 97.1 | Very high | 95.6 | Very high | 129 Ų | 129 | 101.2 Ų | 101.2 | 56% | 0.561 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.4 | -44.7 | 174.8 | -75.7 | 177.5 | -179 | 177 | 0 | 112.3 | E209 A210 A215 E216 E217 | E209-K213 WeakPolarHBondContact O-CG 3.15Å; E209-K213 PolarHBondContact O-N 3.45Å; A210-K213 PolarHBondContact O-N 3Å; K213-A215 VanDerWaalsContact C-N 3.32Å; K213-A215 PolarHBondContact O-N 2.89Å; K213-E216 PolarHBondContact O-N 2.81Å; K213-E217 WeakPolarHBondContact O-CG 3.44Å; K213-E217 PolarHBondContact O-N 3.36Å |
| 214 | L | 94.8 | Very high | 95.4 | Very high | 101 Ų | 101 | 103 Ų | 103 | 53% | 0.529 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.7 | -41.3 | 176 | -72.4 | 171.6 | 0 | 0 | 0 | 111.7 | A210 Q211 E217 Q218 | A210-L214 WeakPolarHBondContact O-CG 3.34Å; A210-L214 PolarHBondContact O-N 2.91Å; Q211-L214 PolarHBondContact O-N 2.91Å; L214-E217 PolarHBondContact O-N 3.18Å; L214-Q218 WeakPolarHBondContact O-CB 3.32Å; L214-Q218 VanDerWaalsContact O-CG 3.28Å; L214-Q218 WeakPolarHBondContact O-CG 3.33Å; L214-Q218 PolarHBondContact O-N 2.99Å |
| 215 | A | 95.4 | Very high | 95.2 | Very high | 44 Ų | 44 | 104.1 Ų | 104.1 | 36% | 0.364 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.3 | -40.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | Q211 A212 K213 Q218 L219 | Q211-A215 WeakPolarHBondContact O-CB 3.3Å; Q211-A215 PolarHBondContact O-N 2.86Å; A212-A215 PolarHBondContact O-N 3.43Å; K213-A215 VanDerWaalsContact C-N 3.32Å; K213-A215 PolarHBondContact O-N 2.89Å; A215-Q218 PolarHBondContact O-N 3.48Å; A215-L219 WeakPolarHBondContact O-CG 3.29Å; A215-L219 PolarHBondContact O-N 3.45Å |
| 216 | E | 94.6 | Very high | 95.1 | Very high | 93 Ų | 93 | 104.6 Ų | 104.6 | 44% | 0.435 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.6 | -43.8 | 175.6 | -168.5 | -173.6 | 167.1 | 0 | 0 | 111.7 | A212 K213 L219 R220 | A212-E216 WeakPolarHBondContact O-CB 3.3Å; A212-E216 PolarHBondContact O-N 2.84Å; K213-E216 PolarHBondContact O-N 2.81Å; E216-L219 PolarHBondContact O-N 3.44Å; E216-R220 WeakPolarHBondContact O-CG 3.17Å; E216-R220 PolarHBondContact O-N 3.04Å; E216-R220 IonicContact OE1-CZ 3.76Å; E216-R220 IonicContact OE1-NE 2.97Å; E216-R220 PolarHBondContact OE1-NE 3.25Å; E216-R220 IonicContact OE1-NH2 3.7Å; E216-R220 PolarHBondContact OE1-NH2 2.91Å |
| 217 | E | 94.7 | Very high | 94.9 | Very high | 114 Ų | 114 | 104.4 Ų | 104.4 | 53% | 0.533 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 175 | -74.5 | 177.2 | 179.8 | 0 | 0 | 111.9 | K213 L214 L219 R220 I221 | K213-E217 WeakPolarHBondContact O-CG 3.44Å; K213-E217 PolarHBondContact O-N 3.36Å; L214-E217 PolarHBondContact O-N 3.18Å; E217-L219 VanDerWaalsContact C-N 3.34Å; E217-L219 PolarHBondContact O-N 3.38Å; E217-R220 PolarHBondContact O-N 3.41Å; E217-I221 WeakPolarHBondContact O-CG1 3.35Å; E217-I221 PolarHBondContact O-N 2.98Å |
| 218 | Q | 94.4 | Very high | 94.8 | Very high | 134 Ų | 134 | 104.2 Ų | 104.2 | 63% | 0.626 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60.2 | -43.8 | 174.6 | -74.6 | 177.8 | 2.5 | 0 | 0 | 111.9 | L214 A215 I221 V222 | L214-Q218 WeakPolarHBondContact O-CB 3.32Å; L214-Q218 VanDerWaalsContact O-CG 3.28Å; L214-Q218 WeakPolarHBondContact O-CG 3.33Å; L214-Q218 PolarHBondContact O-N 2.99Å; A215-Q218 PolarHBondContact O-N 3.48Å; Q218-I221 PolarHBondContact O-N 3.35Å; Q218-V222 WeakPolarHBondContact O-CG2 3.48Å; Q218-V222 PolarHBondContact O-N 3.19Å; Q218-V222 VanDerWaalsContact O-N 3.1Å |
