| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.3 | Very low | 37.8 | Very low | 244 Ų | 244 | 152.4 Ų | 152.4 | 100% | 1.202 | 87% | 0.869 | S | S | * | * | 0 | 127 | 0 | -67.7 | -158.3 | 84.5 | 0 | 0 | 109.4 | |||||
| 2 | S | 39.9 | Very low | 37.7 | Very low | 127 Ų | 127 | 156 Ų | 156 | 89% | 0.888 | 87% | 0.868 | S | S | * | * | trans | 157.9 | 107.7 | 142.2 | -169.8 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 3 | G | 35.9 | Very low | 37.5 | Very low | 69 Ų | 69 | 157.2 Ų | 157.2 | 71% | 0.711 | 86% | 0.863 | S | S | * | * | trans | -97.7 | 161.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 4 | K | 41.1 | Very low | 37.3 | Very low | 219 Ų | 219 | 156.1 Ų | 156.1 | 95% | 0.952 | 85% | 0.849 | S | S | * | * | trans | -164.3 | 128.3 | 143.6 | -114.5 | 166.6 | -177.5 | 175.1 | 0 | 113.2 | ||||
| 5 | A | 37.8 | Very low | 37.1 | Very low | 86 Ų | 86 | 157.6 Ų | 157.6 | 71% | 0.711 | 85% | 0.854 | S | S | * | * | trans | -30.7 | 139.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 6 | N | 38.1 | Very low | 37 | Very low | 165 Ų | 165 | 159.4 Ų | 159.4 | 88% | 0.882 | 85% | 0.852 | S | S | * | * | 35.4 | 127.2 | 125.1 | -60.9 | -21.8 | 0 | 0 | 0 | 121.8 | |||||
| 7 | A | 35.2 | Very low | 36.7 | Very low | 106 Ų | 106 | 164.1 Ų | 164.1 | 88% | 0.876 | 86% | 0.855 | S | S | * | * | trans | -153.5 | 120.6 | 135.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 8 | S | 40.2 | Very low | 36.8 | Very low | 115 Ų | 115 | 163.6 Ų | 163.6 | 80% | 0.804 | 85% | 0.853 | S | S | * | * | trans | -81.1 | 140.1 | 174.7 | 44.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 9 | K | 37.7 | Very low | 37.1 | Very low | 202 Ų | 202 | 161.2 Ų | 161.2 | 88% | 0.878 | 85% | 0.849 | S | S | * | * | trans | -137.7 | 102.1 | 160.5 | -80.2 | -173.6 | 178.4 | 174.1 | 0 | 110.7 | ||||
| 10 | K | 37.4 | Very low | 37 | Very low | 183 Ų | 183 | 162.4 Ų | 162.4 | 80% | 0.796 | 85% | 0.846 | S | S | * | * | trans | -72.3 | 134.4 | 158.4 | -78.5 | 176.4 | 173.5 | 175.9 | 0 | 108.2 | ||||
| 11 | N | 31.3 | Very low | 36.8 | Very low | 160 Ų | 160 | 164.2 Ų | 164.2 | 86% | 0.856 | 84% | 0.842 | S | S | * | * | trans | -127.2 | 110.2 | 158 | -76 | -24.6 | 0 | 0 | 0 | 108.6 | ||||
| 12 | F | 36.6 | Very low | 36.3 | Very low | 196 Ų | 196 | 161.5 Ų | 161.5 | 86% | 0.86 | 82% | 0.824 | S | S | * | * | trans | -102.8 | 124.9 | 164 | -98.1 | -90.7 | 0 | 0 | 0 | 106.7 | ||||
| 13 | E | 34.6 | Very low | 35.8 | Very low | 171 Ų | 171 | 163.7 Ų | 163.7 | 80% | 0.799 | 82% | 0.817 | S | S | * | * | trans | -167.9 | 138.5 | 165.6 | -108.4 | 178.7 | 167.9 | 0 | 0 | 107 | ||||
| 14 | Q | 34.9 | Very low | 35.4 | Very low | 143 Ų | 143 | 166 Ų | 166 | 67% | 0.668 | 81% | 0.813 | S | S | * | * | cis | -165.2 | 121.7 | -5.1 | -138.4 | 172.8 | 35.7 | 0 | 0 | 105.9 | ||||
| 15 | L | 34.1 | Very low | 34.7 | Very low | 178 Ų | 178 | 162.3 Ų | 162.3 | 93% | 0.932 | 80% | 0.804 | S | S | * | * | trans | -78.5 | 114.9 | 170.4 | -102 | 135.8 | 0 | 0 | 0 | 108.9 | ||||
| 16 | K | 35.9 | Very low | 34.3 | Very low | 186 Ų | 186 | 165.4 Ų | 165.4 | 81% | 0.809 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -89.7 | 118.5 | 170.2 | -74.7 | -158.2 | 176.1 | -175.8 | 0 | 111.2 | ||
| 17 | R | 32.4 | Very low | 33.7 | Very low | 240 Ų | 240 | 165.4 Ų | 165.4 | 91% | 0.906 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -85.1 | 150.2 | 170.3 | -94.6 | 177.1 | 168.9 | 164.5 | -3.1 | 111.6 | ||
| 18 | N | 38.3 | Very low | 33.6 | Very low | 154 Ų | 154 | 166.1 Ų | 166.1 | 82% | 0.824 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 172.7 | 177.8 | -55.3 | -61.9 | 0 | 0 | 0 | 116.3 | ||
| 19 | P | 43.2 | Very low | 33.1 | Very low | 119 Ų | 119 | 166.9 Ų | 166.9 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | -135.9 | 129.3 | 126 | 30.1 | -13.3 | 0 | 0 | 0 | 112.9 | |||||
| 20 | K | 34.1 | Very low | 32.7 | Very low | 184 Ų | 184 | 164.3 Ų | 164.3 | 80% | 0.8 | 79% | 0.786 | S | S | * | * | 53.4 | 136.9 | 93.2 | -91 | -176 | 179.5 | 171.9 | 0 | 113.9 | |||||
| 21 | R | 32.3 | Very low | 32.7 | Very low | 202 Ų | 202 | 161.6 Ų | 161.6 | 76% | 0.762 | 79% | 0.79 | S | S | * | * | cis | 178.4 | 163.2 | 4.5 | -163.8 | 178.7 | -177.2 | 163.7 | 3 | 108.7 | ||||
| 22 | K | 31.4 | Very low | 32.5 | Very low | 186 Ų | 186 | 161.3 Ų | 161.3 | 81% | 0.809 | 78% | 0.784 | S | S | * | * | trans | 92.3 | 148.7 | 154.7 | -62.9 | -166.1 | 179 | -175.4 | 0 | 118 | ||||
| 23 | K | 30 | Very low | 32.2 | Very low | 173 Ų | 173 | 161.1 Ų | 161.1 | 75% | 0.752 | 78% | 0.783 | S | S | * | * | cis | -179.7 | 138.6 | -32 | -125.1 | -165.3 | 174.1 | -150.4 | 0 | 106.2 | ||||
| 24 | D | 27.6 | Very low | 31.9 | Very low | 118 Ų | 118 | 162.5 Ų | 162.5 | 63% | 0.631 | 79% | 0.786 | S | S | * | * | trans | 51.9 | 147 | 144.3 | -58.9 | -22.4 | 0 | 0 | 0 | 124.5 | ||||
| 25 | N | 26.6 | Very low | 31.5 | Very low | 142 Ų | 142 | 160.9 Ų | 160.9 | 76% | 0.759 | 79% | 0.786 | S | S | * | * | trans | 79.9 | 151.7 | 156.2 | -68.4 | 6.4 | 0 | 0 | 0 | 118.5 | ||||
| 26 | E | 28 | Very low | 31.4 | Very low | 151 Ų | 151 | 164.4 Ų | 164.4 | 71% | 0.706 | 79% | 0.787 | S | S | * | * | cis | 176 | 156.2 | -15.6 | -175.3 | 166.2 | -155.7 | 0 | 0 | 103.7 | ||||
| 27 | E | 25.8 | Very low | 31 | Very low | 164 Ų | 164 | 161.6 Ų | 161.6 | 77% | 0.766 | 78% | 0.78 | S | S | * | * | trans | 63.2 | 115.1 | 166.3 | -86.1 | -179.1 | 140.4 | 0 | 0 | 120.1 | ||||
| 28 | V | 34 | Very low | 31 | Very low | 121 Ų | 121 | 157 Ų | 157 | 73% | 0.733 | 78% | 0.779 | S | S | * | * | 60.3 | 113.7 | 92.1 | -178.8 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 29 | V | 28 | Very low | 30.7 | Very low | 131 Ų | 131 | 155.2 Ų | 155.2 | 79% | 0.794 | 77% | 0.774 | S | S | * | * | -176.6 | 132.1 | 120.4 | 154.3 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 30 | L | 30.7 | Very low | 30.5 | Very low | 148 Ų | 148 | 159.6 Ų | 159.6 | 78% | 0.775 | 78% | 0.781 | S | S | * | * | trans | -61.6 | 148.9 | 177.6 | -66.4 | 148.3 | 0 | 0 | 0 | 111.8 | ||||
| 31 | S | 36.2 | Very low | 30.4 | Very low | 126 Ų | 126 | 160.5 Ų | 160.5 | 88% | 0.881 | 78% | 0.779 | S | S | * | * | trans | -134.4 | 99.6 | 153.4 | -68.7 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 32 | E | 27.8 | Very low | 30.5 | Very low | 155 Ų | 155 | 158.9 Ų | 158.9 | 72% | 0.724 | 79% | 0.785 | S | S | * | * | trans | -66.1 | 164.2 | 170 | -63.6 | 179.7 | 133.6 | 0 | 0 | 112 | ||||
| 33 | K | 29.6 | Very low | 30.7 | Very low | 191 Ų | 191 | 158.2 Ų | 158.2 | 83% | 0.83 | 78% | 0.783 | S | S | * | * | trans | 87.9 | 124.5 | 164.4 | -55.5 | 164.5 | -175.4 | 172.1 | 0 | 112.7 | ||||
| 34 | K | 28.6 | Very low | 30.9 | Very low | 200 Ų | 200 | 156.2 Ų | 156.2 | 87% | 0.87 | 78% | 0.78 | S | S | * | * | cis | -157.7 | 116.8 | 39.7 | -172.4 | 170.3 | -177.6 | 174.7 | 0 | 109.7 | ||||
| 35 | V | 27.7 | Very low | 31.2 | Very low | 110 Ų | 110 | 159 Ų | 159 | 67% | 0.667 | 79% | 0.789 | S | S | * | * | trans | -62.8 | 129.2 | 165.4 | 170.9 | 0 | 0 | 0 | 0 | 109.1 | N37 | V35-N37 HydrophobicContact CG1-CB 4.49Å; V35-N37 VanDerWaalsContact CG1-CG 3.43Å; V35-N37 WeakPolarHBondContact CG1-OD1 3.43Å | ||
| 36 | R | 30.5 | Very low | 31.6 | Very low | 251 Ų | 251 | 160.6 Ų | 160.6 | 95% | 0.947 | 80% | 0.797 | S | S | * | * | trans | -118 | 102.4 | 156.4 | -140.1 | 179.4 | -168.4 | -176.6 | 3 | 107.6 | ||||
| 37 | N | 29.3 | Very low | 31.9 | Very low | 127 Ų | 127 | 162 Ų | 162 | 68% | 0.679 | 80% | 0.801 | S | S | * | * | trans | -71 | 130.5 | 175.8 | -68.4 | -40 | 0 | 0 | 0 | 110.1 | V35 | V35-N37 HydrophobicContact CG1-CB 4.49Å; V35-N37 VanDerWaalsContact CG1-CG 3.43Å; V35-N37 WeakPolarHBondContact CG1-OD1 3.43Å | ||
| 38 | T | 32.2 | Very low | 32.1 | Very low | 144 Ų | 144 | 159.7 Ų | 159.7 | 88% | 0.883 | 79% | 0.793 | S | S | * | * | trans | -123.5 | 97.2 | 148.8 | 52 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 39 | V | 30.7 | Very low | 32.2 | Very low | 117 Ų | 117 | 162.9 Ų | 162.9 | 71% | 0.709 | 81% | 0.805 | S | S | * | * | trans | -67.5 | 121.6 | 169.4 | 169.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 40 | K | 39.1 | Very low | 32.5 | Very low | 211 Ų | 211 | 161.8 Ų | 161.8 | 92% | 0.917 | 80% | 0.804 | S | S | * | * | trans | -128.2 | 105 | 146 | -93.7 | -172.9 | 176.2 | -179.8 | 0 | 108.6 | ||||
| 41 | R | 32.8 | Very low | 32.9 | Very low | 202 Ų | 202 | 160.3 Ų | 160.3 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | trans | -46.6 | 142.6 | 162 | -90.6 | 172.6 | 147.2 | 104.7 | -4.1 | 110.1 | ||||
| 42 | N | 33.3 | Very low | 33 | Very low | 168 Ų | 168 | 163.5 Ų | 163.5 | 90% | 0.898 | 81% | 0.806 | S | S | * | * | trans | -148.9 | 134.2 | 130.2 | -83.1 | -26.1 | 0 | 0 | 0 | 109.3 | ||||
| 43 | K | 37 | Very low | 33.2 | Very low | 173 Ų | 173 | 158.8 Ų | 158.8 | 75% | 0.752 | 80% | 0.799 | S | S | * | * | trans | -78.4 | 132.5 | -170 | -99.3 | 172.9 | 165.3 | 176.9 | 0 | 112 | ||||
| 44 | N | 34.3 | Very low | 33.8 | Very low | 131 Ų | 131 | 158.1 Ų | 158.1 | 70% | 0.701 | 80% | 0.799 | S | S | * | * | 49 | 117.2 | 128.3 | -49.7 | -6.3 | 0 | 0 | 0 | 120.1 | |||||
| 45 | H | 33.7 | Very low | 34.3 | Very low | 176 Ų | 176 | 153.9 Ų | 153.9 | 82% | 0.815 | 79% | 0.79 | S | S | * | * | -179.4 | 111.1 | 104.2 | -117.8 | -83.3 | 0 | 0 | 0 | 110.7 | |||||
| 46 | L | 35.3 | Very low | 35.2 | Very low | 176 Ų | 176 | 157.7 Ų | 157.7 | 92% | 0.921 | 80% | 0.798 | S | S | * | * | trans | -177.3 | 98.5 | 131.6 | -121.3 | 85.4 | 0 | 0 | 0 | 106.7 | ||||
| 47 | K | 33.7 | Very low | 35.7 | Very low | 181 Ų | 181 | 152.7 Ų | 152.7 | 79% | 0.787 | 79% | 0.785 | S | S | * | * | trans | -97.6 | 134.5 | 169.6 | -119.2 | -178.4 | 170.4 | -178.4 | 0 | 108.1 | ||||
| 48 | D | 29.7 | Very low | 36.5 | Very low | 115 Ų | 115 | 151.8 Ų | 151.8 | 62% | 0.615 | 78% | 0.784 | S | S | * | * | trans | 67.4 | 89.8 | 142.2 | -57.9 | -24.5 | 0 | 0 | 0 | 118.6 | ||||
| 49 | L | 35.9 | Very low | 37.2 | Very low | 188 Ų | 188 | 153 Ų | 153 | 98% | 0.984 | 79% | 0.785 | S | S | * | * | -130.5 | 69 | 126.7 | -69.9 | 177.2 | 0 | 0 | 0 | 108.4 | |||||
| 50 | S | 35 | Very low | 38.6 | Very low | 108 Ų | 108 | 154.2 Ų | 154.2 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | trans | -100.7 | 96.5 | 164.3 | -177.3 | 0 | 0 | 0 | 0 | 107.3 | E52 | S50-E52 PolarHBondContact O-N 3.39Š| ||
| 51 | S | 37.9 | Very low | 39.8 | Very low | 116 Ų | 116 | 153.6 Ų | 153.6 | 81% | 0.811 | 78% | 0.784 | S | S | * | * | trans | -60.9 | 126.5 | 175.3 | -176.7 | 0 | 0 | 0 | 0 | 110.2 | G53 | S51-G53 PolarHBondContact O-N 3.05Å; S51-G53 VanDerWaalsContact O-N 3.13Å | ||
| 52 | E | 38.8 | Very low | 41.2 | Very low | 194 Ų | 194 | 152.5 Ų | 152.5 | 91% | 0.907 | 79% | 0.788 | S | S | * | * | trans | -68 | 99.2 | 174.2 | -169.3 | 145.6 | -168.6 | 0 | 0 | 109.2 | S50 | S50-E52 PolarHBondContact O-N 3.39Š| ||
| 53 | G | 31.5 | Very low | 42.7 | Very low | 55 Ų | 55 | 151.3 Ų | 151.3 | 57% | 0.567 | 78% | 0.78 | S | S | * | * | trans | -138.4 | 75 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | S51 T55 | S51-G53 PolarHBondContact O-N 3.05Å; S51-G53 VanDerWaalsContact O-N 3.13Å; G53-T55 PolarHBondContact O-N 2.97Å | ||
| 54 | Q | 43.4 | Very low | 44 | Very low | 178 Ų | 178 | 152.7 Ų | 152.7 | 83% | 0.832 | 79% | 0.785 | S | S | * | * | trans | -63.4 | 91 | -180 | -153.6 | 178.7 | 38.3 | 0 | 0 | 110 | ||||
| 55 | T | 38.7 | Very low | 45.6 | Very low | 110 Ų | 110 | 150.3 Ų | 150.3 | 68% | 0.675 | 77% | 0.772 | S | S | * | * | trans | -107 | 106.6 | 169.6 | 40.4 | 0 | 0 | 0 | 0 | 109.1 | G53 H57 | G53-T55 PolarHBondContact O-N 2.97Å; T55-H57 PolarHBondContact O-N 3.41Å | ||
| 56 | K | 47 | Very low | 47.5 | Very low | 191 Ų | 191 | 144.2 Ų | 144.2 | 83% | 0.83 | 75% | 0.752 | S | S | * | * | trans | -71.1 | 66.2 | 175.7 | -63.1 | 178.6 | -178.8 | 176.4 | 0 | 110.3 | ||||
| 57 | H | 39.9 | Very low | 49 | Very low | 146 Ų | 146 | 140.6 Ų | 140.6 | 68% | 0.676 | 74% | 0.739 | S | S | * | * | trans | -111.3 | 115.4 | 173.3 | -67.8 | -58.4 | 0 | 0 | 0 | 110.3 | T55 | T55-H57 PolarHBondContact O-N 3.41Š| ||
| 58 | T | 46.8 | Very low | 50.7 | Low | 107 Ų | 107 | 137.5 Ų | 137.5 | 66% | 0.656 | 73% | 0.731 | S | S | * | * | trans | 46.4 | 108.9 | 156 | 55.2 | 0 | 0 | 0 | 0 | 116.4 | L60 | T58-L60 PolarHBondContact O-N 3.33Š| ||
| 59 | N | 47.4 | Very low | 52.6 | Low | 171 Ų | 171 | 138.9 Ų | 138.9 | 91% | 0.914 | 73% | 0.732 | S | S | * | * | trans | -61.2 | 79.2 | 163.7 | -65.2 | -66.6 | 0 | 0 | 0 | 110.1 | K61 | N59-K61 PolarHBondContact O-N 2.91Å; N59-K61 VanDerWaalsContact O-N 3.11Å | ||
| 60 | L | 59.8 | Low | 54.2 | Low | 141 Ų | 141 | 137.5 Ų | 137.5 | 74% | 0.738 | 71% | 0.713 | S | S | * | * | trans | -64.9 | 111.8 | 169 | -70.4 | 173.4 | 0 | 0 | 0 | 106.5 | T58 Q62 | T58-L60 PolarHBondContact O-N 3.33Å; L60-Q62 VanDerWaalsContact C-N 3.34Å; L60-Q62 PolarHBondContact O-N 3.42Å | ||