| 219 | L | 94.9 | Very high | 94.6 | Very high | 111 Ų | 111 | 107.2 Ų | 107.2 | 58% | 0.581 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.2 | -44 | 175.6 | -75.5 | 169.1 | 0 | 0 | 0 | 111.7 | A215 E216 E217 I221 V222 E223 | A215-L219 WeakPolarHBondContact O-CG 3.29Å; A215-L219 PolarHBondContact O-N 3.45Å; E216-L219 PolarHBondContact O-N 3.44Å; E217-L219 VanDerWaalsContact C-N 3.34Å; E217-L219 PolarHBondContact O-N 3.38Å; L219-I221 VanDerWaalsContact C-N 3.34Å; L219-I221 PolarHBondContact O-N 2.88Å; L219-V222 PolarHBondContact O-N 3.45Å; L219-E223 WeakPolarHBondContact O-CG 3.34Å; L219-E223 PolarHBondContact O-N 2.83Å |
| 220 | R | 94.4 | Very high | 94.4 | Very high | 148 Ų | 148 | 106.8 Ų | 106.8 | 56% | 0.558 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -59.4 | -42.3 | 176.3 | -73.8 | 178.1 | -174 | -169.1 | 3.4 | 112.3 | E216 E217 V222 E223 E224 | E216-R220 WeakPolarHBondContact O-CG 3.17Å; E216-R220 PolarHBondContact O-N 3.04Å; E216-R220 IonicContact OE1-CZ 3.76Å; E216-R220 IonicContact OE1-NE 2.97Å; E216-R220 PolarHBondContact OE1-NE 3.25Å; E216-R220 IonicContact OE1-NH2 3.7Å; E216-R220 PolarHBondContact OE1-NH2 2.91Å; E217-R220 PolarHBondContact O-N 3.41Å; R220-V222 VanDerWaalsContact C-N 3.34Å; R220-V222 PolarHBondContact O-N 2.78Å; R220-E223 PolarHBondContact O-N 3.24Å; R220-E224 WeakPolarHBondContact O-CB 3.25Å; R220-E224 PolarHBondContact O-N 3.08Å |
| 221 | I | 93.8 | Very high | 94.2 | Very high | 92 Ų | 92 | 110.9 Ų | 110.9 | 47% | 0.472 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.7 | -43.8 | 176.3 | -68.6 | 165.8 | 0 | 0 | 0 | 110.6 | E217 Q218 L219 E224 Q225 | E217-I221 WeakPolarHBondContact O-CG1 3.35Å; E217-I221 PolarHBondContact O-N 2.98Å; Q218-I221 PolarHBondContact O-N 3.35Å; L219-I221 VanDerWaalsContact C-N 3.34Å; L219-I221 PolarHBondContact O-N 2.88Å; I221-E224 PolarHBondContact O-N 3.15Å; I221-Q225 WeakPolarHBondContact O-CB 3.39Å; I221-Q225 VanDerWaalsContact O-CG 3.31Å; I221-Q225 WeakPolarHBondContact O-CG 3.28Å; I221-Q225 PolarHBondContact O-N 3.5Å |
| 222 | V | 94.6 | Very high | 94.1 | Very high | 90 Ų | 90 | 113.5 Ų | 113.5 | 55% | 0.545 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.9 | -41.8 | 178.4 | 172.9 | 0 | 0 | 0 | 0 | 111.3 | Q218 L219 R220 Q225 R226 | Q218-V222 WeakPolarHBondContact O-CG2 3.48Å; Q218-V222 PolarHBondContact O-N 3.19Å; Q218-V222 VanDerWaalsContact O-N 3.1Å; L219-V222 PolarHBondContact O-N 3.45Å; R220-V222 VanDerWaalsContact C-N 3.34Å; R220-V222 PolarHBondContact O-N 2.78Å; V222-Q225 PolarHBondContact O-N 3.25Å; V222-R226 WeakPolarHBondContact O-CB 3.45Å; V222-R226 PolarHBondContact O-N 2.94Å |
| 223 | E | 93.1 | Very high | 93.7 | Very high | 114 Ų | 114 | 114.5 Ų | 114.5 | 53% | 0.533 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.3 | -40.6 | 174.8 | -73.8 | -177.7 | 174.9 | 0 | 0 | 112.3 | L219 R220 R226 K227 | L219-E223 WeakPolarHBondContact O-CG 3.34Å; L219-E223 PolarHBondContact O-N 2.83Å; R220-E223 PolarHBondContact O-N 3.24Å; E223-R226 WeakPolarHBondContact O-CB 3.34Å; E223-R226 PolarHBondContact O-N 2.83Å; E223-K227 WeakPolarHBondContact O-CG 3.48Å; E223-K227 PolarHBondContact O-N 3.36Å |
| 224 | E | 93.5 | Very high | 93.5 | Very high | 120 Ų | 120 | 114.9 Ų | 114.9 | 56% | 0.561 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -66.3 | -44 | 176.1 | -170.1 | 177.2 | 176.1 | 0 | 0 | 111.3 | R220 I221 R226 K227 I228 | R220-E224 WeakPolarHBondContact O-CB 3.25Å; R220-E224 PolarHBondContact O-N 3.08Å; I221-E224 PolarHBondContact O-N 3.15Å; E224-R226 VanDerWaalsContact C-N 3.27Å; E224-R226 PolarHBondContact O-N 3.34Å; E224-K227 PolarHBondContact O-N 3.47Å; E224-K227 VanDerWaalsContact O-N 3.15Å; E224-I228 HydrophobicContact CG-CD1 4.17Å; E224-I228 WeakPolarHBondContact O-CG1 3.49Å; E224-I228 PolarHBondContact O-N 2.97Å |
| 225 | Q | 91.9 | Very high | 93.3 | Very high | 124 Ų | 124 | 116.1 Ų | 116.1 | 58% | 0.579 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -58.9 | -40.1 | 172.7 | -75.7 | -177 | -3.2 | 0 | 0 | 111.9 | I221 V222 I228 H229 | I221-Q225 WeakPolarHBondContact O-CB 3.39Å; I221-Q225 VanDerWaalsContact O-CG 3.31Å; I221-Q225 WeakPolarHBondContact O-CG 3.28Å; I221-Q225 PolarHBondContact O-N 3.5Å; V222-Q225 PolarHBondContact O-N 3.25Å; Q225-I228 PolarHBondContact O-N 3.47Å; Q225-H229 WeakPolarHBondContact O-CB 3.26Å; Q225-H229 PolarHBondContact O-N 3.23Å |
| 226 | R | 94.3 | Very high | 93 | Very high | 169 Ų | 169 | 119.1 Ų | 119.1 | 64% | 0.638 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -63.2 | -44.4 | 174.6 | -175.9 | -178.6 | 170.8 | 172.5 | 4.2 | 111.5 | V222 E223 E224 H229 E230 | V222-R226 WeakPolarHBondContact O-CB 3.45Å; V222-R226 PolarHBondContact O-N 2.94Å; E223-R226 WeakPolarHBondContact O-CB 3.34Å; E223-R226 PolarHBondContact O-N 2.83Å; E224-R226 VanDerWaalsContact C-N 3.27Å; E224-R226 PolarHBondContact O-N 3.34Å; R226-H229 PolarHBondContact O-N 3.24Å; R226-E230 IonicContact CZ-OE1 3.7Å; R226-E230 IonicContact NE-OE1 3.34Å; R226-E230 PolarHBondContact NE-OE1 3.48Å; R226-E230 IonicContact NH2-OE1 3.69Å; R226-E230 WeakPolarHBondContact O-CG 3.27Å; R226-E230 PolarHBondContact O-N 3.49Å |
| 227 | K | 95.2 | Very high | 92.8 | Very high | 131 Ų | 131 | 119.2 Ų | 119.2 | 57% | 0.57 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -61.5 | -46.8 | 175.5 | -75.5 | 175.7 | -177.4 | 171.8 | 0 | 112.1 | E223 E224 H229 E230 E231 | E223-K227 WeakPolarHBondContact O-CG 3.48Å; E223-K227 PolarHBondContact O-N 3.36Å; E224-K227 PolarHBondContact O-N 3.47Å; E224-K227 VanDerWaalsContact O-N 3.15Å; K227-H229 VanDerWaalsContact C-N 3.26Å; K227-H229 PolarHBondContact O-N 3.2Å; K227-E230 PolarHBondContact O-N 3.36Å; K227-E231 WeakPolarHBondContact O-CB 3.44Å; K227-E231 WeakPolarHBondContact O-CG 3.28Å; K227-E231 PolarHBondContact O-N 2.84Å |
| 228 | I | 93.1 | Very high | 92.5 | Very high | 72 Ų | 72 | 116.7 Ų | 116.7 | 37% | 0.369 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -59.3 | -40.9 | 176.5 | -67.9 | 167 | 0 | 0 | 0 | 110.4 | E224 Q225 E231 R232 | E224-I228 HydrophobicContact CG-CD1 4.17Å; E224-I228 WeakPolarHBondContact O-CG1 3.49Å; E224-I228 PolarHBondContact O-N 2.97Å; Q225-I228 PolarHBondContact O-N 3.47Å; I228-E231 PolarHBondContact O-N 3.49Å; I228-R232 HydrophobicContact CG2-CG 4.49Å; I228-R232 WeakPolarHBondContact O-CB 3.5Å; I228-R232 VanDerWaalsContact O-CG 3.3Å; I228-R232 WeakPolarHBondContact O-CG 3.14Å; I228-R232 PolarHBondContact O-N 3.22Å |
| 229 | H | 92.2 | Very high | 92.3 | Very high | 117 Ų | 117 | 118.2 Ų | 118.2 | 54% | 0.542 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -66.2 | -44.6 | 176.8 | -171 | -76.1 | 0 | 0 | 0 | 111.9 | Q225 R226 K227 E231 R232 M233 | Q225-H229 WeakPolarHBondContact O-CB 3.26Å; Q225-H229 PolarHBondContact O-N 3.23Å; R226-H229 PolarHBondContact O-N 3.24Å; K227-H229 VanDerWaalsContact C-N 3.26Å; K227-H229 PolarHBondContact O-N 3.2Å; H229-E231 VanDerWaalsContact C-N 3.34Å; H229-E231 PolarHBondContact O-N 2.89Å; H229-R232 PolarHBondContact O-N 2.96Å; H229-M233 VanDerWaalsContact O-CG 3.32Å; H229-M233 WeakPolarHBondContact O-CG 3.31Å; H229-M233 PolarHBondContact O-N 3.28Å |
| 230 | E | 92.9 | Very high | 91.9 | Very high | 105 Ų | 105 | 117.1 Ų | 117.1 | 49% | 0.491 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.1 | -42.8 | 175 | -74.3 | 174.4 | -170.1 | 0 | 0 | 111.6 | R226 K227 M233 K234 | R226-E230 IonicContact CZ-OE1 3.7Å; R226-E230 IonicContact NE-OE1 3.34Å; R226-E230 PolarHBondContact NE-OE1 3.48Å; R226-E230 IonicContact NH2-OE1 3.69Å; R226-E230 WeakPolarHBondContact O-CG 3.27Å; R226-E230 PolarHBondContact O-N 3.49Å; K227-E230 PolarHBondContact O-N 3.36Å; E230-M233 PolarHBondContact O-N 2.93Å; E230-K234 WeakPolarHBondContact O-CB 3.39Å; E230-K234 PolarHBondContact O-N 2.88Å |