| 61 | K | 63.5 | Low | 55.8 | Low | 198 Ų | 198 | 140.4 Ų | 140.4 | 86% | 0.861 | 71% | 0.713 | S | S | * | * | trans | -57.4 | 101.2 | 171.3 | -70.7 | -177.8 | 179.4 | 179.2 | 0 | 107.4 | N59 I63 | N59-K61 PolarHBondContact O-N 2.91Å; N59-K61 VanDerWaalsContact O-N 3.11Å; K61-I63 PolarHBondContact O-N 3.34Å | ||
| 62 | Q | 63.1 | Low | 57.6 | Low | 180 Ų | 180 | 139 Ų | 139 | 84% | 0.841 | 70% | 0.699 | S | S | * | * | trans | -67.7 | 101.8 | 173.5 | -68.7 | -174.7 | 6.8 | 0 | 0 | 107.5 | L60 K64 | L60-Q62 VanDerWaalsContact C-N 3.34Å; L60-Q62 PolarHBondContact O-N 3.42Å; Q62-K64 PolarHBondContact O-N 2.93Å | ||
| 63 | I | 64.6 | Low | 59.7 | Low | 143 Ų | 143 | 132.2 Ų | 132.2 | 73% | 0.733 | 67% | 0.665 | S | S | * | * | trans | -72.3 | 101.3 | 174.8 | -57.7 | 172.3 | 0 | 0 | 0 | 106.3 | K61 I65 | K61-I63 PolarHBondContact O-N 3.34Å; I63-I65 HydrophobicContact CG2-CG1 4.13Å; I63-I65 PolarHBondContact O-N 2.81Å | ||
| 64 | K | 64.6 | Low | 62 | Low | 201 Ų | 201 | 135.2 Ų | 135.2 | 87% | 0.874 | 66% | 0.664 | S | S | * | * | trans | -66.8 | 99.6 | 169.5 | -91.9 | -176.7 | 176.4 | 176.7 | 0 | 108.5 | Q62 | Q62-K64 PolarHBondContact O-N 2.93Š| ||
| 65 | I | 67.8 | Low | 63.9 | Low | 81 Ų | 81 | 130.6 Ų | 130.6 | 42% | 0.415 | 65% | 0.65 | S | S | . | * | trans | -78.2 | 127.7 | 174.4 | -57 | 177.8 | 0 | 0 | 0 | 108 | I63 K69 W73 | I63-I65 HydrophobicContact CG2-CG1 4.13Å; I63-I65 PolarHBondContact O-N 2.81Å; I65-K69 HydrophobicContact CG2-CB 3.84Å; I65-W73 HydrophobicContact CD1-CH2 3.97Å; I65-W73 HydrophobicContact CD1-CZ2 3.62Å | ||
| 66 | A | 72.9 | Confident | 65.9 | Low | 49 Ų | 49 | 126.9 Ų | 126.9 | 41% | 0.405 | 63% | 0.626 | S | S | . | * | trans | -56.7 | 135.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | N68 K69 | A66-N68 PolarHBondContact O-N 2.8Å; A66-K69 PolarHBondContact O-N 3.26Å | ||
| 67 | P | 68.1 | Low | 67.6 | Low | 99 Ų | 99 | 120.5 Ų | 120.5 | 64% | 0.643 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -58.3 | -27.5 | -173.8 | 22.4 | -33.3 | 0 | 0 | 0 | 112.9 | K69 R70 | P67-K69 VanDerWaalsContact C-N 3.29Å; P67-K69 PolarHBondContact O-N 3.06Å; P67-R70 PolarHBondContact O-N 2.96Å; P67-R70 VanDerWaalsContact O-N 3.14Å |
| 68 | N | 69.2 | Low | 69.8 | Low | 117 Ų | 117 | 120.8 Ų | 120.8 | 63% | 0.626 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -64 | -31.5 | 176.9 | -61.8 | -14 | 0 | 0 | 0 | 112.9 | A66 R70 | A66-N68 PolarHBondContact O-N 2.8Å; N68-R70 VanDerWaalsContact C-N 3.35Å |
| 69 | K | 68.7 | Low | 71.6 | Confident | 144 Ų | 144 | 119.7 Ų | 119.7 | 63% | 0.626 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -79.3 | -15.7 | 176.5 | -63.9 | -170.8 | 178.4 | -174.7 | 0 | 113.2 | I65 A66 P67 T72 W73 | I65-K69 HydrophobicContact CG2-CB 3.84Å; A66-K69 PolarHBondContact O-N 3.26Å; P67-K69 VanDerWaalsContact C-N 3.29Å; P67-K69 PolarHBondContact O-N 3.06Å; K69-T72 PolarHBondContact O-OG1 3.36Å; K69-T72 VanDerWaalsContact O-OG1 3.05Å; K69-W73 PolarHBondContact O-NE1 3.4Å |
| 70 | R | 68.8 | Low | 73.4 | Confident | 158 Ų | 158 | 114.1 Ų | 114.1 | 60% | 0.596 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -80.7 | -17.8 | 176.2 | -171.3 | 179.7 | -90.3 | -171.8 | -5.6 | 112.2 | P67 N68 T72 W73 | P67-R70 PolarHBondContact O-N 2.96Å; P67-R70 VanDerWaalsContact O-N 3.14Å; N68-R70 VanDerWaalsContact C-N 3.35Å; R70-T72 VanDerWaalsContact C-N 3.29Å; R70-T72 PolarHBondContact O-N 2.73Å; R70-W73 HydrophobicContact CG-CD2 4.24Å; R70-W73 HydrophobicContact CG-CE3 4.33Å; R70-W73 HydrophobicContact CG-CG 4.48Å; R70-W73 WeakPolarHBondContact O-CB 3.2Å; R70-W73 PolarHBondContact O-N 3.17Å |
| 71 | K | 70.2 | Confident | 74.6 | Confident | 170 Ų | 170 | 110.6 Ų | 110.6 | 74% | 0.739 | 55% | 0.55 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.1 | -25 | 177.9 | -64 | -177.7 | -179.7 | -180 | 0 | 113.2 | W73 | K71-W73 VanDerWaalsContact C-N 3.32Š|
| 72 | T | 75.8 | Confident | 75.8 | Confident | 86 Ų | 86 | 105.5 Ų | 105.5 | 53% | 0.528 | 53% | 0.532 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.5 | 0.4 | 177.3 | 55.5 | 0 | 0 | 0 | 0 | 113.5 | K69 R70 P128 | K69-T72 PolarHBondContact O-OG1 3.36Å; K69-T72 VanDerWaalsContact O-OG1 3.05Å; R70-T72 VanDerWaalsContact C-N 3.29Å; R70-T72 PolarHBondContact O-N 2.73Å; T72-P128 WeakPolarHBondContact O-CD 3.47Å |
| 73 | W | 82.8 | Confident | 77.1 | Confident | 52 Ų | 52 | 103.9 Ų | 103.9 | 20% | 0.197 | 52% | 0.52 | C | S | . | . | P | Polyproline II helix | trans | -77.4 | 131.5 | -178.8 | -69.2 | 20.6 | 0 | 0 | 0 | 110.1 | I65 K69 R70 K71 K125 V126 P127 | I65-W73 HydrophobicContact CD1-CH2 3.97Å; I65-W73 HydrophobicContact CD1-CZ2 3.62Å; K69-W73 PolarHBondContact O-NE1 3.4Å; R70-W73 HydrophobicContact CG-CD2 4.24Å; R70-W73 HydrophobicContact CG-CE3 4.33Å; R70-W73 HydrophobicContact CG-CG 4.48Å; R70-W73 WeakPolarHBondContact O-CB 3.2Å; R70-W73 PolarHBondContact O-N 3.17Å; K71-W73 VanDerWaalsContact C-N 3.32Å; W73-K125 HydrophobicContact CB-CB 3.84Å; W73-K125 HydrophobicContact CE3-CB 4.22Å; W73-K125 WeakPolarHBondContact CZ3-O 3.23Å; W73-V126 CarbonylContact C-O 3.58Å; W73-V126 WeakPolarHBondContact CA-O 3.34Å; W73-V126 WeakPolarHBondContact CB-O 3.37Å; W73-P127 HydrophobicContact CD2-CG 4.12Å; W73-P127 HydrophobicContact CH2-CG 4.02Å; W73-P127 HydrophobicContact CZ2-CG 3.58Å; W73-P127 HydrophobicContact CZ3-CG 4.48Å |
| 74 | Q | 79.5 | Confident | 78.3 | Confident | 117 Ų | 117 | 100 Ų | 100 | 55% | 0.547 | 50% | 0.5 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.9 | 150.1 | -178.6 | -65.3 | -64.6 | -29.7 | 0 | 0 | 109.7 | V126 | Q74-V126 PolarHBondContact N-O 3.29Å; Q74-V126 PolarHBondContact O-N 3.3Å |
| 75 | P | 82.6 | Confident | 79.7 | Confident | 82 Ų | 82 | 93.6 Ų | 93.6 | 53% | 0.532 | 47% | 0.473 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -55.5 | 149.6 | 165.3 | -20.7 | 32.6 | 0 | 0 | 0 | 110.7 | S77 | P75-S77 PolarHBondContact O-N 3Å |
| 76 | L | 81.4 | Confident | 80.9 | Confident | 32 Ų | 32 | 93.9 Ų | 93.9 | 17% | 0.168 | 48% | 0.479 | C | S | . | . | P | Polyproline II helix | trans | -56.3 | 133.9 | 177.9 | -172.5 | 63.5 | 0 | 0 | 0 | 111.3 | T80 R81 L84 C121 L124 V126 | L76-T80 WeakPolarHBondContact CD1-OG1 3.25Å; L76-T80 VanDerWaalsContact CG-OG1 3.32Å; L76-T80 WeakPolarHBondContact CG-OG1 3.16Å; L76-R81 HydrophobicContact CB-CG 4.33Å; L76-R81 HydrophobicContact CD2-CG 3.64Å; L76-R81 HydrophobicContact CG-CG 3.9Å; L76-L84 HydrophobicContact CD2-CD1 4.14Å; L76-C121 HydrophobicContact CD2-CB 4.05Å; L76-L124 PolarHBondContact N-O 3.46Å; L76-V126 HydrophobicContact CD1-CG2 4.16Å |
| 77 | S | 83.2 | Confident | 81.8 | Confident | 56 Ų | 56 | 95.6 Ų | 95.6 | 39% | 0.392 | 48% | 0.48 | S | S | . | . | P | Polyproline II helix | trans | -65.7 | 146.3 | -176.2 | 73.2 | 0 | 0 | 0 | 0 | 111.1 | P75 S79 T80 R81 | P75-S77 PolarHBondContact O-N 3Å; S77-S79 VanDerWaalsContact C-N 3.31Å; S77-S79 PolarHBondContact O-N 3.36Å; S77-S79 PolarHBondContact OG-OG 3.44Å; S77-S79 VanDerWaalsContact OG-OG 3.1Å; S77-T80 PolarHBondContact N-OG1 3.09Å; S77-T80 PolarHBondContact O-N 3.28Å; S77-T80 VanDerWaalsContact O-N 3.16Å; S77-T80 PolarHBondContact O-OG1 3.25Å; S77-T80 WeakPolarHBondContact OG-CG2 3.48Å; S77-T80 PolarHBondContact OG-N 2.95Å; S77-T80 PolarHBondContact OG-OG1 2.95Å; S77-R81 PolarHBondContact O-N 3.17Å; S77-R81 VanDerWaalsContact O-N 3.11Å |
| 78 | K | 85.4 | Confident | 82.9 | Confident | 153 Ų | 153 | 92.6 Ų | 92.6 | 67% | 0.665 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -52.6 | -48.7 | 178 | -69.1 | 176.1 | -179.6 | -176.6 | 0 | 111.5 | T80 R81 D82 | K78-T80 VanDerWaalsContact C-N 3.31Å; K78-T80 PolarHBondContact O-N 3.39Å; K78-R81 WeakPolarHBondContact O-CA 3.34Å; K78-R81 WeakPolarHBondContact O-CB 3.41Å; K78-R81 PolarHBondContact O-N 2.85Å; K78-D82 PolarHBondContact O-N 3.5Å |
| 79 | S | 84.4 | Confident | 84 | Confident | 83 Ų | 83 | 90.2 Ų | 90.2 | 58% | 0.58 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -55.1 | -40.9 | 178.2 | 56.5 | 0 | 0 | 0 | 0 | 114.5 | S77 Y83 | S77-S79 VanDerWaalsContact C-N 3.31Å; S77-S79 PolarHBondContact O-N 3.36Å; S77-S79 PolarHBondContact OG-OG 3.44Å; S77-S79 VanDerWaalsContact OG-OG 3.1Å; S79-Y83 WeakPolarHBondContact O-CB 3.49Å; S79-Y83 PolarHBondContact O-N 3.24Å |
| 80 | T | 84.4 | Confident | 85.2 | Confident | 55 Ų | 55 | 85.9 Ų | 85.9 | 34% | 0.337 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -73.2 | -31.5 | 177.3 | 52.9 | 0 | 0 | 0 | 0 | 112.4 | L76 S77 K78 L84 | L76-T80 WeakPolarHBondContact CD1-OG1 3.25Å; L76-T80 VanDerWaalsContact CG-OG1 3.32Å; L76-T80 WeakPolarHBondContact CG-OG1 3.16Å; S77-T80 PolarHBondContact N-OG1 3.09Å; S77-T80 PolarHBondContact O-N 3.28Å; S77-T80 VanDerWaalsContact O-N 3.16Å; S77-T80 PolarHBondContact O-OG1 3.25Å; S77-T80 WeakPolarHBondContact OG-CG2 3.48Å; S77-T80 PolarHBondContact OG-N 2.95Å; S77-T80 PolarHBondContact OG-OG1 2.95Å; K78-T80 VanDerWaalsContact C-N 3.31Å; K78-T80 PolarHBondContact O-N 3.39Å; T80-L84 WeakPolarHBondContact O-CB 3.41Å; T80-L84 VanDerWaalsContact O-CG 3.24Å; T80-L84 WeakPolarHBondContact O-CG 3.49Å; T80-L84 PolarHBondContact O-N 2.82Å |
| 81 | R | 85.6 | Confident | 86.3 | Confident | 67 Ų | 67 | 82 Ų | 82 | 25% | 0.253 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -67.3 | -45.6 | 173.4 | -71 | -171.4 | -73.2 | 151.5 | -5.3 | 111 | L76 S77 K78 Y83 L84 Q85 E122 | L76-R81 HydrophobicContact CB-CG 4.33Å; L76-R81 HydrophobicContact CD2-CG 3.64Å; L76-R81 HydrophobicContact CG-CG 3.9Å; S77-R81 PolarHBondContact O-N 3.17Å; S77-R81 VanDerWaalsContact O-N 3.11Å; K78-R81 WeakPolarHBondContact O-CA 3.34Å; K78-R81 WeakPolarHBondContact O-CB 3.41Å; K78-R81 PolarHBondContact O-N 2.85Å; R81-Y83 VanDerWaalsContact C-N 3.34Å; R81-Y83 PolarHBondContact O-N 3.05Å; R81-L84 PolarHBondContact O-N 3.17Å; R81-Q85 WeakPolarHBondContact O-CB 3.41Å; R81-Q85 PolarHBondContact O-N 3.15Å; R81-E122 IonicContact NH1-OE1 3.42Å |
| 82 | D | 88.9 | Confident | 87.3 | Confident | 90 Ų | 90 | 74.7 Ų | 74.7 | 48% | 0.481 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -61.3 | -45.1 | 177.7 | -57.2 | -24 | 0 | 0 | 0 | 110.2 | K78 L84 Q85 T86 | K78-D82 PolarHBondContact O-N 3.5Å; D82-L84 PolarHBondContact O-N 3.37Å; D82-Q85 WeakPolarHBondContact O-CB 3.27Å; D82-Q85 PolarHBondContact O-N 3.42Å; D82-T86 PolarHBondContact O-N 2.98Å; D82-T86 PolarHBondContact O-OG1 3.12Å |
| 83 | Y | 90.9 | Very high | 88 | Confident | 146 Ų | 146 | 73.8 Ų | 73.8 | 57% | 0.573 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -59.8 | -46.2 | 174.6 | 175.4 | -100.4 | 0 | 0 | 0 | 112.9 | S79 R81 Q85 T86 M87 | S79-Y83 WeakPolarHBondContact O-CB 3.49Å; S79-Y83 PolarHBondContact O-N 3.24Å; R81-Y83 VanDerWaalsContact C-N 3.34Å; R81-Y83 PolarHBondContact O-N 3.05Å; Y83-Q85 VanDerWaalsContact C-N 3.3Å; Y83-Q85 PolarHBondContact O-N 3.39Å; Y83-T86 PolarHBondContact O-N 3.4Å; Y83-M87 HydrophobicContact CD1-CG 4.34Å; Y83-M87 HydrophobicContact CD2-CG 4.46Å; Y83-M87 HydrophobicContact CE1-CG 3.82Å; Y83-M87 HydrophobicContact CE2-CG 3.96Å; Y83-M87 HydrophobicContact CE2-SD 4.47Å; Y83-M87 WeakPolarHBondContact O-CB 3.26Å; Y83-M87 WeakPolarHBondContact O-CG 3.42Å; Y83-M87 PolarHBondContact O-N 2.91Å |
| 84 | L | 90.3 | Very high | 88.4 | Confident | 61 Ų | 61 | 75.1 Ų | 75.1 | 32% | 0.319 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -62.1 | -40 | 176.8 | -78.4 | 172.6 | 0 | 0 | 0 | 111.4 | L76 T80 R81 D82 M87 M88 | L76-L84 HydrophobicContact CD2-CD1 4.14Å; T80-L84 WeakPolarHBondContact O-CB 3.41Å; T80-L84 VanDerWaalsContact O-CG 3.24Å; T80-L84 WeakPolarHBondContact O-CG 3.49Å; T80-L84 PolarHBondContact O-N 2.82Å; R81-L84 PolarHBondContact O-N 3.17Å; D82-L84 PolarHBondContact O-N 3.37Å; L84-M87 PolarHBondContact O-N 3.44Å; L84-M88 HydrophobicContact CB-CE 4.12Å; L84-M88 VanDerWaalsContact O-CG 3.25Å; L84-M88 WeakPolarHBondContact O-CG 3.31Å; L84-M88 PolarHBondContact O-N 3.29Å |
| 85 | Q | 92.1 | Very high | 88.8 | Confident | 68 Ų | 68 | 72.3 Ų | 72.3 | 32% | 0.318 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62.5 | -49.1 | 175.1 | 180 | 175 | -13.6 | 0 | 0 | 111.2 | R81 D82 Y83 M87 M88 E89 L118 | R81-Q85 WeakPolarHBondContact O-CB 3.41Å; R81-Q85 PolarHBondContact O-N 3.15Å; D82-Q85 WeakPolarHBondContact O-CB 3.27Å; D82-Q85 PolarHBondContact O-N 3.42Å; Y83-Q85 VanDerWaalsContact C-N 3.3Å; Y83-Q85 PolarHBondContact O-N 3.39Å; Q85-M87 VanDerWaalsContact C-N 3.32Å; Q85-M87 PolarHBondContact O-N 3.43Å; Q85-M88 PolarHBondContact O-N 2.71Å; Q85-M88 VanDerWaalsContact O-N 3.17Å; Q85-E89 HydrophobicContact CG-CG 4.49Å; Q85-E89 WeakPolarHBondContact CG-OE1 3.32Å; Q85-E89 PolarHBondContact NE2-OE1 3.4Å; Q85-E89 WeakPolarHBondContact O-CB 3.29Å; Q85-E89 WeakPolarHBondContact O-CG 3.48Å; Q85-E89 PolarHBondContact O-N 2.93Å; Q85-L118 HydrophobicContact CB-CD2 4.13Å; Q85-L118 HydrophobicContact CG-CD1 4.3Å |
| 86 | T | 93.2 | Very high | 89.1 | Confident | 87 Ų | 87 | 69.7 Ų | 69.7 | 53% | 0.534 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -60.2 | -40.8 | 177.4 | -54.9 | 0 | 0 | 0 | 0 | 111.9 | D82 Y83 E89 S90 | D82-T86 PolarHBondContact O-N 2.98Å; D82-T86 PolarHBondContact O-OG1 3.12Å; Y83-T86 PolarHBondContact O-N 3.4Å; T86-E89 PolarHBondContact O-N 2.95Å; T86-S90 WeakPolarHBondContact O-CB 3.48Å; T86-S90 PolarHBondContact O-N 3.4Å |
| 87 | M | 92.3 | Very high | 89.3 | Confident | 85 Ų | 85 | 72.7 Ų | 72.7 | 42% | 0.419 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64.5 | -41.1 | 175.1 | -79.4 | -72.5 | -70 | 0 | 0 | 112.4 | Y83 L84 Q85 S90 V91 | Y83-M87 HydrophobicContact CD1-CG 4.34Å; Y83-M87 HydrophobicContact CD2-CG 4.46Å; Y83-M87 HydrophobicContact CE1-CG 3.82Å; Y83-M87 HydrophobicContact CE2-CG 3.96Å; Y83-M87 HydrophobicContact CE2-SD 4.47Å; Y83-M87 WeakPolarHBondContact O-CB 3.26Å; Y83-M87 WeakPolarHBondContact O-CG 3.42Å; Y83-M87 PolarHBondContact O-N 2.91Å; L84-M87 PolarHBondContact O-N 3.44Å; Q85-M87 VanDerWaalsContact C-N 3.32Å; Q85-M87 PolarHBondContact O-N 3.43Å; M87-S90 PolarHBondContact O-N 2.88Å; M87-S90 PolarHBondContact O-OG 2.89Å; M87-V91 VanDerWaalsContact O-CG2 3.28Å; M87-V91 WeakPolarHBondContact O-CG2 3.23Å; M87-V91 PolarHBondContact O-N 2.96Å |
| 88 | M | 92.3 | Very high | 89.3 | Confident | 36 Ų | 36 | 76.2 Ų | 76.2 | 18% | 0.177 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -65.4 | -42.5 | 175 | -70.9 | 173 | -152.6 | 0 | 0 | 110.8 | L84 Q85 S90 V91 I92 K114 L117 | L84-M88 HydrophobicContact CB-CE 4.12Å; L84-M88 VanDerWaalsContact O-CG 3.25Å; L84-M88 WeakPolarHBondContact O-CG 3.31Å; L84-M88 PolarHBondContact O-N 3.29Å; Q85-M88 PolarHBondContact O-N 2.71Å; Q85-M88 VanDerWaalsContact O-N 3.17Å; M88-S90 VanDerWaalsContact C-N 3.35Å; M88-S90 PolarHBondContact O-N 3.38Å; M88-V91 PolarHBondContact O-N 2.99Å; M88-I92 WeakPolarHBondContact O-CB 3.41Å; M88-I92 WeakPolarHBondContact O-CG1 3.49Å; M88-I92 PolarHBondContact O-N 3.36Å; M88-K114 HydrophobicContact CB-CD 4.49Å; M88-K114 HydrophobicContact CB-CG 4.24Å; M88-K114 HydrophobicContact SD-CG 4.18Å; M88-L117 HydrophobicContact CE-CD2 3.31Å; M88-L117 HydrophobicContact CE-CG 3.91Å; M88-L117 HydrophobicContact SD-CD2 3.81Å; M88-L117 HydrophobicContact SD-CG 4.43Å |
| 89 | E | 92.3 | Very high | 89 | Confident | 67 Ų | 67 | 76.1 Ų | 76.1 | 31% | 0.313 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -64.5 | -37.5 | 178.1 | -73.6 | 170.5 | 179.9 | 0 | 0 | 112.3 | Q85 T86 S93 K114 | Q85-E89 HydrophobicContact CG-CG 4.49Å; Q85-E89 WeakPolarHBondContact CG-OE1 3.32Å; Q85-E89 PolarHBondContact NE2-OE1 3.4Å; Q85-E89 WeakPolarHBondContact O-CB 3.29Å; Q85-E89 WeakPolarHBondContact O-CG 3.48Å; Q85-E89 PolarHBondContact O-N 2.93Å; T86-E89 PolarHBondContact O-N 2.95Å; E89-S93 WeakPolarHBondContact O-CB 3.39Å; E89-S93 PolarHBondContact O-N 2.92Å; E89-S93 PolarHBondContact O-OG 3.01Å; E89-K114 HydrophobicContact CG-CD 4.03Å; E89-K114 IonicContact OE1-NZ 2.84Å; E89-K114 PolarHBondContact OE1-NZ 2.98Å |
| 90 | S | 93.8 | Very high | 88.2 | Confident | 53 Ų | 53 | 79.5 Ų | 79.5 | 37% | 0.371 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -67.9 | -41 | 174.9 | 73.6 | 0 | 0 | 0 | 0 | 112.2 | T86 M87 M88 S93 T94 | T86-S90 WeakPolarHBondContact O-CB 3.48Å; T86-S90 PolarHBondContact O-N 3.4Å; M87-S90 PolarHBondContact O-N 2.88Å; M87-S90 PolarHBondContact O-OG 2.89Å; M88-S90 VanDerWaalsContact C-N 3.35Å; M88-S90 PolarHBondContact O-N 3.38Å; S90-S93 PolarHBondContact O-N 3.2Å; S90-T94 WeakPolarHBondContact O-CB 3.35Å; S90-T94 PolarHBondContact O-N 3.37Å; S90-T94 PolarHBondContact O-OG1 3.22Å |
| 91 | V | 91.9 | Very high | 88 | Confident | 75 Ų | 75 | 84.8 Ų | 84.8 | 46% | 0.455 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -65.7 | -44.3 | 175.8 | 170.6 | 0 | 0 | 0 | 0 | 110.9 | M87 M88 S93 T94 I95 | M87-V91 VanDerWaalsContact O-CG2 3.28Å; M87-V91 WeakPolarHBondContact O-CG2 3.23Å; M87-V91 PolarHBondContact O-N 2.96Å; M88-V91 PolarHBondContact O-N 2.99Å; V91-S93 VanDerWaalsContact C-N 3.33Å; V91-S93 PolarHBondContact O-N 3.46Å; V91-T94 PolarHBondContact O-N 3.33Å; V91-I95 HydrophobicContact CG1-CD1 3.7Å; V91-I95 HydrophobicContact CG1-CG1 4.38Å; V91-I95 VanDerWaalsContact O-CG1 3.25Å; V91-I95 WeakPolarHBondContact O-CG1 3.48Å; V91-I95 PolarHBondContact O-N 3.45Å |
| 92 | I | 90.3 | Very high | 87.6 | Confident | 17 Ų | 17 | 86.8 Ų | 86.8 | 9% | 0.087 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -58.5 | -48.1 | 174.7 | -68.8 | 170.9 | 0 | 0 | 0 | 109.9 | M88 T94 I95 L96 L110 K114 | M88-I92 WeakPolarHBondContact O-CB 3.41Å; M88-I92 WeakPolarHBondContact O-CG1 3.49Å; M88-I92 PolarHBondContact O-N 3.36Å; I92-T94 VanDerWaalsContact C-N 3.32Å; I92-T94 PolarHBondContact O-N 2.93Å; I92-I95 PolarHBondContact O-N 3.45Å; I92-L96 HydrophobicContact CG2-CD1 3.73Å; I92-L96 HydrophobicContact CG2-CG 4.3Å; I92-L96 WeakPolarHBondContact O-CB 3.49Å; I92-L96 VanDerWaalsContact O-CG 3.26Å; I92-L96 WeakPolarHBondContact O-CG 3.36Å; I92-L96 PolarHBondContact O-N 3.47Å; I92-L110 HydrophobicContact CD1-CB 4.14Å; I92-L110 HydrophobicContact CG1-CB 3.99Å; I92-L110 HydrophobicContact CG1-CD1 4.3Å; I92-L110 HydrophobicContact CG2-CB 4.29Å; I92-L110 HydrophobicContact CG2-CD1 4.14Å; I92-K114 HydrophobicContact CD1-CB 4.15Å; I92-K114 HydrophobicContact CD1-CD 4.15Å |
| 93 | S | 89.8 | Confident | 87.3 | Confident | 68 Ų | 68 | 86.5 Ų | 86.5 | 48% | 0.476 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -57.9 | -45.2 | 177.3 | -58.5 | 0 | 0 | 0 | 0 | 111.3 | E89 S90 V91 I95 L96 S97 | E89-S93 WeakPolarHBondContact O-CB 3.39Å; E89-S93 PolarHBondContact O-N 2.92Å; E89-S93 PolarHBondContact O-OG 3.01Å; S90-S93 PolarHBondContact O-N 3.2Å; V91-S93 VanDerWaalsContact C-N 3.33Å; V91-S93 PolarHBondContact O-N 3.46Å; S93-I95 PolarHBondContact O-N 3.19Å; S93-L96 PolarHBondContact O-N 2.89Å; S93-S97 WeakPolarHBondContact O-CB 3.49Å; S93-S97 PolarHBondContact O-N 3.4Å; S93-S97 PolarHBondContact O-OG 3.14Å |
| 94 | T | 92.4 | Very high | 87.1 | Confident | 79 Ų | 79 | 86.5 Ų | 86.5 | 49% | 0.485 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -62.2 | -42.9 | 178.3 | -53.9 | 0 | 0 | 0 | 0 | 112.2 | S90 V91 I92 S97 N98 | S90-T94 WeakPolarHBondContact O-CB 3.35Å; S90-T94 PolarHBondContact O-N 3.37Å; S90-T94 PolarHBondContact O-OG1 3.22Å; V91-T94 PolarHBondContact O-N 3.33Å; I92-T94 VanDerWaalsContact C-N 3.32Å; I92-T94 PolarHBondContact O-N 2.93Å; T94-S97 PolarHBondContact O-N 3.25Å; T94-N98 VanDerWaalsContact O-CG 3.3Å; T94-N98 PolarHBondContact O-N 3.4Å; T94-N98 VanDerWaalsContact O-N 3.11Å; T94-N98 PolarHBondContact O-ND2 3.45Å |
| 95 | I | 88.4 | Confident | 87 | Confident | 58 Ų | 58 | 89.8 Ų | 89.8 | 30% | 0.297 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64.7 | -42 | 178.1 | -67.9 | 164.9 | 0 | 0 | 0 | 110.7 | V91 I92 S93 N98 R99 I106 L110 | V91-I95 HydrophobicContact CG1-CD1 3.7Å; V91-I95 HydrophobicContact CG1-CG1 4.38Å; V91-I95 VanDerWaalsContact O-CG1 3.25Å; V91-I95 WeakPolarHBondContact O-CG1 3.48Å; V91-I95 PolarHBondContact O-N 3.45Å; I92-I95 PolarHBondContact O-N 3.45Å; S93-I95 PolarHBondContact O-N 3.19Å; I95-N98 PolarHBondContact O-N 3.26Å; I95-R99 PolarHBondContact O-N 3.41Å; I95-I106 HydrophobicContact CG2-CG2 4.39Å; I95-L110 HydrophobicContact CB-CD1 4.35Å; I95-L110 HydrophobicContact CD1-CD1 4.4Å; I95-L110 HydrophobicContact CG2-CD1 4.01Å |
| 96 | L | 87.8 | Confident | 86.7 | Confident | 28 Ų | 28 | 88.7 Ų | 88.7 | 15% | 0.147 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -70 | -33.4 | 178.6 | -67.2 | 174.1 | 0 | 0 | 0 | 112.5 | I92 S93 I106 Q107 | I92-L96 HydrophobicContact CG2-CD1 3.73Å; I92-L96 HydrophobicContact CG2-CG 4.3Å; I92-L96 WeakPolarHBondContact O-CB 3.49Å; I92-L96 VanDerWaalsContact O-CG 3.26Å; I92-L96 WeakPolarHBondContact O-CG 3.36Å; I92-L96 PolarHBondContact O-N 3.47Å; S93-L96 PolarHBondContact O-N 2.89Å; L96-I106 HydrophobicContact CD2-CB 4.36Å; L96-I106 HydrophobicContact CD2-CG2 4.02Å; L96-Q107 HydrophobicContact CD1-CB 3.97Å; L96-Q107 HydrophobicContact CD1-CG 4.01Å; L96-Q107 HydrophobicContact CD2-CB 3.93Å |
| 97 | S | 85.5 | Confident | 86.5 | Confident | 95 Ų | 95 | 88.6 Ų | 88.6 | 66% | 0.664 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -67.5 | -35.8 | 173.6 | -63.6 | 0 | 0 | 0 | 0 | 112.5 | S93 T94 | S93-S97 WeakPolarHBondContact O-CB 3.49Å; S93-S97 PolarHBondContact O-N 3.4Å; S93-S97 PolarHBondContact O-OG 3.14Å; T94-S97 PolarHBondContact O-N 3.25Å |
| 98 | N | 84.4 | Confident | 86.5 | Confident | 129 Ų | 129 | 92 Ų | 92 | 69% | 0.69 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -80.7 | -14.6 | -177.3 | -72.7 | -18.2 | 0 | 0 | 0 | 114.4 | T94 I95 | T94-N98 VanDerWaalsContact O-CG 3.3Å; T94-N98 PolarHBondContact O-N 3.4Å; T94-N98 VanDerWaalsContact O-N 3.11Å; T94-N98 PolarHBondContact O-ND2 3.45Å; I95-N98 PolarHBondContact O-N 3.26Å |
| 99 | R | 79.1 | Confident | 86.5 | Confident | 152 Ų | 152 | 96 Ų | 96 | 57% | 0.574 | 48% | 0.481 | S | S | * | . | trans | -110.6 | 135.4 | -179.7 | -65.6 | -158.1 | -174.3 | -90.5 | 3.4 | 111.4 | I95 K103 | I95-R99 PolarHBondContact O-N 3.41Å; R99-K103 WeakPolarHBondContact O-CE 3.28Å | ||
| 100 | I | 67.3 | Low | 86.4 | Confident | 154 Ų | 154 | 94.6 Ų | 94.6 | 79% | 0.79 | 48% | 0.476 | S | S | * | . | trans | -96.3 | -25.4 | -175.4 | -59 | 171.9 | 0 | 0 | 0 | 112 | ||||
| 101 | K | 78.6 | Confident | 86.3 | Confident | 166 Ų | 166 | 94.3 Ų | 94.3 | 72% | 0.722 | 47% | 0.47 | S | S | * | . | S | Bend | trans | -113 | 153.7 | -178.6 | -61.4 | -177 | -179.7 | -176.6 | 0 | 111.6 | K103 | K101-K103 VanDerWaalsContact C-N 3.33Å; K101-K103 PolarHBondContact O-N 2.99Å |
| 102 | D | 79.1 | Confident | 86.4 | Confident | 108 Ų | 108 | 96.5 Ų | 96.5 | 58% | 0.578 | 47% | 0.473 | S | S | * | . | trans | 56.4 | 37.2 | 173.5 | -44.3 | -34.6 | 0 | 0 | 0 | 115 | E104 I106 | D102-E104 PolarHBondContact O-N 3.49Å; D102-I106 HydrophobicContact CB-CD1 4.47Å; D102-I106 WeakPolarHBondContact O-CB 3.44Å; D102-I106 WeakPolarHBondContact O-CD1 3.49Å; D102-I106 WeakPolarHBondContact O-CG1 3.41Å; D102-I106 PolarHBondContact O-N 2.73Å; D102-I106 VanDerWaalsContact O-N 3.16Å | ||
| 103 | K | 82.2 | Confident | 86.4 | Confident | 85 Ų | 85 | 100.7 Ų | 100.7 | 37% | 0.37 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.8 | -43 | -176.5 | -70.8 | 179.8 | 176.2 | 177.4 | 0 | 112.3 | R99 K101 Q107 | R99-K103 WeakPolarHBondContact O-CE 3.28Å; K101-K103 VanDerWaalsContact C-N 3.33Å; K101-K103 PolarHBondContact O-N 2.99Å; K103-Q107 WeakPolarHBondContact O-CB 3.29Å; K103-Q107 PolarHBondContact O-N 3.32Å |
| 104 | E | 85.7 | Confident | 86.5 | Confident | 145 Ų | 145 | 98.8 Ų | 98.8 | 68% | 0.678 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -64.3 | -45 | -177.4 | -77.9 | 65.9 | -149.8 | 0 | 0 | 112.5 | D102 Q107 Y108 | D102-E104 PolarHBondContact O-N 3.49Å; E104-Q107 PolarHBondContact O-N 3.41Å; E104-Y108 WeakPolarHBondContact O-CB 3.32Å; E104-Y108 PolarHBondContact O-N 3.48Å |
| 105 | E | 88 | Confident | 86.5 | Confident | 130 Ų | 130 | 99.6 Ų | 99.6 | 61% | 0.607 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -67.5 | -44.3 | 178.5 | -68.7 | -177.5 | 176 | 0 | 0 | 111.3 | Q107 Y108 H109 | E105-Q107 VanDerWaalsContact C-N 3.33Å; E105-Q107 PolarHBondContact O-N 3.48Å; E105-Y108 WeakPolarHBondContact O-CB 3.32Å; E105-Y108 PolarHBondContact O-N 3.23Å; E105-H109 PolarHBondContact O-CD2 3.31Å; E105-H109 PolarHBondContact O-N 2.92Å |
| 106 | I | 87.4 | Confident | 86.6 | Confident | 45 Ų | 45 | 104.2 Ų | 104.2 | 23% | 0.231 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -62.3 | -43.8 | 176.6 | -67.1 | 171.5 | 0 | 0 | 0 | 110.2 | I95 L96 D102 Y108 H109 L110 | I95-I106 HydrophobicContact CG2-CG2 4.39Å; L96-I106 HydrophobicContact CD2-CB 4.36Å; L96-I106 HydrophobicContact CD2-CG2 4.02Å; D102-I106 HydrophobicContact CB-CD1 4.47Å; D102-I106 WeakPolarHBondContact O-CB 3.44Å; D102-I106 WeakPolarHBondContact O-CD1 3.49Å; D102-I106 WeakPolarHBondContact O-CG1 3.41Å; D102-I106 PolarHBondContact O-N 2.73Å; D102-I106 VanDerWaalsContact O-N 3.16Å; I106-Y108 VanDerWaalsContact C-N 3.33Å; I106-Y108 PolarHBondContact O-N 3.42Å; I106-H109 PolarHBondContact O-N 2.88Å; I106-L110 HydrophobicContact CG2-CD1 3.63Å; I106-L110 HydrophobicContact CG2-CG 4.17Å; I106-L110 VanDerWaalsContact O-CB 3.26Å; I106-L110 WeakPolarHBondContact O-CB 3.37Å; I106-L110 WeakPolarHBondContact O-CG 3.18Å; I106-L110 PolarHBondContact O-N 2.91Å |
| 107 | Q | 88.7 | Confident | 86.7 | Confident | 86 Ų | 86 | 106.3 Ų | 106.3 | 40% | 0.402 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.7 | -41.2 | 176.2 | 179.3 | 173.3 | -17.4 | 0 | 0 | 111.6 | L96 K103 E104 E105 N111 | L96-Q107 HydrophobicContact CD1-CB 3.97Å; L96-Q107 HydrophobicContact CD1-CG 4.01Å; L96-Q107 HydrophobicContact CD2-CB 3.93Å; K103-Q107 WeakPolarHBondContact O-CB 3.29Å; K103-Q107 PolarHBondContact O-N 3.32Å; E104-Q107 PolarHBondContact O-N 3.41Å; E105-Q107 VanDerWaalsContact C-N 3.33Å; E105-Q107 PolarHBondContact O-N 3.48Å; Q107-N111 WeakPolarHBondContact CG-ND2 3.32Å; Q107-N111 VanDerWaalsContact O-CB 3.26Å; Q107-N111 WeakPolarHBondContact O-CB 3.39Å; Q107-N111 PolarHBondContact O-N 3.18Å; Q107-N111 PolarHBondContact O-ND2 3.07Å |