| 231 | E | 92.4 | Very high | 91.6 | Very high | 136 Ų | 136 | 116.9 Ų | 116.9 | 64% | 0.636 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.8 | -42.8 | 175 | -74.4 | -179 | 177.7 | 0 | 0 | 112.5 | K227 I228 H229 K234 L235 | K227-E231 WeakPolarHBondContact O-CB 3.44Å; K227-E231 WeakPolarHBondContact O-CG 3.28Å; K227-E231 PolarHBondContact O-N 2.84Å; I228-E231 PolarHBondContact O-N 3.49Å; H229-E231 VanDerWaalsContact C-N 3.34Å; H229-E231 PolarHBondContact O-N 2.89Å; E231-K234 PolarHBondContact O-N 2.91Å; E231-L235 WeakPolarHBondContact O-CB 3.39Å; E231-L235 PolarHBondContact O-N 2.87Å |
| 232 | R | 91.6 | Very high | 91.3 | Very high | 181 Ų | 181 | 117.9 Ų | 117.9 | 68% | 0.683 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -60.4 | -46.2 | 174.9 | -79.8 | -178.3 | 179 | -173.6 | 1.7 | 111.8 | I228 H229 K234 L235 E236 | I228-R232 HydrophobicContact CG2-CG 4.49Å; I228-R232 WeakPolarHBondContact O-CB 3.5Å; I228-R232 VanDerWaalsContact O-CG 3.3Å; I228-R232 WeakPolarHBondContact O-CG 3.14Å; I228-R232 PolarHBondContact O-N 3.22Å; H229-R232 PolarHBondContact O-N 2.96Å; R232-K234 VanDerWaalsContact C-N 3.29Å; R232-K234 PolarHBondContact O-N 3.41Å; R232-L235 PolarHBondContact O-N 3.37Å; R232-E236 WeakPolarHBondContact O-CB 3.26Å; R232-E236 PolarHBondContact O-N 2.84Å |
| 233 | M | 89.2 | Confident | 90.9 | Very high | 80 Ų | 80 | 117.8 Ų | 117.8 | 39% | 0.394 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62 | -39.2 | 177.1 | -71 | -58 | -60.4 | 0 | 0 | 111.6 | H229 E230 E236 Q237 | H229-M233 VanDerWaalsContact O-CG 3.32Å; H229-M233 WeakPolarHBondContact O-CG 3.31Å; H229-M233 PolarHBondContact O-N 3.28Å; E230-M233 PolarHBondContact O-N 2.93Å; M233-E236 PolarHBondContact O-N 2.71Å; M233-Q237 WeakPolarHBondContact O-CB 3.29Å; M233-Q237 VanDerWaalsContact O-CG 3.27Å; M233-Q237 WeakPolarHBondContact O-CG 3.27Å; M233-Q237 PolarHBondContact O-N 2.77Å |
| 234 | K | 93.7 | Very high | 90.6 | Very high | 137 Ų | 137 | 118.2 Ų | 118.2 | 60% | 0.596 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.5 | -45.8 | 176.5 | -167.6 | 177.4 | -180 | -176.5 | 0 | 111.7 | E230 E231 R232 E236 Q237 D238 | E230-K234 WeakPolarHBondContact O-CB 3.39Å; E230-K234 PolarHBondContact O-N 2.88Å; E231-K234 PolarHBondContact O-N 2.91Å; R232-K234 VanDerWaalsContact C-N 3.29Å; R232-K234 PolarHBondContact O-N 3.41Å; K234-E236 VanDerWaalsContact C-N 3.3Å; K234-E236 PolarHBondContact O-N 3.38Å; K234-Q237 PolarHBondContact O-N 3.26Å; K234-D238 WeakPolarHBondContact O-CB 3.32Å; K234-D238 PolarHBondContact O-N 3.44Å |
| 235 | L | 88.6 | Confident | 90.1 | Very high | 127 Ų | 127 | 118.1 Ų | 118.1 | 67% | 0.665 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -61.6 | -39.7 | 176.6 | -158.1 | 97.7 | 0 | 0 | 0 | 111.5 | E231 R232 D238 R239 | E231-L235 WeakPolarHBondContact O-CB 3.39Å; E231-L235 PolarHBondContact O-N 2.87Å; R232-L235 PolarHBondContact O-N 3.37Å; L235-D238 PolarHBondContact O-N 3.33Å; L235-R239 VanDerWaalsContact O-CB 3.28Å; L235-R239 WeakPolarHBondContact O-CB 3.12Å; L235-R239 PolarHBondContact O-N 3.29Å |
| 236 | E | 89.1 | Confident | 89.7 | Confident | 107 Ų | 107 | 117.6 Ų | 117.6 | 50% | 0.5 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67 | -43.1 | 176.3 | -171.2 | 173.1 | -171.8 | 0 | 0 | 111.8 | R232 M233 K234 R239 Q240 | R232-E236 WeakPolarHBondContact O-CB 3.26Å; R232-E236 PolarHBondContact O-N 2.84Å; M233-E236 PolarHBondContact O-N 2.71Å; K234-E236 VanDerWaalsContact C-N 3.3Å; K234-E236 PolarHBondContact O-N 3.38Å; E236-R239 PolarHBondContact O-N 2.81Å; E236-Q240 WeakPolarHBondContact O-CG 3.16Å; E236-Q240 PolarHBondContact O-N 2.68Å |
| 237 | Q | 90.4 | Very high | 88.9 | Confident | 95 Ų | 95 | 115.6 Ų | 115.6 | 44% | 0.444 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.8 | -43.7 | 173 | -75.9 | 179.1 | 17.6 | 0 | 0 | 112 | M233 K234 Q240 R241 | M233-Q237 WeakPolarHBondContact O-CB 3.29Å; M233-Q237 VanDerWaalsContact O-CG 3.27Å; M233-Q237 WeakPolarHBondContact O-CG 3.27Å; M233-Q237 PolarHBondContact O-N 2.77Å; K234-Q237 PolarHBondContact O-N 3.26Å; Q237-Q240 PolarHBondContact O-N 2.73Å; Q237-R241 VanDerWaalsContact O-CG 3.29Å; Q237-R241 WeakPolarHBondContact O-CG 3.17Å; Q237-R241 PolarHBondContact O-N 3.37Å |
| 238 | D | 89.7 | Confident | 88.1 | Confident | 61 Ų | 61 | 115.3 Ų | 115.3 | 33% | 0.326 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.9 | -39.5 | 178.3 | -73 | -21.8 | 0 | 0 | 0 | 111.2 | K234 L235 R241 Q242 | K234-D238 WeakPolarHBondContact O-CB 3.32Å; K234-D238 PolarHBondContact O-N 3.44Å; L235-D238 PolarHBondContact O-N 3.33Å; D238-R241 WeakPolarHBondContact O-CB 3.3Å; D238-R241 PolarHBondContact O-N 3.49Å; D238-R241 IonicContact OD1-NH1 3.55Å; D238-Q242 WeakPolarHBondContact O-CG 3.47Å; D238-Q242 PolarHBondContact O-N 2.78Å |
| 239 | R | 88.8 | Confident | 87.3 | Confident | 165 Ų | 165 | 117.2 Ų | 117.2 | 62% | 0.623 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -65.6 | -39 | 174.6 | -163.5 | 178.9 | 164.9 | 178.1 | -5.4 | 112.2 | L235 E236 Q242 Q243 | L235-R239 VanDerWaalsContact O-CB 3.28Å; L235-R239 WeakPolarHBondContact O-CB 3.12Å; L235-R239 PolarHBondContact O-N 3.29Å; E236-R239 PolarHBondContact O-N 2.81Å; R239-Q242 PolarHBondContact O-N 3.45Å; R239-Q243 WeakPolarHBondContact O-CG 3.21Å; R239-Q243 PolarHBondContact O-N 2.81Å |
| 240 | Q | 87.8 | Confident | 86.4 | Confident | 89 Ų | 89 | 118.6 Ų | 118.6 | 42% | 0.416 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.9 | -36.9 | 172.1 | -73.6 | -177.3 | 13.4 | 0 | 0 | 112.2 | E236 Q237 K244 | E236-Q240 WeakPolarHBondContact O-CG 3.16Å; E236-Q240 PolarHBondContact O-N 2.68Å; Q237-Q240 PolarHBondContact O-N 2.73Å; Q240-K244 WeakPolarHBondContact O-CB 3.23Å; Q240-K244 VanDerWaalsContact O-CG 3.27Å; Q240-K244 WeakPolarHBondContact O-CG 3.2Å; Q240-K244 PolarHBondContact O-N 2.83Å |
| 241 | R | 88.8 | Confident | 85.3 | Confident | 143 Ų | 143 | 119.1 Ų | 119.1 | 54% | 0.54 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.2 | -47.4 | 174.5 | -74.3 | 170.4 | -178.9 | -178.2 | -1.4 | 110.7 | Q237 D238 Q243 K244 E245 | Q237-R241 VanDerWaalsContact O-CG 3.29Å; Q237-R241 WeakPolarHBondContact O-CG 3.17Å; Q237-R241 PolarHBondContact O-N 3.37Å; D238-R241 WeakPolarHBondContact O-CB 3.3Å; D238-R241 PolarHBondContact O-N 3.49Å; D238-R241 IonicContact OD1-NH1 3.55Å; R241-Q243 PolarHBondContact O-N 3.33Å; R241-K244 WeakPolarHBondContact O-CB 3.37Å; R241-K244 PolarHBondContact O-N 2.82Å; R241-K244 VanDerWaalsContact O-N 3.14Å; R241-E245 WeakPolarHBondContact O-CG 3.29Å; R241-E245 PolarHBondContact O-N 2.79Å |
| 242 | Q | 86.3 | Confident | 83.8 | Confident | 112 Ų | 112 | 114.4 Ų | 114.4 | 52% | 0.523 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -57.8 | -47.8 | 175 | -73.1 | 176.1 | -4.2 | 0 | 0 | 111.4 | D238 R239 K244 E245 E246 | D238-Q242 WeakPolarHBondContact O-CG 3.47Å; D238-Q242 PolarHBondContact O-N 2.78Å; R239-Q242 PolarHBondContact O-N 3.45Å; Q242-K244 VanDerWaalsContact C-N 3.31Å; Q242-K244 PolarHBondContact O-N 2.8Å; Q242-E245 CarbonylContact O-C 3.59Å; Q242-E245 PolarHBondContact O-N 2.8Å; Q242-E245 VanDerWaalsContact O-N 3.1Å; Q242-E246 WeakPolarHBondContact O-CB 3.39Å; Q242-E246 WeakPolarHBondContact O-CG 3.21Å; Q242-E246 PolarHBondContact O-N 3.4Å |