| 108 | Y | 92.4 | Very high | 86.8 | Confident | 157 Ų | 157 | 103.1 Ų | 103.1 | 62% | 0.616 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -60.8 | -51.2 | 176 | 177.4 | -96.1 | 0 | 0 | 0 | 111.5 | E104 E105 I106 L110 N111 F112 | E104-Y108 WeakPolarHBondContact O-CB 3.32Å; E104-Y108 PolarHBondContact O-N 3.48Å; E105-Y108 WeakPolarHBondContact O-CB 3.32Å; E105-Y108 PolarHBondContact O-N 3.23Å; I106-Y108 VanDerWaalsContact C-N 3.33Å; I106-Y108 PolarHBondContact O-N 3.42Å; Y108-L110 PolarHBondContact O-N 3.3Å; Y108-N111 PolarHBondContact O-N 2.95Å; Y108-F112 WeakPolarHBondContact O-CB 3.44Å; Y108-F112 PolarHBondContact O-N 3.37Å |
| 109 | H | 90.9 | Very high | 87 | Confident | 119 Ų | 119 | 103.2 Ų | 103.2 | 55% | 0.551 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -64.1 | -40.3 | 179.8 | -71.4 | -58.8 | 0 | 0 | 0 | 112.9 | E105 I106 F112 L113 | E105-H109 PolarHBondContact O-CD2 3.31Å; E105-H109 PolarHBondContact O-N 2.92Å; I106-H109 PolarHBondContact O-N 2.88Å; H109-F112 PolarHBondContact O-N 3.43Å; H109-L113 WeakPolarHBondContact O-CB 3.41Å; H109-L113 PolarHBondContact O-N 3.22Å |
| 110 | L | 91.2 | Very high | 87.3 | Confident | 38 Ų | 38 | 100.7 Ų | 100.7 | 20% | 0.199 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -67 | -41 | 177.2 | -73.6 | 176.8 | 0 | 0 | 0 | 112.1 | I92 I95 I106 Y108 L113 K114 | I92-L110 HydrophobicContact CD1-CB 4.14Å; I92-L110 HydrophobicContact CG1-CB 3.99Å; I92-L110 HydrophobicContact CG1-CD1 4.3Å; I92-L110 HydrophobicContact CG2-CB 4.29Å; I92-L110 HydrophobicContact CG2-CD1 4.14Å; I95-L110 HydrophobicContact CB-CD1 4.35Å; I95-L110 HydrophobicContact CD1-CD1 4.4Å; I95-L110 HydrophobicContact CG2-CD1 4.01Å; I106-L110 HydrophobicContact CG2-CD1 3.63Å; I106-L110 HydrophobicContact CG2-CG 4.17Å; I106-L110 VanDerWaalsContact O-CB 3.26Å; I106-L110 WeakPolarHBondContact O-CB 3.37Å; I106-L110 WeakPolarHBondContact O-CG 3.18Å; I106-L110 PolarHBondContact O-N 2.91Å; Y108-L110 PolarHBondContact O-N 3.3Å; L110-L113 PolarHBondContact O-N 3.43Å; L110-K114 WeakPolarHBondContact O-CB 3.46Å; L110-K114 PolarHBondContact O-N 2.69Å |
| 111 | N | 91.9 | Very high | 88.1 | Confident | 47 Ų | 47 | 94 Ų | 94 | 25% | 0.251 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -68.2 | -36.7 | 175.4 | -80.6 | -43.5 | 0 | 0 | 0 | 112.3 | Q107 Y108 L113 K114 N115 | Q107-N111 WeakPolarHBondContact CG-ND2 3.32Å; Q107-N111 VanDerWaalsContact O-CB 3.26Å; Q107-N111 WeakPolarHBondContact O-CB 3.39Å; Q107-N111 PolarHBondContact O-N 3.18Å; Q107-N111 PolarHBondContact O-ND2 3.07Å; Y108-N111 PolarHBondContact O-N 2.95Å; N111-L113 VanDerWaalsContact C-N 3.35Å; N111-K114 WeakPolarHBondContact O-CB 3.49Å; N111-K114 PolarHBondContact O-N 3.33Å; N111-N115 WeakPolarHBondContact O-CB 3.3Å; N111-N115 VanDerWaalsContact O-CG 3.24Å; N111-N115 PolarHBondContact O-N 3.16Å; N111-N115 PolarHBondContact O-ND2 3.09Å |
| 112 | F | 92.6 | Very high | 88.3 | Confident | 120 Ų | 120 | 91.7 Ų | 91.7 | 53% | 0.526 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -61.3 | -45.2 | 173 | -178.2 | -98.1 | 0 | 0 | 0 | 111.4 | Y108 H109 N115 R116 | Y108-F112 WeakPolarHBondContact O-CB 3.44Å; Y108-F112 PolarHBondContact O-N 3.37Å; H109-F112 PolarHBondContact O-N 3.43Å; F112-N115 PolarHBondContact O-N 3.33Å; F112-R116 WeakPolarHBondContact O-CB 3.39Å; F112-R116 PolarHBondContact O-N 3.09Å |
| 113 | L | 91.4 | Very high | 88.5 | Confident | 106 Ų | 106 | 91.6 Ų | 91.6 | 56% | 0.555 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -63 | -43.4 | 175.8 | -176.2 | 62.3 | 0 | 0 | 0 | 111.8 | H109 L110 N111 R116 L117 | H109-L113 WeakPolarHBondContact O-CB 3.41Å; H109-L113 PolarHBondContact O-N 3.22Å; L110-L113 PolarHBondContact O-N 3.43Å; N111-L113 VanDerWaalsContact C-N 3.35Å; L113-R116 PolarHBondContact O-N 2.73Å; L113-L117 WeakPolarHBondContact O-CB 3.44Å; L113-L117 PolarHBondContact O-N 3.31Å |
| 114 | K | 92.1 | Very high | 88.5 | Confident | 28 Ų | 28 | 91.9 Ų | 91.9 | 12% | 0.122 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -53.6 | -55.2 | 174.1 | -174.9 | -174.4 | 80.9 | 171.4 | 0 | 110.7 | M88 E89 I92 L110 N111 R116 L117 L118 | M88-K114 HydrophobicContact CB-CD 4.49Å; M88-K114 HydrophobicContact CB-CG 4.24Å; M88-K114 HydrophobicContact SD-CG 4.18Å; E89-K114 HydrophobicContact CG-CD 4.03Å; E89-K114 IonicContact OE1-NZ 2.84Å; E89-K114 PolarHBondContact OE1-NZ 2.98Å; I92-K114 HydrophobicContact CD1-CB 4.15Å; I92-K114 HydrophobicContact CD1-CD 4.15Å; L110-K114 WeakPolarHBondContact O-CB 3.46Å; L110-K114 PolarHBondContact O-N 2.69Å; N111-K114 WeakPolarHBondContact O-CB 3.49Å; N111-K114 PolarHBondContact O-N 3.33Å; K114-R116 PolarHBondContact O-N 2.96Å; K114-L117 PolarHBondContact O-N 2.84Å; K114-L118 HydrophobicContact CD-CD1 4.49Å; K114-L118 HydrophobicContact CG-CD1 3.97Å; K114-L118 HydrophobicContact CG-CG 4.45Å; K114-L118 VanDerWaalsContact O-CG 3.32Å; K114-L118 WeakPolarHBondContact O-CG 3.43Å; K114-L118 PolarHBondContact O-N 2.78Å |
| 115 | N | 91.6 | Very high | 88.4 | Confident | 96 Ų | 96 | 90.8 Ų | 90.8 | 51% | 0.513 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62.3 | -42.4 | -176.7 | -68.5 | -15.3 | 0 | 0 | 0 | 111.9 | N111 F112 L117 L118 Q119 | N111-N115 WeakPolarHBondContact O-CB 3.3Å; N111-N115 VanDerWaalsContact O-CG 3.24Å; N111-N115 PolarHBondContact O-N 3.16Å; N111-N115 PolarHBondContact O-ND2 3.09Å; F112-N115 PolarHBondContact O-N 3.33Å; N115-L117 VanDerWaalsContact C-N 3.35Å; N115-L117 PolarHBondContact O-N 3.42Å; N115-L118 PolarHBondContact O-N 2.96Å; N115-Q119 WeakPolarHBondContact O-CB 3.34Å; N115-Q119 PolarHBondContact O-N 3.26Å |
| 116 | R | 91.6 | Very high | 88 | Confident | 155 Ų | 155 | 87 Ų | 87 | 59% | 0.585 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -61.6 | -42.8 | 175.8 | -178.1 | 177.1 | 177.9 | 178.2 | 0.3 | 112.1 | F112 L113 K114 Q119 L120 | F112-R116 WeakPolarHBondContact O-CB 3.39Å; F112-R116 PolarHBondContact O-N 3.09Å; L113-R116 PolarHBondContact O-N 2.73Å; K114-R116 PolarHBondContact O-N 2.96Å; R116-Q119 PolarHBondContact O-N 3.19Å; R116-L120 WeakPolarHBondContact O-CG 3.3Å; R116-L120 PolarHBondContact O-N 2.66Å; R116-L120 VanDerWaalsContact O-N 3.17Å |
| 117 | L | 88.6 | Confident | 87.5 | Confident | 72 Ų | 72 | 88.1 Ų | 88.1 | 38% | 0.377 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -68.2 | -42.1 | 179.4 | -176.4 | 58.5 | 0 | 0 | 0 | 111.4 | M88 L113 K114 N115 Q119 L120 C121 | M88-L117 HydrophobicContact CE-CD2 3.31Å; M88-L117 HydrophobicContact CE-CG 3.91Å; M88-L117 HydrophobicContact SD-CD2 3.81Å; M88-L117 HydrophobicContact SD-CG 4.43Å; L113-L117 WeakPolarHBondContact O-CB 3.44Å; L113-L117 PolarHBondContact O-N 3.31Å; K114-L117 PolarHBondContact O-N 2.84Å; N115-L117 VanDerWaalsContact C-N 3.35Å; N115-L117 PolarHBondContact O-N 3.42Å; L117-Q119 VanDerWaalsContact C-N 3.32Å; L117-Q119 PolarHBondContact O-N 3.34Å; L117-L120 WeakPolarHBondContact O-CB 3.5Å; L117-L120 PolarHBondContact O-N 2.73Å; L117-L120 VanDerWaalsContact O-N 3.16Å; L117-C121 PolarHBondContact O-N 2.9Å; L117-C121 PolarHBondContact O-SG 2.9Å |
| 118 | L | 88.3 | Confident | 86.7 | Confident | 28 Ų | 28 | 87.6 Ų | 87.6 | 15% | 0.147 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -59 | -43.4 | 175.3 | -71.2 | 173.6 | 0 | 0 | 0 | 111.5 | Q85 K114 N115 L120 C121 E122 | Q85-L118 HydrophobicContact CB-CD2 4.13Å; Q85-L118 HydrophobicContact CG-CD1 4.3Å; K114-L118 HydrophobicContact CD-CD1 4.49Å; K114-L118 HydrophobicContact CG-CD1 3.97Å; K114-L118 HydrophobicContact CG-CG 4.45Å; K114-L118 VanDerWaalsContact O-CG 3.32Å; K114-L118 WeakPolarHBondContact O-CG 3.43Å; K114-L118 PolarHBondContact O-N 2.78Å; N115-L118 PolarHBondContact O-N 2.96Å; L118-L120 VanDerWaalsContact C-N 3.32Å; L118-L120 PolarHBondContact O-N 3.38Å; L118-C121 CarbonylContact O-C 3.45Å; L118-C121 WeakPolarHBondContact O-CA 3.27Å; L118-C121 WeakPolarHBondContact O-CB 3.45Å; L118-C121 PolarHBondContact O-N 3.47Å; L118-C121 VanDerWaalsContact O-N 3.07Å; L118-E122 WeakPolarHBondContact O-CG 3.32Å; L118-E122 PolarHBondContact O-N 3.44Å |
| 119 | Q | 87.9 | Confident | 85.6 | Confident | 130 Ų | 130 | 88.1 Ų | 88.1 | 61% | 0.607 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -61.7 | -38.1 | 176.3 | -168.1 | 179.5 | 9.4 | 0 | 0 | 112.6 | N115 R116 L117 E122 | N115-Q119 WeakPolarHBondContact O-CB 3.34Å; N115-Q119 PolarHBondContact O-N 3.26Å; R116-Q119 PolarHBondContact O-N 3.19Å; L117-Q119 VanDerWaalsContact C-N 3.32Å; L117-Q119 PolarHBondContact O-N 3.34Å; Q119-E122 PolarHBondContact O-N 3.11Å |
| 120 | L | 86.6 | Confident | 84.5 | Confident | 100 Ų | 100 | 90.1 Ų | 90.1 | 52% | 0.524 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -66.8 | -39.6 | 172.6 | -69.4 | 173.2 | 0 | 0 | 0 | 111.5 | R116 L117 L118 E122 T123 L124 | R116-L120 WeakPolarHBondContact O-CG 3.3Å; R116-L120 PolarHBondContact O-N 2.66Å; R116-L120 VanDerWaalsContact O-N 3.17Å; L117-L120 WeakPolarHBondContact O-CB 3.5Å; L117-L120 PolarHBondContact O-N 2.73Å; L117-L120 VanDerWaalsContact O-N 3.16Å; L118-L120 VanDerWaalsContact C-N 3.32Å; L118-L120 PolarHBondContact O-N 3.38Å; L120-E122 VanDerWaalsContact C-N 3.27Å; L120-E122 PolarHBondContact O-N 2.84Å; L120-T123 PolarHBondContact O-N 2.82Å; L120-T123 PolarHBondContact O-OG1 2.99Å; L120-T123 VanDerWaalsContact O-OG1 3.1Å; L120-L124 WeakPolarHBondContact O-CB 3.37Å; L120-L124 PolarHBondContact O-N 3.39Å |
| 121 | C | 83.6 | Confident | 83.2 | Confident | 14 Ų | 14 | 95.6 Ų | 95.6 | 10% | 0.095 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -64.7 | -27.5 | 176.5 | -70.4 | 0 | 0 | 0 | 0 | 113.4 | L76 L117 L118 | L76-C121 HydrophobicContact CD2-CB 4.05Å; L117-C121 PolarHBondContact O-N 2.9Å; L117-C121 PolarHBondContact O-SG 2.9Å; L118-C121 CarbonylContact O-C 3.45Å; L118-C121 WeakPolarHBondContact O-CA 3.27Å; L118-C121 WeakPolarHBondContact O-CB 3.45Å; L118-C121 PolarHBondContact O-N 3.47Å; L118-C121 VanDerWaalsContact O-N 3.07Å |
| 122 | E | 82.7 | Confident | 82.2 | Confident | 116 Ų | 116 | 100.2 Ų | 100.2 | 54% | 0.542 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -69.4 | -38 | 174.4 | -71.1 | -178.6 | 161.5 | 0 | 0 | 113.1 | R81 L118 Q119 L120 | R81-E122 IonicContact NH1-OE1 3.42Å; L118-E122 WeakPolarHBondContact O-CG 3.32Å; L118-E122 PolarHBondContact O-N 3.44Å; Q119-E122 PolarHBondContact O-N 3.11Å; L120-E122 VanDerWaalsContact C-N 3.27Å; L120-E122 PolarHBondContact O-N 2.84Å |
| 123 | T | 82.6 | Confident | 81.1 | Confident | 106 Ų | 106 | 99.7 Ų | 99.7 | 65% | 0.65 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -86.2 | -12.2 | 179.1 | 60.1 | 0 | 0 | 0 | 0 | 112.8 | L120 K125 | L120-T123 PolarHBondContact O-N 2.82Å; L120-T123 PolarHBondContact O-OG1 2.99Å; L120-T123 VanDerWaalsContact O-OG1 3.1Å; T123-K125 PolarHBondContact O-N 2.78Å |
| 124 | L | 83.3 | Confident | 80.2 | Confident | 91 Ų | 91 | 99.7 Ų | 99.7 | 48% | 0.476 | 50% | 0.496 | S | S | . | . | trans | -71.9 | 115 | -179.5 | -172.1 | 65.1 | 0 | 0 | 0 | 111 | L76 L120 V126 | L76-L124 PolarHBondContact N-O 3.46Å; L120-L124 WeakPolarHBondContact O-CB 3.37Å; L120-L124 PolarHBondContact O-N 3.39Å; L124-V126 HydrophobicContact CD2-CG2 4.2Å; L124-V126 HydrophobicContact CG-CG2 4.05Å | ||
| 125 | K | 82.8 | Confident | 79.6 | Confident | 122 Ų | 122 | 102.5 Ų | 102.5 | 53% | 0.53 | 52% | 0.515 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86 | 135.4 | 168.3 | -60.2 | -173.9 | -179.3 | -175.4 | 0 | 108.8 | W73 T123 | W73-K125 HydrophobicContact CB-CB 3.84Å; W73-K125 HydrophobicContact CE3-CB 4.22Å; W73-K125 WeakPolarHBondContact CZ3-O 3.23Å; T123-K125 PolarHBondContact O-N 2.78Å |
| 126 | V | 79.2 | Confident | 79.2 | Confident | 51 Ų | 51 | 101.1 Ų | 101.1 | 31% | 0.309 | 51% | 0.508 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.3 | 144.8 | -177.6 | -175 | 0 | 0 | 0 | 0 | 108.9 | W73 Q74 L76 L124 | W73-V126 CarbonylContact C-O 3.58Å; W73-V126 WeakPolarHBondContact CA-O 3.34Å; W73-V126 WeakPolarHBondContact CB-O 3.37Å; Q74-V126 PolarHBondContact N-O 3.29Å; Q74-V126 PolarHBondContact O-N 3.3Å; L76-V126 HydrophobicContact CD1-CG2 4.16Å; L124-V126 HydrophobicContact CD2-CG2 4.2Å; L124-V126 HydrophobicContact CG-CG2 4.05Å |
| 127 | P | 78.4 | Confident | 79 | Confident | 68 Ų | 68 | 98.1 Ų | 98.1 | 44% | 0.442 | 51% | 0.506 | S | S | . | . | P | Polyproline II helix | trans | -51.9 | 139.3 | 170.5 | -24.4 | 31 | 0 | 0 | 0 | 111.6 | W73 K129 | W73-P127 HydrophobicContact CD2-CG 4.12Å; W73-P127 HydrophobicContact CH2-CG 4.02Å; W73-P127 HydrophobicContact CZ2-CG 3.58Å; W73-P127 HydrophobicContact CZ3-CG 4.48Å; P127-K129 PolarHBondContact O-N 3.34Å |
| 128 | P | 71.1 | Confident | 79 | Confident | 75 Ų | 75 | 97.4 Ų | 97.4 | 49% | 0.487 | 51% | 0.507 | S | S | . | . | P | Polyproline II helix | trans | -62 | 127 | 177.2 | 24.9 | -32.1 | 0 | 0 | 0 | 110.1 | T72 K130 | T72-P128 WeakPolarHBondContact O-CD 3.47Å; P128-K130 PolarHBondContact O-N 3.5Å |
| 129 | K | 69.4 | Low | 79.1 | Confident | 168 Ų | 168 | 104.3 Ų | 104.3 | 73% | 0.73 | 53% | 0.531 | S | S | * | . | P | Polyproline II helix | trans | -70.4 | 126.7 | 179.7 | -167.3 | 174.7 | -177.3 | 179.4 | 0 | 109.3 | P127 M131 | P127-K129 PolarHBondContact O-N 3.34Å; K129-M131 PolarHBondContact O-N 2.93Å |
| 130 | K | 66.8 | Low | 79.3 | Confident | 162 Ų | 162 | 102.5 Ų | 102.5 | 70% | 0.704 | 53% | 0.525 | S | S | * | . | trans | -69.8 | 109 | 169.2 | -63.9 | -175.3 | 179.4 | -174.7 | 0 | 107.6 | P128 E132 | P128-K130 PolarHBondContact O-N 3.5Å; K130-E132 PolarHBondContact O-N 3.38Å | ||
| 131 | M | 64.8 | Low | 79.6 | Confident | 152 Ų | 152 | 102.5 Ų | 102.5 | 75% | 0.749 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.9 | -13.8 | -175.5 | -62.9 | -155.7 | -156 | 0 | 0 | 113.7 | K129 D133 L134 T135 | K129-M131 PolarHBondContact O-N 2.93Å; M131-D133 VanDerWaalsContact C-N 3.26Å; M131-D133 PolarHBondContact O-N 3.01Å; M131-L134 WeakPolarHBondContact O-CB 3.26Å; M131-L134 PolarHBondContact O-N 3.29Å; M131-T135 PolarHBondContact O-N 2.86Å; M131-T135 PolarHBondContact O-OG1 3.19Å |
| 132 | E | 70.3 | Confident | 80.1 | Confident | 144 Ų | 144 | 106.4 Ų | 106.4 | 67% | 0.673 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -56.1 | -38.7 | -178.6 | -165.8 | 168.7 | -170 | 0 | 0 | 112.7 | K130 L134 T135 N136 | K130-E132 PolarHBondContact O-N 3.38Å; E132-L134 VanDerWaalsContact C-N 3.29Å; E132-L134 PolarHBondContact O-N 2.9Å; E132-T135 WeakPolarHBondContact CA-OG1 3.39Å; E132-T135 PolarHBondContact O-N 2.97Å; E132-T135 PolarHBondContact O-OG1 3.36Å; E132-N136 PolarHBondContact O-N 2.63Å; E132-N136 PolarHBondContact O-ND2 2.94Å; E132-N136 VanDerWaalsContact O-ND2 3.15Å |
| 133 | D | 69.4 | Low | 80.7 | Confident | 110 Ų | 110 | 105.4 Ų | 105.4 | 59% | 0.588 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -64.1 | -32.8 | 177.2 | -63 | -29.6 | 0 | 0 | 0 | 112.5 | M131 N136 V137 | M131-D133 VanDerWaalsContact C-N 3.26Å; M131-D133 PolarHBondContact O-N 3.01Å; D133-N136 PolarHBondContact O-N 3.49Å; D133-V137 WeakPolarHBondContact O-CG2 3.27Å; D133-V137 PolarHBondContact O-N 2.87Å |
| 134 | L | 73.9 | Confident | 81.2 | Confident | 106 Ų | 106 | 104.2 Ų | 104.2 | 56% | 0.555 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -76.5 | -37.3 | -178.7 | -171.3 | 63.1 | 0 | 0 | 0 | 112 | M131 E132 N136 V137 S138 | M131-L134 WeakPolarHBondContact O-CB 3.26Å; M131-L134 PolarHBondContact O-N 3.29Å; E132-L134 VanDerWaalsContact C-N 3.29Å; E132-L134 PolarHBondContact O-N 2.9Å; L134-N136 VanDerWaalsContact C-N 3.25Å; L134-N136 PolarHBondContact O-N 2.98Å; L134-V137 PolarHBondContact O-N 3.42Å; L134-S138 PolarHBondContact O-N 3.28Å |
| 135 | T | 78 | Confident | 81.8 | Confident | 86 Ų | 86 | 107.1 Ų | 107.1 | 53% | 0.528 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.2 | -32.9 | 171.1 | 20.8 | 0 | 0 | 0 | 0 | 112.5 | M131 E132 S138 R139 | M131-T135 PolarHBondContact O-N 2.86Å; M131-T135 PolarHBondContact O-OG1 3.19Å; E132-T135 WeakPolarHBondContact CA-OG1 3.39Å; E132-T135 PolarHBondContact O-N 2.97Å; E132-T135 PolarHBondContact O-OG1 3.36Å; T135-S138 PolarHBondContact O-OG 2.94Å; T135-R139 WeakPolarHBondContact O-CB 3.32Å; T135-R139 PolarHBondContact O-N 3.48Å |
| 136 | N | 84.1 | Confident | 82.5 | Confident | 68 Ų | 68 | 104.1 Ų | 104.1 | 36% | 0.364 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.4 | -39.4 | 173.6 | -71.2 | -38.8 | 0 | 0 | 0 | 111.8 | E132 D133 L134 L140 | E132-N136 PolarHBondContact O-N 2.63Å; E132-N136 PolarHBondContact O-ND2 2.94Å; E132-N136 VanDerWaalsContact O-ND2 3.15Å; D133-N136 PolarHBondContact O-N 3.49Å; L134-N136 VanDerWaalsContact C-N 3.25Å; L134-N136 PolarHBondContact O-N 2.98Å; N136-L140 WeakPolarHBondContact O-CB 3.39Å; N136-L140 PolarHBondContact O-N 3.22Å |
| 137 | V | 87.8 | Confident | 83.2 | Confident | 91 Ų | 91 | 107.1 Ų | 107.1 | 55% | 0.552 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -67.1 | -43.1 | 176.7 | 175.2 | 0 | 0 | 0 | 0 | 111.7 | D133 L134 L140 L141 | D133-V137 WeakPolarHBondContact O-CG2 3.27Å; D133-V137 PolarHBondContact O-N 2.87Å; L134-V137 PolarHBondContact O-N 3.42Å; V137-L140 PolarHBondContact O-N 3.38Å; V137-L141 PolarHBondContact O-N 2.57Å |
| 138 | S | 87.6 | Confident | 84.1 | Confident | 57 Ų | 57 | 105.7 Ų | 105.7 | 40% | 0.399 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.5 | -38.6 | 178.1 | 65.3 | 0 | 0 | 0 | 0 | 112.4 | L134 T135 L141 N142 | L134-S138 PolarHBondContact O-N 3.28Å; T135-S138 PolarHBondContact O-OG 2.94Å; S138-L141 PolarHBondContact O-N 3.44Å; S138-N142 PolarHBondContact O-N 3.34Å; S138-N142 PolarHBondContact O-ND2 2.95Å |
| 139 | R | 90.6 | Very high | 85.3 | Confident | 174 Ų | 174 | 107.9 Ų | 107.9 | 66% | 0.657 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -61.3 | -45 | 172.8 | -174.9 | 179.5 | 68 | 178.5 | -1.6 | 111.6 | T135 N142 M143 | T135-R139 WeakPolarHBondContact O-CB 3.32Å; T135-R139 PolarHBondContact O-N 3.48Å; R139-N142 PolarHBondContact O-N 3.05Å; R139-M143 PolarHBondContact O-N 2.94Å |
| 140 | L | 92.5 | Very high | 86.6 | Confident | 91 Ų | 91 | 102.6 Ų | 102.6 | 48% | 0.476 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.7 | -46.1 | 177.1 | -179.5 | 59.8 | 0 | 0 | 0 | 111.1 | N136 V137 N142 M143 E144 | N136-L140 WeakPolarHBondContact O-CB 3.39Å; N136-L140 PolarHBondContact O-N 3.22Å; V137-L140 PolarHBondContact O-N 3.38Å; L140-N142 VanDerWaalsContact C-N 3.34Å; L140-N142 PolarHBondContact O-N 2.85Å; L140-M143 HydrophobicContact CD1-CE 3.59Å; L140-M143 PolarHBondContact O-N 3.4Å; L140-E144 HydrophobicContact CD1-CG 4.38Å; L140-E144 WeakPolarHBondContact O-CG 3.3Å; L140-E144 PolarHBondContact O-N 3.26Å |
| 141 | L | 93.2 | Very high | 88 | Confident | 100 Ų | 100 | 99.4 Ų | 99.4 | 52% | 0.524 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -58.5 | -44 | 177.8 | -178.9 | 66.5 | 0 | 0 | 0 | 112.4 | V137 S138 E144 R145 | V137-L141 PolarHBondContact O-N 2.57Å; S138-L141 PolarHBondContact O-N 3.44Å; L141-E144 PolarHBondContact O-N 3.38Å; L141-R145 WeakPolarHBondContact O-CB 3.49Å; L141-R145 PolarHBondContact O-N 3.37Å |
| 142 | N | 94.1 | Very high | 89.5 | Confident | 96 Ų | 96 | 98.7 Ų | 98.7 | 51% | 0.513 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67 | -38.4 | 178.7 | -71.7 | -23.8 | 0 | 0 | 0 | 112.2 | S138 R139 L140 R145 A146 | S138-N142 PolarHBondContact O-N 3.34Å; S138-N142 PolarHBondContact O-ND2 2.95Å; R139-N142 PolarHBondContact O-N 3.05Å; L140-N142 VanDerWaalsContact C-N 3.34Å; L140-N142 PolarHBondContact O-N 2.85Å; N142-R145 PolarHBondContact O-N 2.87Å; N142-A146 PolarHBondContact O-N 3.41Å |
| 143 | M | 94.8 | Very high | 90.7 | Very high | 95 Ų | 95 | 98.1 Ų | 98.1 | 47% | 0.468 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.1 | -44.4 | 174.8 | -175.3 | -178.8 | 65.4 | 0 | 0 | 111.5 | R139 L140 R145 A146 R147 | R139-M143 PolarHBondContact O-N 2.94Å; L140-M143 HydrophobicContact CD1-CE 3.59Å; L140-M143 PolarHBondContact O-N 3.4Å; M143-R145 VanDerWaalsContact C-N 3.34Å; M143-R145 PolarHBondContact O-N 3.18Å; M143-A146 PolarHBondContact O-N 2.71Å; M143-R147 PolarHBondContact O-N 2.96Å |
| 144 | E | 93.9 | Very high | 92 | Very high | 81 Ų | 81 | 94.3 Ų | 94.3 | 38% | 0.379 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.3 | -40.1 | 175.8 | -70.7 | -53.3 | 140.5 | 0 | 0 | 111.7 | L140 L141 A146 R147 G148 | L140-E144 HydrophobicContact CD1-CG 4.38Å; L140-E144 WeakPolarHBondContact O-CG 3.3Å; L140-E144 PolarHBondContact O-N 3.26Å; L141-E144 PolarHBondContact O-N 3.38Å; E144-A146 PolarHBondContact O-N 3.39Å; E144-R147 PolarHBondContact O-N 3.34Å; E144-R147 IonicContact OE1-CZ 3.52Å; E144-R147 IonicContact OE1-NH1 2.98Å; E144-R147 PolarHBondContact OE1-NH1 2.76Å; E144-R147 IonicContact OE1-NH2 3.74Å; E144-R147 IonicContact OE2-CZ 3.74Å; E144-R147 IonicContact OE2-NH1 3.17Å; E144-R147 PolarHBondContact OE2-NH1 3.3Å; E144-G148 PolarHBondContact O-N 2.87Å |
| 145 | R | 95.8 | Very high | 93.1 | Very high | 153 Ų | 153 | 94.9 Ų | 94.9 | 58% | 0.577 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.2 | -41.9 | 175.5 | -173 | -179.3 | -70.3 | 174.5 | -3.6 | 112.1 | L141 N142 M143 G148 K149 | L141-R145 WeakPolarHBondContact O-CB 3.49Å; L141-R145 PolarHBondContact O-N 3.37Å; N142-R145 PolarHBondContact O-N 2.87Å; M143-R145 VanDerWaalsContact C-N 3.34Å; M143-R145 PolarHBondContact O-N 3.18Å; R145-G148 PolarHBondContact O-N 3.46Å; R145-K149 WeakPolarHBondContact O-CG 3.41Å; R145-K149 PolarHBondContact O-N 3.24Å; R145-K149 VanDerWaalsContact O-N 3.1Å |
| 146 | A | 96.3 | Very high | 94 | Very high | 59 Ų | 59 | 93.7 Ų | 93.7 | 49% | 0.488 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.2 | -42.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | N142 M143 E144 G148 K149 A150 | N142-A146 PolarHBondContact O-N 3.41Å; M143-A146 PolarHBondContact O-N 2.71Å; E144-A146 PolarHBondContact O-N 3.39Å; A146-G148 VanDerWaalsContact C-N 3.35Å; A146-K149 PolarHBondContact O-N 2.91Å; A146-A150 PolarHBondContact O-N 3.44Å; A146-A150 VanDerWaalsContact O-N 3.11Å |
| 147 | R | 95.6 | Very high | 94.6 | Very high | 114 Ų | 114 | 95.9 Ų | 95.9 | 43% | 0.43 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.5 | -43 | 173.6 | -171.5 | -174.9 | -61.2 | 145 | 5.5 | 111.8 | M143 E144 K149 A150 N151 | M143-R147 PolarHBondContact O-N 2.96Å; E144-R147 PolarHBondContact O-N 3.34Å; E144-R147 IonicContact OE1-CZ 3.52Å; E144-R147 IonicContact OE1-NH1 2.98Å; E144-R147 PolarHBondContact OE1-NH1 2.76Å; E144-R147 IonicContact OE1-NH2 3.74Å; E144-R147 IonicContact OE2-CZ 3.74Å; E144-R147 IonicContact OE2-NH1 3.17Å; E144-R147 PolarHBondContact OE2-NH1 3.3Å; R147-K149 VanDerWaalsContact C-N 3.32Å; R147-K149 PolarHBondContact O-N 3.49Å; R147-A150 PolarHBondContact O-N 3.01Å; R147-N151 WeakPolarHBondContact O-CB 3.48Å; R147-N151 PolarHBondContact O-N 3Å; R147-N151 PolarHBondContact O-OD1 3.3Å |
| 148 | G | 95.9 | Very high | 95.1 | Very high | 37 Ų | 37 | 96.9 Ų | 96.9 | 38% | 0.381 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -56.4 | -45.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | E144 R145 A146 N151 E152 | E144-G148 PolarHBondContact O-N 2.87Å; R145-G148 PolarHBondContact O-N 3.46Å; A146-G148 VanDerWaalsContact C-N 3.35Å; G148-N151 PolarHBondContact O-N 2.94Å; G148-E152 PolarHBondContact O-N 3.48Å |
| 149 | K | 96.6 | Very high | 95.6 | Very high | 122 Ų | 122 | 99 Ų | 99 | 53% | 0.53 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.1 | -47.6 | 176.7 | -69.7 | -178.7 | 176.6 | -165.2 | 0 | 112.9 | R145 A146 R147 N151 E152 E153 | R145-K149 WeakPolarHBondContact O-CG 3.41Å; R145-K149 PolarHBondContact O-N 3.24Å; R145-K149 VanDerWaalsContact O-N 3.1Å; A146-K149 PolarHBondContact O-N 2.91Å; R147-K149 VanDerWaalsContact C-N 3.32Å; R147-K149 PolarHBondContact O-N 3.49Å; K149-N151 PolarHBondContact O-N 3.35Å; K149-E152 WeakPolarHBondContact O-CB 3.49Å; K149-E152 PolarHBondContact O-N 3.05Å; K149-E152 VanDerWaalsContact O-N 3.15Å; K149-E153 WeakPolarHBondContact O-CG 3.46Å; K149-E153 PolarHBondContact O-N 3.39Å |
| 150 | A | 96.2 | Very high | 95.9 | Very high | 56 Ų | 56 | 95.2 Ų | 95.2 | 46% | 0.463 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.6 | -36 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A146 R147 G154 | A146-A150 PolarHBondContact O-N 3.44Å; A146-A150 VanDerWaalsContact O-N 3.11Å; R147-A150 PolarHBondContact O-N 3.01Å; A150-G154 PolarHBondContact O-N 3.44Å |
| 151 | N | 96.3 | Very high | 96.1 | Very high | 96 Ų | 96 | 95.8 Ų | 95.8 | 51% | 0.513 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.5 | -40.5 | 175.1 | -69.9 | -6 | 0 | 0 | 0 | 111.9 | R147 G148 K149 G154 L155 | R147-N151 WeakPolarHBondContact O-CB 3.48Å; R147-N151 PolarHBondContact O-N 3Å; R147-N151 PolarHBondContact O-OD1 3.3Å; G148-N151 PolarHBondContact O-N 2.94Å; K149-N151 PolarHBondContact O-N 3.35Å; N151-G154 PolarHBondContact O-N 2.91Å; N151-L155 WeakPolarHBondContact O-CB 3.33Å; N151-L155 VanDerWaalsContact O-CG 3.32Å; N151-L155 WeakPolarHBondContact O-CG 3.4Å; N151-L155 PolarHBondContact O-N 3.41Å |
| 152 | E | 96.4 | Very high | 96.3 | Very high | 137 Ų | 137 | 95.2 Ų | 95.2 | 64% | 0.64 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.7 | -45.2 | 176.4 | -174 | 176.4 | -172.7 | 0 | 0 | 111.5 | G148 K149 G154 L155 A156 | G148-E152 PolarHBondContact O-N 3.48Å; K149-E152 WeakPolarHBondContact O-CB 3.49Å; K149-E152 PolarHBondContact O-N 3.05Å; K149-E152 VanDerWaalsContact O-N 3.15Å; E152-G154 VanDerWaalsContact C-N 3.33Å; E152-G154 PolarHBondContact O-N 2.98Å; E152-L155 PolarHBondContact O-N 2.95Å; E152-A156 PolarHBondContact O-N 2.86Å |
| 153 | E | 95.9 | Very high | 96.5 | Very high | 132 Ų | 132 | 94.8 Ų | 94.8 | 62% | 0.617 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60 | -43.3 | 172.6 | -69.6 | 168.3 | -169.1 | 0 | 0 | 111.5 | K149 L155 A156 L157 | K149-E153 WeakPolarHBondContact O-CG 3.46Å; K149-E153 PolarHBondContact O-N 3.39Å; E153-L155 VanDerWaalsContact C-N 3.35Å; E153-L155 PolarHBondContact O-N 3.47Å; E153-A156 PolarHBondContact O-N 2.7Å; E153-L157 WeakPolarHBondContact O-CG 3.32Å; E153-L157 PolarHBondContact O-N 3.46Å; E153-L157 VanDerWaalsContact O-N 3.08Å |