| 243 | Q | 86.2 | Confident | 82.6 | Confident | 89 Ų | 89 | 112.5 Ų | 112.5 | 42% | 0.416 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -59.1 | -40 | 175.5 | -75.1 | 178.4 | -9 | 0 | 0 | 112.7 | R239 R241 Q247 | R239-Q243 WeakPolarHBondContact O-CG 3.21Å; R239-Q243 PolarHBondContact O-N 2.81Å; R241-Q243 PolarHBondContact O-N 3.33Å; Q243-Q247 VanDerWaalsContact O-CB 3.28Å; Q243-Q247 WeakPolarHBondContact O-CB 3.31Å; Q243-Q247 WeakPolarHBondContact O-CG 3.29Å; Q243-Q247 PolarHBondContact O-N 3.46Å |
| 244 | K | 86.7 | Confident | 81.2 | Confident | 123 Ų | 123 | 111.8 Ų | 111.8 | 54% | 0.535 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -67.1 | -37.5 | 175.3 | -73.9 | 172.9 | -175.1 | 176.6 | 0 | 112 | Q240 R241 Q242 K248 | Q240-K244 WeakPolarHBondContact O-CB 3.23Å; Q240-K244 VanDerWaalsContact O-CG 3.27Å; Q240-K244 WeakPolarHBondContact O-CG 3.2Å; Q240-K244 PolarHBondContact O-N 2.83Å; R241-K244 WeakPolarHBondContact O-CB 3.37Å; R241-K244 PolarHBondContact O-N 2.82Å; R241-K244 VanDerWaalsContact O-N 3.14Å; Q242-K244 VanDerWaalsContact C-N 3.31Å; Q242-K244 PolarHBondContact O-N 2.8Å; K244-K248 WeakPolarHBondContact O-CB 3.32Å; K244-K248 VanDerWaalsContact O-CG 3.24Å; K244-K248 WeakPolarHBondContact O-CG 3.26Å; K244-K248 PolarHBondContact O-N 2.96Å |
| 245 | E | 83.7 | Confident | 79.9 | Confident | 118 Ų | 118 | 115.7 Ų | 115.7 | 55% | 0.551 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -69.6 | -46 | 176.3 | -73.9 | 177.7 | 176.9 | 0 | 0 | 111.7 | R241 Q242 Q247 K248 I249 | R241-E245 WeakPolarHBondContact O-CG 3.29Å; R241-E245 PolarHBondContact O-N 2.79Å; Q242-E245 CarbonylContact O-C 3.59Å; Q242-E245 PolarHBondContact O-N 2.8Å; Q242-E245 VanDerWaalsContact O-N 3.1Å; E245-Q247 PolarHBondContact O-N 3.4Å; E245-K248 CarbonylContact O-C 3.59Å; E245-K248 WeakPolarHBondContact O-CA 3.4Å; E245-K248 WeakPolarHBondContact O-CB 3.33Å; E245-K248 PolarHBondContact O-N 3.37Å; E245-K248 VanDerWaalsContact O-N 3.08Å; E245-I249 VanDerWaalsContact O-CG1 3.31Å; E245-I249 WeakPolarHBondContact O-CG1 3.35Å; E245-I249 PolarHBondContact O-N 3.48Å |
| 246 | E | 83.3 | Confident | 78.7 | Confident | 113 Ų | 113 | 111.8 Ų | 111.8 | 53% | 0.528 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -58 | -46.8 | 172.3 | -73.1 | 175.9 | 176.3 | 0 | 0 | 111.1 | Q242 K248 I249 I250 | Q242-E246 WeakPolarHBondContact O-CB 3.39Å; Q242-E246 WeakPolarHBondContact O-CG 3.21Å; Q242-E246 PolarHBondContact O-N 3.4Å; E246-K248 VanDerWaalsContact C-N 3.31Å; E246-K248 PolarHBondContact O-N 3.45Å; E246-I249 PolarHBondContact O-N 3.01Å; E246-I250 VanDerWaalsContact O-CG1 3.28Å; E246-I250 WeakPolarHBondContact O-CG1 3.19Å; E246-I250 PolarHBondContact O-N 3.29Å |
| 247 | Q | 77.8 | Confident | 77.5 | Confident | 127 Ų | 127 | 116.9 Ų | 116.9 | 59% | 0.593 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -59.7 | -40.1 | 173.2 | -77.7 | 178.8 | 22.6 | 0 | 0 | 111.9 | Q243 E245 I250 L251 | Q243-Q247 VanDerWaalsContact O-CB 3.28Å; Q243-Q247 WeakPolarHBondContact O-CB 3.31Å; Q243-Q247 WeakPolarHBondContact O-CG 3.29Å; Q243-Q247 PolarHBondContact O-N 3.46Å; E245-Q247 PolarHBondContact O-N 3.4Å; Q247-I250 PolarHBondContact O-N 3.19Å; Q247-L251 WeakPolarHBondContact O-CB 2.97Å; Q247-L251 PolarHBondContact O-N 3.15Å |
| 248 | K | 78.5 | Confident | 76.5 | Confident | 124 Ų | 124 | 117.4 Ų | 117.4 | 54% | 0.539 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -65.6 | -38.4 | 175.7 | -78.7 | 172.6 | -177.4 | -180 | 0 | 112.5 | K244 E245 E246 G252 K253 | K244-K248 WeakPolarHBondContact O-CB 3.32Å; K244-K248 VanDerWaalsContact O-CG 3.24Å; K244-K248 WeakPolarHBondContact O-CG 3.26Å; K244-K248 PolarHBondContact O-N 2.96Å; E245-K248 CarbonylContact O-C 3.59Å; E245-K248 WeakPolarHBondContact O-CA 3.4Å; E245-K248 WeakPolarHBondContact O-CB 3.33Å; E245-K248 PolarHBondContact O-N 3.37Å; E245-K248 VanDerWaalsContact O-N 3.08Å; E246-K248 VanDerWaalsContact C-N 3.31Å; E246-K248 PolarHBondContact O-N 3.45Å; K248-G252 PolarHBondContact O-N 3.23Å; K248-K253 PolarHBondContact O-N 3.34Å; K248-K253 VanDerWaalsContact O-N 3.16Å |