| 154 | G | 96.6 | Very high | 96.7 | Very high | 30 Ų | 30 | 94.7 Ų | 94.7 | 31% | 0.309 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.9 | -38.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | A150 N151 E152 L157 L158 | A150-G154 PolarHBondContact O-N 3.44Å; N151-G154 PolarHBondContact O-N 2.91Å; E152-G154 VanDerWaalsContact C-N 3.33Å; E152-G154 PolarHBondContact O-N 2.98Å; G154-L157 PolarHBondContact O-N 3.06Å; G154-L158 WeakPolarHBondContact O-CG 3.3Å; G154-L158 PolarHBondContact O-N 2.88Å; G154-L158 VanDerWaalsContact O-N 3.08Å |
| 155 | L | 97.4 | Very high | 96.8 | Very high | 117 Ų | 117 | 96 Ų | 96 | 61% | 0.613 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66.8 | -39.9 | 175 | -75.2 | 171.9 | 0 | 0 | 0 | 111.7 | N151 E152 E153 L157 L158 Q159 | N151-L155 WeakPolarHBondContact O-CB 3.33Å; N151-L155 VanDerWaalsContact O-CG 3.32Å; N151-L155 WeakPolarHBondContact O-CG 3.4Å; N151-L155 PolarHBondContact O-N 3.41Å; E152-L155 PolarHBondContact O-N 2.95Å; E153-L155 VanDerWaalsContact C-N 3.35Å; E153-L155 PolarHBondContact O-N 3.47Å; L155-L157 VanDerWaalsContact C-N 3.35Å; L155-L158 PolarHBondContact O-N 3.25Å; L155-Q159 PolarHBondContact O-N 3.48Å |
| 156 | A | 96.9 | Very high | 96.9 | Very high | 62 Ų | 62 | 92 Ų | 92 | 51% | 0.512 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.9 | -42.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | E152 E153 L158 Q159 E160 | E152-A156 PolarHBondContact O-N 2.86Å; E153-A156 PolarHBondContact O-N 2.7Å; A156-L158 PolarHBondContact O-N 2.94Å; A156-Q159 PolarHBondContact O-N 3.25Å; A156-E160 PolarHBondContact O-N 3.41Å |
| 157 | L | 97.2 | Very high | 97 | Very high | 113 Ų | 113 | 95.6 Ų | 95.6 | 59% | 0.592 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63 | -40.6 | 175.2 | -70.8 | 172.8 | 0 | 0 | 0 | 112.6 | E153 G154 L155 Q159 E160 E161 | E153-L157 WeakPolarHBondContact O-CG 3.32Å; E153-L157 PolarHBondContact O-N 3.46Å; E153-L157 VanDerWaalsContact O-N 3.08Å; G154-L157 PolarHBondContact O-N 3.06Å; L155-L157 VanDerWaalsContact C-N 3.35Å; L157-Q159 VanDerWaalsContact C-N 3.34Å; L157-E160 PolarHBondContact O-N 2.94Å; L157-E161 PolarHBondContact O-N 2.76Å |
| 158 | L | 97.6 | Very high | 97 | Very high | 112 Ų | 112 | 93.5 Ų | 93.5 | 59% | 0.586 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.4 | -38.9 | 176.4 | -73.8 | 172.6 | 0 | 0 | 0 | 112 | G154 L155 A156 E161 I162 | G154-L158 WeakPolarHBondContact O-CG 3.3Å; G154-L158 PolarHBondContact O-N 2.88Å; G154-L158 VanDerWaalsContact O-N 3.08Å; L155-L158 PolarHBondContact O-N 3.25Å; A156-L158 PolarHBondContact O-N 2.94Å; L158-E161 PolarHBondContact O-N 3.36Å; L158-I162 WeakPolarHBondContact O-CG1 3.48Å; L158-I162 PolarHBondContact O-N 2.87Å |
| 159 | Q | 97.3 | Very high | 97.1 | Very high | 101 Ų | 101 | 95.4 Ų | 95.4 | 47% | 0.472 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.5 | -44 | 175.2 | -173.4 | 61.2 | 48.9 | 0 | 0 | 111.2 | L155 A156 L157 E161 I162 D163 | L155-Q159 PolarHBondContact O-N 3.48Å; A156-Q159 PolarHBondContact O-N 3.25Å; L157-Q159 VanDerWaalsContact C-N 3.34Å; Q159-E161 VanDerWaalsContact C-N 3.3Å; Q159-E161 PolarHBondContact O-N 2.95Å; Q159-I162 PolarHBondContact O-N 2.83Å; Q159-D163 PolarHBondContact NE2-OD1 2.94Å; Q159-D163 PolarHBondContact O-N 3.27Å |
| 160 | E | 96.9 | Very high | 97.1 | Very high | 95 Ų | 95 | 95.9 Ų | 95.9 | 44% | 0.444 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.6 | -40.4 | 176.6 | -169.8 | -169 | 155.6 | 0 | 0 | 112 | A156 L157 D163 K164 | A156-E160 PolarHBondContact O-N 3.41Å; L157-E160 PolarHBondContact O-N 2.94Å; E160-D163 PolarHBondContact O-N 2.84Å; E160-K164 WeakPolarHBondContact O-CG 3.47Å; E160-K164 PolarHBondContact O-N 3.49Å; E160-K164 VanDerWaalsContact OE1-CE 3.23Å; E160-K164 WeakPolarHBondContact OE1-CE 3.5Å; E160-K164 IonicContact OE1-NZ 3.15Å; E160-K164 PolarHBondContact OE1-NZ 3.01Å |
| 161 | E | 97.6 | Very high | 97.2 | Very high | 104 Ų | 104 | 98.7 Ų | 98.7 | 49% | 0.486 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.2 | -39.6 | 176.9 | -168.7 | 62.6 | -157 | 0 | 0 | 112.1 | L157 L158 Q159 D163 K164 M165 | L157-E161 PolarHBondContact O-N 2.76Å; L158-E161 PolarHBondContact O-N 3.36Å; Q159-E161 VanDerWaalsContact C-N 3.3Å; Q159-E161 PolarHBondContact O-N 2.95Å; E161-D163 VanDerWaalsContact C-N 3.35Å; E161-K164 PolarHBondContact O-N 3.37Å; E161-M165 WeakPolarHBondContact O-CB 3.49Å; E161-M165 WeakPolarHBondContact O-CG 3.45Å; E161-M165 PolarHBondContact O-N 3.33Å |
| 162 | I | 97.8 | Very high | 97.3 | Very high | 88 Ų | 88 | 99.8 Ų | 99.8 | 45% | 0.451 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61 | -46.4 | 173.8 | -71.5 | 167.5 | 0 | 0 | 0 | 110.2 | L158 Q159 K164 M165 V166 | L158-I162 WeakPolarHBondContact O-CG1 3.48Å; L158-I162 PolarHBondContact O-N 2.87Å; Q159-I162 PolarHBondContact O-N 2.83Å; I162-K164 VanDerWaalsContact C-N 3.33Å; I162-K164 PolarHBondContact O-N 2.9Å; I162-M165 WeakPolarHBondContact O-CB 3.4Å; I162-M165 PolarHBondContact O-N 3.49Å; I162-M165 VanDerWaalsContact O-N 3.14Å; I162-V166 HydrophobicContact CG2-CG2 4.3Å; I162-V166 WeakPolarHBondContact O-CG2 3.5Å; I162-V166 PolarHBondContact O-N 2.96Å |
| 163 | D | 97.8 | Very high | 97.3 | Very high | 87 Ų | 87 | 96.9 Ų | 96.9 | 47% | 0.465 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62 | -41.8 | -178.8 | -64.9 | -18 | 0 | 0 | 0 | 111.1 | Q159 E160 E161 V166 E167 | Q159-D163 PolarHBondContact NE2-OD1 2.94Å; Q159-D163 PolarHBondContact O-N 3.27Å; E160-D163 PolarHBondContact O-N 2.84Å; E161-D163 VanDerWaalsContact C-N 3.35Å; D163-V166 PolarHBondContact O-N 3.02Å; D163-E167 PolarHBondContact O-N 3.08Å |
| 164 | K | 97.8 | Very high | 97.3 | Very high | 92 Ų | 92 | 92.4 Ų | 92.4 | 40% | 0.4 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.6 | -43.1 | 172.6 | -72 | 170.4 | -173.6 | 162.5 | 0 | 112.5 | E160 E161 I162 V166 E167 T168 | E160-K164 WeakPolarHBondContact O-CG 3.47Å; E160-K164 PolarHBondContact O-N 3.49Å; E160-K164 VanDerWaalsContact OE1-CE 3.23Å; E160-K164 WeakPolarHBondContact OE1-CE 3.5Å; E160-K164 IonicContact OE1-NZ 3.15Å; E160-K164 PolarHBondContact OE1-NZ 3.01Å; E161-K164 PolarHBondContact O-N 3.37Å; I162-K164 VanDerWaalsContact C-N 3.33Å; I162-K164 PolarHBondContact O-N 2.9Å; K164-V166 VanDerWaalsContact C-N 3.31Å; K164-V166 PolarHBondContact O-N 3.37Å; K164-E167 PolarHBondContact O-N 3.41Å; K164-T168 WeakPolarHBondContact O-CG2 3.36Å; K164-T168 PolarHBondContact O-N 2.68Å; K164-T168 PolarHBondContact O-OG1 3.42Å |
| 165 | M | 97.5 | Very high | 97.4 | Very high | 109 Ų | 109 | 95 Ų | 95 | 54% | 0.537 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.9 | -38.1 | 176.3 | -81 | -175.4 | 49.5 | 0 | 0 | 112.1 | E161 I162 T168 T169 | E161-M165 WeakPolarHBondContact O-CB 3.49Å; E161-M165 WeakPolarHBondContact O-CG 3.45Å; E161-M165 PolarHBondContact O-N 3.33Å; I162-M165 WeakPolarHBondContact O-CB 3.4Å; I162-M165 PolarHBondContact O-N 3.49Å; I162-M165 VanDerWaalsContact O-N 3.14Å; M165-T168 WeakPolarHBondContact CA-OG1 3.33Å; M165-T168 PolarHBondContact O-OG1 3.38Å; M165-T169 VanDerWaalsContact O-CB 3.3Å; M165-T169 WeakPolarHBondContact O-CB 3.44Å; M165-T169 PolarHBondContact O-N 3.3Å; M165-T169 PolarHBondContact O-OG1 3.14Å |
| 166 | V | 97.9 | Very high | 97.4 | Very high | 68 Ų | 68 | 94.8 Ų | 94.8 | 41% | 0.412 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.3 | -50.6 | 176.1 | 170.3 | 0 | 0 | 0 | 0 | 110 | I162 D163 K164 T168 T169 E170 | I162-V166 HydrophobicContact CG2-CG2 4.3Å; I162-V166 WeakPolarHBondContact O-CG2 3.5Å; I162-V166 PolarHBondContact O-N 2.96Å; D163-V166 PolarHBondContact O-N 3.02Å; K164-V166 VanDerWaalsContact C-N 3.31Å; K164-V166 PolarHBondContact O-N 3.37Å; V166-T168 VanDerWaalsContact C-N 3.32Å; V166-T168 PolarHBondContact O-N 3.5Å; V166-T169 WeakPolarHBondContact O-CB 3.33Å; V166-T169 PolarHBondContact O-N 3.06Å; V166-E170 HydrophobicContact CG1-CG 4.29Å; V166-E170 WeakPolarHBondContact O-CG 3.46Å; V166-E170 PolarHBondContact O-N 3.29Å |
| 167 | E | 97.2 | Very high | 97.4 | Very high | 136 Ų | 136 | 97.5 Ų | 97.5 | 64% | 0.636 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -56.5 | -45.7 | 178.6 | -175.5 | -178.3 | -171.3 | 0 | 0 | 111.8 | D163 K164 T169 E170 L171 | D163-E167 PolarHBondContact O-N 3.08Å; K164-E167 PolarHBondContact O-N 3.41Å; E167-T169 VanDerWaalsContact C-N 3.34Å; E167-T169 PolarHBondContact O-N 2.92Å; E167-E170 PolarHBondContact O-N 3.2Å; E167-L171 WeakPolarHBondContact O-CB 3.34Å; E167-L171 PolarHBondContact O-N 2.94Å |
| 168 | T | 97.3 | Very high | 97.4 | Very high | 70 Ų | 70 | 94.3 Ų | 94.3 | 43% | 0.429 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.8 | -38 | 177 | 52.2 | 0 | 0 | 0 | 0 | 112.4 | K164 M165 V166 L171 M172 | K164-T168 WeakPolarHBondContact O-CG2 3.36Å; K164-T168 PolarHBondContact O-N 2.68Å; K164-T168 PolarHBondContact O-OG1 3.42Å; M165-T168 WeakPolarHBondContact CA-OG1 3.33Å; M165-T168 PolarHBondContact O-OG1 3.38Å; V166-T168 VanDerWaalsContact C-N 3.32Å; V166-T168 PolarHBondContact O-N 3.5Å; T168-L171 PolarHBondContact O-N 3.38Å; T168-M172 WeakPolarHBondContact O-CB 3.4Å; T168-M172 VanDerWaalsContact O-CG 3.3Å; T168-M172 WeakPolarHBondContact O-CG 3.38Å; T168-M172 PolarHBondContact O-N 3.47Å |
| 169 | T | 97.1 | Very high | 97.4 | Very high | 77 Ų | 77 | 93.5 Ų | 93.5 | 47% | 0.472 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67.8 | -40.7 | 176.7 | -59 | 0 | 0 | 0 | 0 | 111.7 | M165 V166 E167 M172 T173 | M165-T169 VanDerWaalsContact O-CB 3.3Å; M165-T169 WeakPolarHBondContact O-CB 3.44Å; M165-T169 PolarHBondContact O-N 3.3Å; M165-T169 PolarHBondContact O-OG1 3.14Å; V166-T169 WeakPolarHBondContact O-CB 3.33Å; V166-T169 PolarHBondContact O-N 3.06Å; E167-T169 VanDerWaalsContact C-N 3.34Å; E167-T169 PolarHBondContact O-N 2.92Å; T169-M172 PolarHBondContact O-N 2.93Å; T169-T173 WeakPolarHBondContact O-CB 3.48Å; T169-T173 PolarHBondContact O-N 3.4Å; T169-T173 PolarHBondContact O-OG1 3.23Å |
| 170 | E | 96.9 | Very high | 97.4 | Very high | 131 Ų | 131 | 95.5 Ų | 95.5 | 61% | 0.612 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63 | -46.1 | 175.2 | -73.1 | -180 | 173.6 | 0 | 0 | 111 | V166 E167 M172 T173 G174 | V166-E170 HydrophobicContact CG1-CG 4.29Å; V166-E170 WeakPolarHBondContact O-CG 3.46Å; V166-E170 PolarHBondContact O-N 3.29Å; E167-E170 PolarHBondContact O-N 3.2Å; E170-M172 PolarHBondContact O-N 3Å; E170-T173 PolarHBondContact O-N 3.39Å; E170-G174 PolarHBondContact O-N 2.84Å |
| 171 | L | 97.8 | Very high | 97.4 | Very high | 115 Ų | 115 | 94.8 Ų | 94.8 | 60% | 0.602 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -58.6 | -47.4 | 174.7 | 179.7 | 68.5 | 0 | 0 | 0 | 111.8 | E167 T168 T173 G174 N175 | E167-L171 WeakPolarHBondContact O-CB 3.34Å; E167-L171 PolarHBondContact O-N 2.94Å; T168-L171 PolarHBondContact O-N 3.38Å; L171-T173 VanDerWaalsContact C-N 3.34Å; L171-T173 PolarHBondContact O-N 2.95Å; L171-G174 PolarHBondContact O-N 3.47Å; L171-N175 PolarHBondContact O-N 3.29Å; L171-N175 PolarHBondContact O-ND2 3.06Å |
| 172 | M | 97.4 | Very high | 97.4 | Very high | 120 Ų | 120 | 95.8 Ų | 95.8 | 59% | 0.591 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.3 | -41.7 | 177.3 | -75 | -174.4 | -174.4 | 0 | 0 | 111.8 | T168 T169 E170 N175 I176 | T168-M172 WeakPolarHBondContact O-CB 3.4Å; T168-M172 VanDerWaalsContact O-CG 3.3Å; T168-M172 WeakPolarHBondContact O-CG 3.38Å; T168-M172 PolarHBondContact O-N 3.47Å; T169-M172 PolarHBondContact O-N 2.93Å; E170-M172 PolarHBondContact O-N 3Å; M172-N175 WeakPolarHBondContact O-CB 3.36Å; M172-N175 PolarHBondContact O-N 3.28Å; M172-I176 VanDerWaalsContact O-CG1 3.27Å; M172-I176 WeakPolarHBondContact O-CG1 3.46Å; M172-I176 PolarHBondContact O-N 2.68Å |
| 173 | T | 97.1 | Very high | 97.4 | Very high | 76 Ų | 76 | 97 Ų | 97 | 47% | 0.466 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.6 | -44.6 | 177.3 | -59.6 | 0 | 0 | 0 | 0 | 111.1 | T169 E170 L171 N175 I176 Q177 | T169-T173 WeakPolarHBondContact O-CB 3.48Å; T169-T173 PolarHBondContact O-N 3.4Å; T169-T173 PolarHBondContact O-OG1 3.23Å; E170-T173 PolarHBondContact O-N 3.39Å; L171-T173 VanDerWaalsContact C-N 3.34Å; L171-T173 PolarHBondContact O-N 2.95Å; T173-N175 VanDerWaalsContact C-N 3.34Å; T173-N175 PolarHBondContact O-N 3.47Å; T173-I176 PolarHBondContact O-N 3.08Å; T173-Q177 WeakPolarHBondContact O-CB 3.23Å; T173-Q177 PolarHBondContact O-N 3.47Å |
| 174 | G | 96.9 | Very high | 97.4 | Very high | 38 Ų | 38 | 99.1 Ų | 99.1 | 39% | 0.392 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.3 | -43.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | E170 L171 Q177 S178 | E170-G174 PolarHBondContact O-N 2.84Å; L171-G174 PolarHBondContact O-N 3.47Å; G174-Q177 PolarHBondContact O-N 3.15Å; G174-S178 WeakPolarHBondContact O-CB 3.32Å; G174-S178 PolarHBondContact O-N 2.92Å |