| 249 | I | 75.4 | Confident | 75.4 | Confident | 113 Ų | 113 | 124.4 Ų | 124.4 | 58% | 0.579 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -64 | -49.4 | 175.9 | -68.8 | 165 | 0 | 0 | 0 | 109.7 | E245 E246 G252 | E245-I249 VanDerWaalsContact O-CG1 3.31Å; E245-I249 WeakPolarHBondContact O-CG1 3.35Å; E245-I249 PolarHBondContact O-N 3.48Å; E246-I249 PolarHBondContact O-N 3.01Å; I249-G252 PolarHBondContact O-N 2.84Å |
| 250 | I | 72.8 | Confident | 74.1 | Confident | 145 Ų | 145 | 122.9 Ų | 122.9 | 74% | 0.744 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -64.2 | -42.6 | 178.9 | -65.9 | 165.9 | 0 | 0 | 0 | 111.4 | E246 Q247 G252 | E246-I250 VanDerWaalsContact O-CG1 3.28Å; E246-I250 WeakPolarHBondContact O-CG1 3.19Å; E246-I250 PolarHBondContact O-N 3.29Å; Q247-I250 PolarHBondContact O-N 3.19Å; I250-G252 PolarHBondContact O-N 3.26Å |
| 251 | L | 70.1 | Confident | 73.1 | Confident | 117 Ų | 117 | 124.2 Ų | 124.2 | 61% | 0.613 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | -1.8 | -180 | -150.4 | 77.7 | 0 | 0 | 0 | 112.9 | Q247 K253 | Q247-L251 WeakPolarHBondContact O-CB 2.97Å; Q247-L251 PolarHBondContact O-N 3.15Å; L251-K253 HydrophobicContact CD2-CD 3.8Å; L251-K253 VanDerWaalsContact CD2-CE 3.47Å; L251-K253 HydrophobicContact CD2-CG 4.25Å; L251-K253 PolarHBondContact O-N 3.36Å |
| 252 | G | 62 | Low | 71.8 | Confident | 36 Ų | 36 | 125.5 Ų | 125.5 | 37% | 0.371 | 63% | 0.629 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 64.6 | 17.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | K248 I249 I250 | K248-G252 PolarHBondContact O-N 3.23Å; I249-G252 PolarHBondContact O-N 2.84Å; I250-G252 PolarHBondContact O-N 3.26Å |
| 253 | K | 66.9 | Low | 70.6 | Confident | 142 Ų | 142 | 125.8 Ų | 125.8 | 62% | 0.617 | 64% | 0.643 | S | S | * | * | trans | -88.9 | 120.5 | -177.2 | -70.4 | -171.4 | -176.1 | 171.8 | 0 | 110.5 | K248 L251 | K248-K253 PolarHBondContact O-N 3.34Å; K248-K253 VanDerWaalsContact O-N 3.16Å; L251-K253 HydrophobicContact CD2-CD 3.8Å; L251-K253 VanDerWaalsContact CD2-CE 3.47Å; L251-K253 HydrophobicContact CD2-CG 4.25Å; L251-K253 PolarHBondContact O-N 3.36Å | ||
| 254 | G | 59.8 | Low | 69.4 | Low | 65 Ų | 65 | 129.8 Ų | 129.8 | 67% | 0.67 | 67% | 0.666 | S | S | * | * | S | Bend | trans | 86.7 | 82.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | S256 | G254-S256 PolarHBondContact O-N 3.46Š|
| 255 | K | 65.8 | Low | 68 | Low | 219 Ų | 219 | 133.5 Ų | 133.5 | 95% | 0.952 | 68% | 0.683 | S | S | * | * | S | Bend | trans | 44.9 | 11.1 | 170.2 | -55.9 | -176.6 | -175.3 | -178.3 | 0 | 117.6 | R257 | K255-R257 PolarHBondContact O-N 2.78Š|
| 256 | S | 62.8 | Low | 66.7 | Low | 45 Ų | 45 | 132.7 Ų | 132.7 | 32% | 0.315 | 70% | 0.696 | S | S | . | * | trans | -77.9 | -20.1 | -172.5 | 65.6 | 0 | 0 | 0 | 0 | 113.4 | G254 P258 | G254-S256 PolarHBondContact O-N 3.46Å; S256-P258 VanDerWaalsContact O-CD 3.23Å; S256-P258 WeakPolarHBondContact O-CD 2.91Å | ||
| 257 | R | 64.1 | Low | 65.2 | Low | 214 Ų | 214 | 132 Ų | 132 | 81% | 0.808 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -80 | 110.2 | 176.9 | -137.7 | 171.3 | 120 | 145.3 | 0.3 | 108.8 | K255 K259 | K255-R257 PolarHBondContact O-N 2.78Å; R257-K259 PolarHBondContact O-N 3.23Å |