| 175 | N | 97.5 | Very high | 97.3 | Very high | 83 Ų | 83 | 99.8 Ų | 99.8 | 44% | 0.444 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.1 | -46 | 175.6 | -75.1 | -25.8 | 0 | 0 | 0 | 112.1 | L171 M172 T173 Q177 S178 L179 | L171-N175 PolarHBondContact O-N 3.29Å; L171-N175 PolarHBondContact O-ND2 3.06Å; M172-N175 WeakPolarHBondContact O-CB 3.36Å; M172-N175 PolarHBondContact O-N 3.28Å; T173-N175 VanDerWaalsContact C-N 3.34Å; T173-N175 PolarHBondContact O-N 3.47Å; N175-Q177 VanDerWaalsContact C-N 3.33Å; N175-Q177 PolarHBondContact O-N 3.01Å; N175-S178 PolarHBondContact O-N 3.32Å; N175-S178 PolarHBondContact O-OG 3.49Å; N175-L179 WeakPolarHBondContact O-CG 3.5Å; N175-L179 PolarHBondContact O-N 3.39Å |
| 176 | I | 97.2 | Very high | 97.3 | Very high | 113 Ų | 113 | 99.3 Ų | 99.3 | 58% | 0.579 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -58.8 | -45.7 | 176.5 | -70.9 | 164.4 | 0 | 0 | 0 | 110.6 | M172 T173 S178 L179 K180 | M172-I176 VanDerWaalsContact O-CG1 3.27Å; M172-I176 WeakPolarHBondContact O-CG1 3.46Å; M172-I176 PolarHBondContact O-N 2.68Å; T173-I176 PolarHBondContact O-N 3.08Å; I176-S178 VanDerWaalsContact C-N 3.35Å; I176-S178 PolarHBondContact O-N 2.96Å; I176-L179 PolarHBondContact O-N 2.9Å; I176-K180 WeakPolarHBondContact O-CB 3.41Å; I176-K180 PolarHBondContact O-N 2.83Å |
| 177 | Q | 97.3 | Very high | 97.2 | Very high | 120 Ų | 120 | 98.9 Ų | 98.9 | 56% | 0.561 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65.2 | -39.4 | 179 | -168.9 | 166.4 | -3.3 | 0 | 0 | 111.8 | T173 G174 N175 L179 K180 N181 | T173-Q177 WeakPolarHBondContact O-CB 3.23Å; T173-Q177 PolarHBondContact O-N 3.47Å; G174-Q177 PolarHBondContact O-N 3.15Å; N175-Q177 VanDerWaalsContact C-N 3.33Å; N175-Q177 PolarHBondContact O-N 3.01Å; Q177-L179 PolarHBondContact O-N 3.31Å; Q177-K180 PolarHBondContact O-N 3.42Å; Q177-N181 VanDerWaalsContact O-CG 3.27Å; Q177-N181 PolarHBondContact O-N 3.39Å; Q177-N181 PolarHBondContact O-OD1 3.22Å |
| 178 | S | 97.3 | Very high | 97.1 | Very high | 45 Ų | 45 | 95.3 Ų | 95.3 | 32% | 0.315 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.6 | -41.9 | 174.7 | 85.3 | 0 | 0 | 0 | 0 | 112.3 | G174 N175 I176 N181 K182 | G174-S178 WeakPolarHBondContact O-CB 3.32Å; G174-S178 PolarHBondContact O-N 2.92Å; N175-S178 PolarHBondContact O-N 3.32Å; N175-S178 PolarHBondContact O-OG 3.49Å; I176-S178 VanDerWaalsContact C-N 3.35Å; I176-S178 PolarHBondContact O-N 2.96Å; S178-N181 PolarHBondContact O-N 3.31Å; S178-K182 WeakPolarHBondContact O-CG 3.48Å; S178-K182 PolarHBondContact O-N 3.33Å |
| 179 | L | 97.8 | Very high | 97 | Very high | 95 Ų | 95 | 96.9 Ų | 96.9 | 50% | 0.497 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68 | -41.8 | 178 | -74.3 | 170.9 | 0 | 0 | 0 | 111 | N175 I176 Q177 N181 K182 I183 | N175-L179 WeakPolarHBondContact O-CG 3.5Å; N175-L179 PolarHBondContact O-N 3.39Å; I176-L179 PolarHBondContact O-N 2.9Å; Q177-L179 PolarHBondContact O-N 3.31Å; L179-N181 VanDerWaalsContact C-N 3.3Å; L179-N181 PolarHBondContact O-N 2.94Å; L179-K182 PolarHBondContact O-N 3.48Å; L179-I183 WeakPolarHBondContact O-CG1 3.48Å; L179-I183 PolarHBondContact O-N 3.11Å |
| 180 | K | 97.6 | Very high | 96.9 | Very high | 143 Ų | 143 | 97.1 Ų | 97.1 | 62% | 0.622 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -57 | -45 | 174.2 | -175 | -179.6 | 178.4 | -178.5 | 0 | 111.4 | I176 Q177 I183 Q184 | I176-K180 WeakPolarHBondContact O-CB 3.41Å; I176-K180 PolarHBondContact O-N 2.83Å; Q177-K180 PolarHBondContact O-N 3.42Å; K180-I183 PolarHBondContact O-N 3.42Å; K180-Q184 WeakPolarHBondContact O-CB 3.43Å; K180-Q184 PolarHBondContact O-N 3.34Å |
| 181 | N | 97.4 | Very high | 96.8 | Very high | 80 Ų | 80 | 95.7 Ų | 95.7 | 43% | 0.428 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63 | -42.9 | 176.8 | -68.2 | -9.5 | 0 | 0 | 0 | 111.7 | Q177 S178 L179 Q184 I185 | Q177-N181 VanDerWaalsContact O-CG 3.27Å; Q177-N181 PolarHBondContact O-N 3.39Å; Q177-N181 PolarHBondContact O-OD1 3.22Å; S178-N181 PolarHBondContact O-N 3.31Å; L179-N181 VanDerWaalsContact C-N 3.3Å; L179-N181 PolarHBondContact O-N 2.94Å; N181-Q184 PolarHBondContact O-N 2.97Å; N181-I185 VanDerWaalsContact O-CG1 3.32Å; N181-I185 WeakPolarHBondContact O-CG1 3.46Å; N181-I185 PolarHBondContact O-N 2.95Å |
| 182 | K | 97.5 | Very high | 96.6 | Very high | 125 Ų | 125 | 96.6 Ų | 96.6 | 54% | 0.543 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.1 | -44 | 176.1 | -71.8 | 173.1 | -178.3 | 177.5 | 0 | 112.3 | S178 L179 Q184 I185 L186 | S178-K182 WeakPolarHBondContact O-CG 3.48Å; S178-K182 PolarHBondContact O-N 3.33Å; L179-K182 PolarHBondContact O-N 3.48Å; K182-Q184 VanDerWaalsContact C-N 3.3Å; K182-Q184 PolarHBondContact O-N 3.35Å; K182-I185 PolarHBondContact O-N 2.95Å; K182-L186 WeakPolarHBondContact O-CB 3.39Å; K182-L186 WeakPolarHBondContact O-CG 3.46Å; K182-L186 PolarHBondContact O-N 3.33Å |
| 183 | I | 96.8 | Very high | 96.3 | Very high | 115 Ų | 115 | 94.5 Ų | 94.5 | 59% | 0.59 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.7 | -42 | 176.3 | -69.2 | 166.3 | 0 | 0 | 0 | 110.3 | L179 K180 L186 A187 | L179-I183 WeakPolarHBondContact O-CG1 3.48Å; L179-I183 PolarHBondContact O-N 3.11Å; K180-I183 PolarHBondContact O-N 3.42Å; I183-L186 PolarHBondContact O-N 3.1Å; I183-A187 VanDerWaalsContact O-CB 3.26Å; I183-A187 WeakPolarHBondContact O-CB 3.46Å; I183-A187 PolarHBondContact O-N 2.96Å |
| 184 | Q | 97.2 | Very high | 95.9 | Very high | 131 Ų | 131 | 95.6 Ų | 95.6 | 61% | 0.612 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.7 | -43.2 | 177.7 | -176.4 | 176.9 | -5.2 | 0 | 0 | 112.3 | K180 N181 K182 A187 S188 | K180-Q184 WeakPolarHBondContact O-CB 3.43Å; K180-Q184 PolarHBondContact O-N 3.34Å; N181-Q184 PolarHBondContact O-N 2.97Å; K182-Q184 VanDerWaalsContact C-N 3.3Å; K182-Q184 PolarHBondContact O-N 3.35Å; Q184-A187 PolarHBondContact O-N 3.22Å; Q184-S188 PolarHBondContact O-N 2.79Å; Q184-S188 PolarHBondContact O-OG 3.34Å |
| 185 | I | 96.5 | Very high | 95.6 | Very high | 106 Ų | 106 | 97.5 Ų | 97.5 | 54% | 0.544 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.5 | -47.9 | 177 | -66.8 | 163.5 | 0 | 0 | 0 | 110.7 | N181 K182 A187 S188 E189 | N181-I185 VanDerWaalsContact O-CG1 3.32Å; N181-I185 WeakPolarHBondContact O-CG1 3.46Å; N181-I185 PolarHBondContact O-N 2.95Å; K182-I185 PolarHBondContact O-N 2.95Å; I185-A187 VanDerWaalsContact C-N 3.29Å; I185-A187 PolarHBondContact O-N 3.43Å; I185-S188 WeakPolarHBondContact CA-OG 3.48Å; I185-S188 PolarHBondContact O-N 3.41Å; I185-S188 PolarHBondContact O-OG 3.15Å; I185-E189 PolarHBondContact O-N 3.37Å |
| 186 | L | 96.8 | Very high | 95.3 | Very high | 99 Ų | 99 | 100.7 Ų | 100.7 | 52% | 0.518 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.5 | -37.6 | 177.8 | -73.4 | 169.1 | 0 | 0 | 0 | 111.7 | K182 I183 E189 V190 | K182-L186 WeakPolarHBondContact O-CB 3.39Å; K182-L186 WeakPolarHBondContact O-CG 3.46Å; K182-L186 PolarHBondContact O-N 3.33Å; I183-L186 PolarHBondContact O-N 3.1Å; L186-E189 PolarHBondContact O-N 2.97Å; L186-V190 WeakPolarHBondContact O-CB 3.03Å; L186-V190 VanDerWaalsContact O-CG2 3.27Å; L186-V190 WeakPolarHBondContact O-CG2 3.49Å; L186-V190 PolarHBondContact O-N 3.11Å |
| 187 | A | 96.4 | Very high | 94.7 | Very high | 58 Ų | 58 | 98.7 Ų | 98.7 | 48% | 0.479 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.8 | -41.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | I183 Q184 I185 E191 | I183-A187 VanDerWaalsContact O-CB 3.26Å; I183-A187 WeakPolarHBondContact O-CB 3.46Å; I183-A187 PolarHBondContact O-N 2.96Å; Q184-A187 PolarHBondContact O-N 3.22Å; I185-A187 VanDerWaalsContact C-N 3.29Å; I185-A187 PolarHBondContact O-N 3.43Å; A187-E191 WeakPolarHBondContact O-CB 3.42Å; A187-E191 PolarHBondContact O-N 3.35Å |
| 188 | S | 95.4 | Very high | 94.1 | Very high | 61 Ų | 61 | 97.3 Ų | 97.3 | 43% | 0.427 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66 | -39.6 | 173.8 | 47.5 | 0 | 0 | 0 | 0 | 112.8 | Q184 I185 E191 E192 | Q184-S188 PolarHBondContact O-N 2.79Å; Q184-S188 PolarHBondContact O-OG 3.34Å; I185-S188 WeakPolarHBondContact CA-OG 3.48Å; I185-S188 PolarHBondContact O-N 3.41Å; I185-S188 PolarHBondContact O-OG 3.15Å; S188-E191 PolarHBondContact O-N 3Å; S188-E192 WeakPolarHBondContact O-CG 3.37Å; S188-E192 PolarHBondContact O-N 3.02Å |
| 189 | E | 95.3 | Very high | 93.4 | Very high | 104 Ų | 104 | 100.6 Ų | 100.6 | 49% | 0.486 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.6 | -42.2 | 177.4 | -173.9 | 175.3 | -172.7 | 0 | 0 | 111.4 | I185 L186 E192 E193 | I185-E189 PolarHBondContact O-N 3.37Å; L186-E189 PolarHBondContact O-N 2.97Å; E189-E192 PolarHBondContact O-N 3.03Å; E189-E193 WeakPolarHBondContact O-CG 3.42Å; E189-E193 PolarHBondContact O-N 2.94Å |
| 190 | V | 95.6 | Very high | 92.3 | Very high | 81 Ų | 81 | 101.5 Ų | 101.5 | 49% | 0.491 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.5 | -43.7 | 175 | 169.7 | 0 | 0 | 0 | 0 | 111.5 | L186 E192 E193 E194 | L186-V190 WeakPolarHBondContact O-CB 3.03Å; L186-V190 VanDerWaalsContact O-CG2 3.27Å; L186-V190 WeakPolarHBondContact O-CG2 3.49Å; L186-V190 PolarHBondContact O-N 3.11Å; V190-E192 PolarHBondContact O-N 3.49Å; V190-E193 PolarHBondContact O-N 3.27Å; V190-E194 HydrophobicContact CG1-CG 4.46Å; V190-E194 WeakPolarHBondContact O-CG 3.36Å; V190-E194 PolarHBondContact O-N 3.32Å |
| 191 | E | 94.6 | Very high | 90.9 | Very high | 102 Ų | 102 | 100 Ų | 100 | 48% | 0.477 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.2 | -43.9 | 176.4 | -173.5 | 70.4 | -146.2 | 0 | 0 | 111.4 | A187 S188 E193 E194 E195 | A187-E191 WeakPolarHBondContact O-CB 3.42Å; A187-E191 PolarHBondContact O-N 3.35Å; S188-E191 PolarHBondContact O-N 3Å; E191-E193 PolarHBondContact O-N 3.44Å; E191-E194 PolarHBondContact O-N 3.29Å; E191-E195 WeakPolarHBondContact O-CG 3.42Å; E191-E195 PolarHBondContact O-N 3.18Å |
| 192 | E | 93.2 | Very high | 89.5 | Confident | 133 Ų | 133 | 102.8 Ų | 102.8 | 62% | 0.621 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.2 | -46 | 175.1 | -75.1 | 179.9 | -168.3 | 0 | 0 | 111.4 | S188 E189 V190 E195 R196 | S188-E192 WeakPolarHBondContact O-CG 3.37Å; S188-E192 PolarHBondContact O-N 3.02Å; E189-E192 PolarHBondContact O-N 3.03Å; V190-E192 PolarHBondContact O-N 3.49Å; E192-E195 PolarHBondContact O-N 3.06Å; E192-R196 WeakPolarHBondContact O-CG 3.39Å; E192-R196 PolarHBondContact O-N 3.42Å |
| 193 | E | 90.3 | Very high | 87.9 | Confident | 77 Ų | 77 | 102.4 Ų | 102.4 | 36% | 0.36 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62 | -42.3 | 176.1 | -73 | -59 | 159.2 | 0 | 0 | 113.1 | E189 V190 E191 E195 R196 V197 | E189-E193 WeakPolarHBondContact O-CG 3.42Å; E189-E193 PolarHBondContact O-N 2.94Å; V190-E193 PolarHBondContact O-N 3.27Å; E191-E193 PolarHBondContact O-N 3.44Å; E193-E195 VanDerWaalsContact C-N 3.32Å; E193-E195 PolarHBondContact O-N 3.04Å; E193-R196 PolarHBondContact O-N 3.06Å; E193-R196 IonicContact OE1-CZ 2.78Å; E193-R196 IonicContact OE1-NE 2.63Å; E193-R196 PolarHBondContact OE1-NE 2.82Å; E193-R196 IonicContact OE1-NH2 3.39Å; E193-R196 PolarHBondContact OE1-NH2 3.19Å; E193-R196 IonicContact OE2-CZ 2.68Å; E193-R196 IonicContact OE2-NE 2.68Å; E193-R196 PolarHBondContact OE2-NE 3.38Å; E193-R196 IonicContact OE2-NH2 2.9Å; E193-R196 PolarHBondContact OE2-NH2 3.22Å; E193-V197 WeakPolarHBondContact O-CG2 3.41Å; E193-V197 PolarHBondContact O-N 2.69Å |
| 194 | E | 89.9 | Confident | 86 | Confident | 98 Ų | 98 | 101.2 Ų | 101.2 | 46% | 0.458 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.8 | -42.6 | 175.6 | -77.6 | -169.6 | -171.7 | 0 | 0 | 111.5 | V190 E191 V197 K198 | V190-E194 HydrophobicContact CG1-CG 4.46Å; V190-E194 WeakPolarHBondContact O-CG 3.36Å; V190-E194 PolarHBondContact O-N 3.32Å; E191-E194 PolarHBondContact O-N 3.29Å; E194-V197 PolarHBondContact O-N 3.32Å; E194-K198 WeakPolarHBondContact O-CB 3.39Å; E194-K198 VanDerWaalsContact O-CG 3.3Å; E194-K198 WeakPolarHBondContact O-CG 3.42Å; E194-K198 PolarHBondContact O-N 2.98Å |
| 195 | E | 91 | Very high | 84.1 | Confident | 78 Ų | 78 | 100.5 Ų | 100.5 | 36% | 0.364 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63 | -40.3 | 174.3 | -74.3 | -59 | 131.7 | 0 | 0 | 112 | E191 E192 E193 K198 Q199 | E191-E195 WeakPolarHBondContact O-CG 3.42Å; E191-E195 PolarHBondContact O-N 3.18Å; E192-E195 PolarHBondContact O-N 3.06Å; E193-E195 VanDerWaalsContact C-N 3.32Å; E193-E195 PolarHBondContact O-N 3.04Å; E195-K198 PolarHBondContact O-N 3.14Å; E195-K198 IonicContact OE1-NZ 2.71Å; E195-K198 PolarHBondContact OE1-NZ 3.03Å; E195-Q199 VanDerWaalsContact O-CG 3.3Å; E195-Q199 WeakPolarHBondContact O-CG 3.32Å; E195-Q199 PolarHBondContact O-N 3.04Å |