| 258 | P | 68.8 | Low | 63.7 | Low | 106 Ų | 106 | 138.9 Ų | 138.9 | 69% | 0.688 | 74% | 0.742 | S | S | * | * | trans | -59.7 | 128.2 | 178 | 23.1 | -30.8 | 0 | 0 | 0 | 108.9 | S256 L260 | S256-P258 VanDerWaalsContact O-CD 3.23Å; S256-P258 WeakPolarHBondContact O-CD 2.91Å; P258-L260 VanDerWaalsContact C-N 3.34Å; P258-L260 PolarHBondContact O-N 3.45Å | ||
| 259 | K | 66.8 | Low | 63 | Low | 207 Ų | 207 | 139.7 Ų | 139.7 | 90% | 0.9 | 75% | 0.752 | S | S | * | * | trans | -67.6 | 96.2 | 174.6 | -73.4 | -169.3 | 177.2 | -175.9 | 0 | 107.9 | R257 S261 | R257-K259 PolarHBondContact O-N 3.23Å; K259-S261 PolarHBondContact O-N 3.4Å | ||
| 260 | L | 62.3 | Low | 62.3 | Low | 133 Ų | 133 | 141.1 Ų | 141.1 | 70% | 0.696 | 76% | 0.761 | S | S | * | * | trans | -64.6 | 105.3 | 167.7 | -74.8 | 160.7 | 0 | 0 | 0 | 107.6 | P258 F262 | P258-L260 VanDerWaalsContact C-N 3.34Å; P258-L260 PolarHBondContact O-N 3.45Å; L260-F262 HydrophobicContact CB-CD2 4.14Å; L260-F262 HydrophobicContact CB-CE2 3.58Å; L260-F262 HydrophobicContact CB-CZ 4.1Å; L260-F262 HydrophobicContact CD1-CE2 4.2Å; L260-F262 HydrophobicContact CD1-CZ 4.18Å; L260-F262 HydrophobicContact CD2-CZ 4.43Å; L260-F262 HydrophobicContact CG-CE2 4.38Å; L260-F262 HydrophobicContact CG-CZ 4.48Å | ||
| 261 | S | 66.9 | Low | 61.7 | Low | 117 Ų | 117 | 140.8 Ų | 140.8 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -86.9 | 103.4 | 167.7 | 39.8 | 0 | 0 | 0 | 0 | 107.3 | K259 | K259-S261 PolarHBondContact O-N 3.4Š| ||
| 262 | F | 61.8 | Low | 61.2 | Low | 170 Ų | 170 | 142.2 Ų | 142.2 | 75% | 0.746 | 77% | 0.771 | S | S | * | * | trans | -85.7 | 115.3 | 169.9 | -67.3 | -81.8 | 0 | 0 | 0 | 108.1 | L260 L264 | L260-F262 HydrophobicContact CB-CD2 4.14Å; L260-F262 HydrophobicContact CB-CE2 3.58Å; L260-F262 HydrophobicContact CB-CZ 4.1Å; L260-F262 HydrophobicContact CD1-CE2 4.2Å; L260-F262 HydrophobicContact CD1-CZ 4.18Å; L260-F262 HydrophobicContact CD2-CZ 4.43Å; L260-F262 HydrophobicContact CG-CE2 4.38Å; L260-F262 HydrophobicContact CG-CZ 4.48Å; F262-L264 PolarHBondContact O-N 3.26Å | ||
| 263 | S | 60.2 | Low | 61.2 | Low | 118 Ų | 118 | 148.9 Ų | 148.9 | 83% | 0.825 | 80% | 0.796 | S | S | * | * | trans | -79 | 113 | 164.4 | 44.5 | 0 | 0 | 0 | 0 | 108 | K265 | S263-K265 PolarHBondContact O-N 2.81Å; S263-K265 VanDerWaalsContact O-N 3.13Å | ||
| 264 | L | 61.9 | Low | 60.8 | Low | 173 Ų | 173 | 149.3 Ų | 149.3 | 91% | 0.906 | 81% | 0.808 | S | S | * | * | trans | -71.3 | 104.8 | 167.6 | -80.5 | 163.1 | 0 | 0 | 0 | 107.3 | F262 A266 | F262-L264 PolarHBondContact O-N 3.26Å; L264-A266 PolarHBondContact O-N 2.86Å; L264-A266 VanDerWaalsContact O-N 3.12Å | ||
| 265 | K | 56.8 | Low | 60.9 | Low | 201 Ų | 201 | 155.4 Ų | 155.4 | 87% | 0.874 | 82% | 0.818 | S | S | * | * | trans | -72.3 | 99.2 | 168.8 | -147 | 177.5 | -172.7 | -179.3 | 0 | 106.5 | S263 A267 | S263-K265 PolarHBondContact O-N 2.81Å; S263-K265 VanDerWaalsContact O-N 3.13Å; K265-A267 PolarHBondContact O-N 3.17Å | ||
| 266 | A | 56.1 | Low | 60.5 | Low | 102 Ų | 102 | 150.5 Ų | 150.5 | 84% | 0.843 | 81% | 0.808 | S | S | * | * | trans | -63.2 | 120.2 | 166.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | L264 | L264-A266 PolarHBondContact O-N 2.86Å; L264-A266 VanDerWaalsContact O-N 3.12Å | ||
| 267 | A | 50.9 | Low | 60.3 | Low | 98 Ų | 98 | 159.3 Ų | 159.3 | 81% | 0.81 | 85% | 0.849 | S | S | * | * | trans | -108.8 | 122 | 170.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | K265 | K265-A267 PolarHBondContact O-N 3.17Š| ||
| 268 | E | 47 | Very low | 59.9 | Low | 272 Ų | 272 | 154.3 Ų | 154.3 | 100% | 1.271 | 85% | 0.852 | S | S | * | * | trans | -57.4 | 0 | 166.4 | -72.7 | 173.1 | 138.7 | 0 | 0 | 112.5 |
Retrieved 268 of 268 residues in 40.9 ms
(Link to these results)