| 196 | R | 89.3 | Confident | 82.2 | Confident | 150 Ų | 150 | 98.6 Ų | 98.6 | 57% | 0.566 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.6 | -43 | 173.5 | -64.6 | -163.1 | -48.7 | 165 | 6.4 | 112 | E192 E193 Q199 M200 | E192-R196 WeakPolarHBondContact O-CG 3.39Å; E192-R196 PolarHBondContact O-N 3.42Å; E193-R196 PolarHBondContact O-N 3.06Å; E193-R196 IonicContact OE1-CZ 2.78Å; E193-R196 IonicContact OE1-NE 2.63Å; E193-R196 PolarHBondContact OE1-NE 2.82Å; E193-R196 IonicContact OE1-NH2 3.39Å; E193-R196 PolarHBondContact OE1-NH2 3.19Å; E193-R196 IonicContact OE2-CZ 2.68Å; E193-R196 IonicContact OE2-NE 2.68Å; E193-R196 PolarHBondContact OE2-NE 3.38Å; E193-R196 IonicContact OE2-NH2 2.9Å; E193-R196 PolarHBondContact OE2-NH2 3.22Å; R196-Q199 PolarHBondContact O-N 3.05Å; R196-M200 WeakPolarHBondContact O-CB 3.28Å; R196-M200 PolarHBondContact O-N 3.27Å |
| 197 | V | 85 | Confident | 80.1 | Confident | 72 Ų | 72 | 95.5 Ų | 95.5 | 44% | 0.436 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66.5 | -39.9 | 178 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | E193 E194 M200 H201 | E193-V197 WeakPolarHBondContact O-CG2 3.41Å; E193-V197 PolarHBondContact O-N 2.69Å; E194-V197 PolarHBondContact O-N 3.32Å; V197-M200 PolarHBondContact O-N 3.02Å; V197-H201 WeakPolarHBondContact CG1-ND1 3.45Å; V197-H201 WeakPolarHBondContact O-CB 3.45Å; V197-H201 PolarHBondContact O-N 2.95Å; V197-H201 PolarHBondContact O-ND1 3.43Å |
| 198 | K | 85.6 | Confident | 78.3 | Confident | 91 Ų | 91 | 100 Ų | 100 | 40% | 0.396 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.3 | -44.9 | 174 | -74.5 | 173.7 | -159 | 161.2 | 0 | 111.2 | E194 E195 H201 Q202 | E194-K198 WeakPolarHBondContact O-CB 3.39Å; E194-K198 VanDerWaalsContact O-CG 3.3Å; E194-K198 WeakPolarHBondContact O-CG 3.42Å; E194-K198 PolarHBondContact O-N 2.98Å; E195-K198 PolarHBondContact O-N 3.14Å; E195-K198 IonicContact OE1-NZ 2.71Å; E195-K198 PolarHBondContact OE1-NZ 3.03Å; K198-H201 PolarHBondContact O-N 3.37Å; K198-Q202 WeakPolarHBondContact O-CG 3.24Å; K198-Q202 PolarHBondContact O-N 2.92Å |
| 199 | Q | 82.6 | Confident | 76.7 | Confident | 113 Ų | 113 | 103.3 Ų | 103.3 | 53% | 0.528 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62 | -44.6 | 175.6 | -72.2 | 174.9 | 24.8 | 0 | 0 | 111.6 | E195 R196 H201 Q202 I203 | E195-Q199 VanDerWaalsContact O-CG 3.3Å; E195-Q199 WeakPolarHBondContact O-CG 3.32Å; E195-Q199 PolarHBondContact O-N 3.04Å; R196-Q199 PolarHBondContact O-N 3.05Å; Q199-H201 VanDerWaalsContact C-N 3.35Å; Q199-H201 PolarHBondContact O-N 2.86Å; Q199-Q202 PolarHBondContact O-N 2.97Å; Q199-I203 VanDerWaalsContact O-CG1 3.32Å; Q199-I203 WeakPolarHBondContact O-CG1 3.19Å; Q199-I203 PolarHBondContact O-N 2.88Å |
| 200 | M | 74.9 | Confident | 74.9 | Confident | 114 Ų | 114 | 102.9 Ų | 102.9 | 56% | 0.562 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.9 | -39.6 | 176 | -168.9 | 168.8 | 102.9 | 0 | 0 | 112 | R196 V197 I203 N204 | R196-M200 WeakPolarHBondContact O-CB 3.28Å; R196-M200 PolarHBondContact O-N 3.27Å; V197-M200 PolarHBondContact O-N 3.02Å; M200-I203 PolarHBondContact O-N 3.47Å; M200-N204 WeakPolarHBondContact O-CB 3.36Å; M200-N204 PolarHBondContact O-N 2.97Å; M200-N204 PolarHBondContact O-ND2 3.28Å |
| 201 | H | 68.6 | Low | 73.4 | Confident | 113 Ų | 113 | 104.9 Ų | 104.9 | 52% | 0.523 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.3 | -42.4 | 173.2 | -86.3 | 79.3 | 0 | 0 | 0 | 111.9 | V197 K198 Q199 I203 N204 T205 | V197-H201 WeakPolarHBondContact CG1-ND1 3.45Å; V197-H201 WeakPolarHBondContact O-CB 3.45Å; V197-H201 PolarHBondContact O-N 2.95Å; V197-H201 PolarHBondContact O-ND1 3.43Å; K198-H201 PolarHBondContact O-N 3.37Å; Q199-H201 VanDerWaalsContact C-N 3.35Å; Q199-H201 PolarHBondContact O-N 2.86Å; H201-I203 VanDerWaalsContact C-N 3.3Å; H201-I203 PolarHBondContact O-N 3.23Å; H201-N204 CarbonylContact O-C 3.47Å; H201-N204 PolarHBondContact O-N 3.31Å; H201-N204 VanDerWaalsContact O-N 3.11Å; H201-T205 VanDerWaalsContact O-CG2 3.32Å; H201-T205 WeakPolarHBondContact O-CG2 3.25Å; H201-T205 PolarHBondContact O-N 3.46Å |
| 202 | Q | 67.9 | Low | 72.1 | Confident | 137 Ų | 137 | 105.3 Ų | 105.3 | 64% | 0.64 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -59.3 | -42.6 | 174.2 | -75.8 | 177.1 | 20.7 | 0 | 0 | 111.4 | K198 Q199 N204 T205 | K198-Q202 WeakPolarHBondContact O-CG 3.24Å; K198-Q202 PolarHBondContact O-N 2.92Å; Q199-Q202 PolarHBondContact O-N 2.97Å; Q202-N204 VanDerWaalsContact C-N 3.33Å; Q202-N204 PolarHBondContact O-N 2.85Å; Q202-T205 PolarHBondContact O-N 3.42Å; Q202-T205 PolarHBondContact O-OG1 3.46Å |
| 203 | I | 63.1 | Low | 70.7 | Confident | 117 Ų | 117 | 108.4 Ų | 108.4 | 60% | 0.6 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -61.6 | -42 | 174.1 | -65.3 | 164.3 | 0 | 0 | 0 | 110.9 | Q199 M200 H201 S206 | Q199-I203 VanDerWaalsContact O-CG1 3.32Å; Q199-I203 WeakPolarHBondContact O-CG1 3.19Å; Q199-I203 PolarHBondContact O-N 2.88Å; M200-I203 PolarHBondContact O-N 3.47Å; H201-I203 VanDerWaalsContact C-N 3.3Å; H201-I203 PolarHBondContact O-N 3.23Å; I203-S206 WeakPolarHBondContact O-CB 3.45Å; I203-S206 PolarHBondContact O-N 3.11Å; I203-S206 PolarHBondContact O-OG 2.96Å |
| 204 | N | 57.8 | Low | 69.5 | Low | 91 Ų | 91 | 111.2 Ų | 111.2 | 49% | 0.487 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -78.7 | -13 | -179.7 | -67.3 | -25.6 | 0 | 0 | 0 | 114.8 | M200 H201 Q202 S206 | M200-N204 WeakPolarHBondContact O-CB 3.36Å; M200-N204 PolarHBondContact O-N 2.97Å; M200-N204 PolarHBondContact O-ND2 3.28Å; H201-N204 CarbonylContact O-C 3.47Å; H201-N204 PolarHBondContact O-N 3.31Å; H201-N204 VanDerWaalsContact O-N 3.11Å; Q202-N204 VanDerWaalsContact C-N 3.33Å; Q202-N204 PolarHBondContact O-N 2.85Å; N204-S206 VanDerWaalsContact C-N 3.27Å; N204-S206 CarbonylContact C-O 3.58Å; N204-S206 VanDerWaalsContact C-O 3.23Å; N204-S206 CarbonylContact O-C 3.57Å; N204-S206 VanDerWaalsContact O-O 3.06Å |
| 205 | T | 56.8 | Low | 68.2 | Low | 116 Ų | 116 | 109.5 Ų | 109.5 | 71% | 0.712 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -74 | -21.1 | 169.6 | 54.6 | 0 | 0 | 0 | 0 | 112.1 | H201 Q202 G207 | H201-T205 VanDerWaalsContact O-CG2 3.32Å; H201-T205 WeakPolarHBondContact O-CG2 3.25Å; H201-T205 PolarHBondContact O-N 3.46Å; Q202-T205 PolarHBondContact O-N 3.42Å; Q202-T205 PolarHBondContact O-OG1 3.46Å; T205-G207 PolarHBondContact O-N 2.79Å; T205-G207 VanDerWaalsContact O-N 3.16Å |
| 206 | S | 56.3 | Low | 66.8 | Low | 65 Ų | 65 | 112.7 Ų | 112.7 | 46% | 0.455 | 60% | 0.602 | S | S | . | * | S | Bend | trans | -71.3 | 103.5 | 148.8 | 86.1 | 0 | 0 | 0 | 0 | 104.8 | I203 N204 | I203-S206 WeakPolarHBondContact O-CB 3.45Å; I203-S206 PolarHBondContact O-N 3.11Å; I203-S206 PolarHBondContact O-OG 2.96Å; N204-S206 VanDerWaalsContact C-N 3.27Å; N204-S206 CarbonylContact C-O 3.58Å; N204-S206 VanDerWaalsContact C-O 3.23Å; N204-S206 CarbonylContact O-C 3.57Å; N204-S206 VanDerWaalsContact O-O 3.06Å |
| 207 | G | 52.6 | Low | 65.5 | Low | 34 Ų | 34 | 114.1 Ų | 114.1 | 35% | 0.351 | 61% | 0.612 | S | S | . | * | trans | -51.4 | 169.9 | -162.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | T205 L209 S210 | T205-G207 PolarHBondContact O-N 2.79Å; T205-G207 VanDerWaalsContact O-N 3.16Å; G207-L209 CarbonylContact O-C 3.59Å; G207-L209 PolarHBondContact O-N 2.98Å; G207-S210 PolarHBondContact O-N 3.16Å | ||
| 208 | V | 58.8 | Low | 64.3 | Low | 152 Ų | 152 | 115.3 Ų | 115.3 | 92% | 0.921 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47.9 | -11.8 | 175.3 | 178.4 | 0 | 0 | 0 | 0 | 114 | ||
| 209 | L | 60.6 | Low | 63.2 | Low | 132 Ų | 132 | 117.9 Ų | 117.9 | 69% | 0.691 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.6 | 12.2 | 176.7 | -61 | 175.8 | 0 | 0 | 0 | 115.3 | G207 L211 | G207-L209 CarbonylContact O-C 3.59Å; G207-L209 PolarHBondContact O-N 2.98Å; L209-L211 HydrophobicContact CB-CD1 3.99Å; L209-L211 HydrophobicContact CB-CG 3.82Å; L209-L211 HydrophobicContact CD1-CD1 4.22Å; L209-L211 PolarHBondContact O-N 3.22Å; L209-L211 VanDerWaalsContact O-N 3.09Å |
| 210 | S | 59.3 | Low | 62.2 | Low | 95 Ų | 95 | 120.3 Ų | 120.3 | 66% | 0.664 | 65% | 0.646 | S | S | * | * | trans | 47.9 | 37.4 | -177.9 | -49.1 | 0 | 0 | 0 | 0 | 114 | G207 | G207-S210 PolarHBondContact O-N 3.16Š| ||
| 211 | L | 63.9 | Low | 61.7 | Low | 123 Ų | 123 | 117.5 Ų | 117.5 | 64% | 0.644 | 64% | 0.641 | S | S | * | * | trans | -82.4 | 137.8 | -174.7 | -67.2 | 174.8 | 0 | 0 | 0 | 111.3 | L209 E213 | L209-L211 HydrophobicContact CB-CD1 3.99Å; L209-L211 HydrophobicContact CB-CG 3.82Å; L209-L211 HydrophobicContact CD1-CD1 4.22Å; L209-L211 PolarHBondContact O-N 3.22Å; L209-L211 VanDerWaalsContact O-N 3.09Å; L211-E213 PolarHBondContact O-N 3.47Å | ||
| 212 | P | 66.3 | Low | 61.5 | Low | 111 Ų | 111 | 116.1 Ų | 116.1 | 72% | 0.721 | 64% | 0.642 | S | S | * | * | trans | -57.9 | 134.4 | 172.6 | -20.7 | 30.9 | 0 | 0 | 0 | 110.8 | L214 | P212-L214 PolarHBondContact O-N 3.35Å; P212-L214 VanDerWaalsContact O-N 3.09Å | ||
| 213 | E | 64.5 | Low | 61.6 | Low | 197 Ų | 197 | 113.7 Ų | 113.7 | 92% | 0.921 | 64% | 0.637 | S | S | * | * | trans | -60.8 | 114.7 | 175.8 | -138 | 175.8 | -170.2 | 0 | 0 | 109.1 | L211 S215 | L211-E213 PolarHBondContact O-N 3.47Å; E213-S215 PolarHBondContact O-N 3.02Å | ||
| 214 | L | 64.6 | Low | 61.8 | Low | 137 Ų | 137 | 113.8 Ų | 113.8 | 72% | 0.717 | 64% | 0.638 | S | S | * | * | trans | -64.5 | 127.4 | -179.2 | -67.8 | 176.7 | 0 | 0 | 0 | 109.1 | P212 Q216 | P212-L214 PolarHBondContact O-N 3.35Å; P212-L214 VanDerWaalsContact O-N 3.09Å; L214-Q216 PolarHBondContact O-N 3.1Å | ||
| 215 | S | 62.3 | Low | 62.3 | Low | 61 Ų | 61 | 116.2 Ų | 116.2 | 43% | 0.427 | 65% | 0.646 | S | S | . | * | trans | -57 | 139.6 | -174.3 | 97 | 0 | 0 | 0 | 0 | 111.4 | E213 K217 T218 L219 | E213-S215 PolarHBondContact O-N 3.02Å; S215-K217 PolarHBondContact O-N 3.13Å; S215-K217 PolarHBondContact OG-N 3.36Å; S215-T218 PolarHBondContact O-N 2.75Å; S215-T218 PolarHBondContact O-OG1 3.17Å; S215-T218 PolarHBondContact OG-OG1 2.93Å; S215-L219 PolarHBondContact O-N 3.49Å | ||
| 216 | Q | 62.8 | Low | 63 | Low | 145 Ų | 145 | 117.5 Ų | 117.5 | 68% | 0.678 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -58.3 | -16.3 | 176.9 | -64.6 | -174.4 | 1.3 | 0 | 0 | 113.6 | L214 K220 | L214-Q216 PolarHBondContact O-N 3.1Å; Q216-K220 WeakPolarHBondContact O-CB 3.48Å; Q216-K220 WeakPolarHBondContact O-CG 3.48Å; Q216-K220 PolarHBondContact O-N 3.07Å |
| 217 | K | 61 | Low | 63.7 | Low | 181 Ų | 181 | 120.1 Ų | 120.1 | 79% | 0.787 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -70 | -34 | 174.2 | -60.6 | -178.7 | 179.3 | 178.8 | 0 | 111.8 | S215 A221 | S215-K217 PolarHBondContact O-N 3.13Å; S215-K217 PolarHBondContact OG-N 3.36Å; K217-A221 PolarHBondContact O-N 2.9Å |
| 218 | T | 60.8 | Low | 64.6 | Low | 97 Ų | 97 | 123 Ų | 123 | 60% | 0.595 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -76.2 | -35.6 | 177.9 | -31.1 | 0 | 0 | 0 | 0 | 110.9 | S215 | S215-T218 PolarHBondContact O-N 2.75Å; S215-T218 PolarHBondContact O-OG1 3.17Å; S215-T218 PolarHBondContact OG-OG1 2.93Å |
| 219 | L | 61 | Low | 65 | Low | 144 Ų | 144 | 118.6 Ų | 118.6 | 75% | 0.754 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -73.3 | -31.5 | 177 | -125.3 | 91.5 | 0 | 0 | 0 | 113.2 | S215 | S215-L219 PolarHBondContact O-N 3.49Å |
| 220 | K | 61.3 | Low | 65.4 | Low | 164 Ų | 164 | 115.9 Ų | 115.9 | 71% | 0.713 | 62% | 0.621 | S | S | * | * | S | Bend | trans | -90.5 | -1.7 | 177.5 | -71.7 | 178.4 | 177.2 | 173.2 | 0 | 113.6 | Q216 | Q216-K220 WeakPolarHBondContact O-CB 3.48Å; Q216-K220 WeakPolarHBondContact O-CG 3.48Å; Q216-K220 PolarHBondContact O-N 3.07Å |
| 221 | A | 65.2 | Low | 66.1 | Low | 56 Ų | 56 | 118.3 Ų | 118.3 | 46% | 0.463 | 63% | 0.626 | S | S | . | * | S | Bend | trans | -61.3 | 131.3 | 174 | 0 | 0 | 0 | 0 | 0 | 109 | K217 T223 | K217-A221 PolarHBondContact O-N 2.9Å; A221-T223 PolarHBondContact O-N 3.1Å |
| 222 | P | 64.1 | Low | 66.7 | Low | 83 Ų | 83 | 115.8 Ų | 115.8 | 54% | 0.539 | 61% | 0.612 | S | S | . | * | P | Polyproline II helix | trans | -53.3 | 134.7 | 169.3 | -18.7 | 29.4 | 0 | 0 | 0 | 108.5 | L224 K226 | P222-L224 PolarHBondContact O-N 3.33Å; P222-K226 HydrophobicContact CB-CB 3.97Å; P222-K226 HydrophobicContact CB-CD 4.45Å |
| 223 | T | 69.9 | Low | 66.9 | Low | 87 Ų | 87 | 116.1 Ų | 116.1 | 53% | 0.534 | 61% | 0.614 | S | S | . | * | P | Polyproline II helix | trans | -52.8 | 140.5 | 173.4 | -36.3 | 0 | 0 | 0 | 0 | 108.6 | A221 Q225 K226 E227 | A221-T223 PolarHBondContact O-N 3.1Å; T223-Q225 CarbonylContact O-C 3.23Å; T223-Q225 PolarHBondContact O-N 3.28Å; T223-K226 WeakPolarHBondContact O-CA 3.38Å; T223-K226 WeakPolarHBondContact O-CB 3.47Å; T223-K226 PolarHBondContact O-N 3.02Å; T223-E227 PolarHBondContact O-N 3.39Å |
| 224 | L | 68.6 | Low | 67.3 | Low | 119 Ų | 119 | 112.4 Ų | 112.4 | 62% | 0.623 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -43.7 | -36.3 | -177.7 | -173.7 | 75.6 | 0 | 0 | 0 | 113.2 | P222 K226 E227 I228 | P222-L224 PolarHBondContact O-N 3.33Å; L224-K226 PolarHBondContact O-N 3.37Å; L224-E227 PolarHBondContact O-N 3.16Å; L224-I228 HydrophobicContact CD2-CD1 4.11Å; L224-I228 HydrophobicContact CG-CD1 3.79Å; L224-I228 HydrophobicContact CG-CG1 4.37Å; L224-I228 VanDerWaalsContact O-CG1 3.29Å; L224-I228 WeakPolarHBondContact O-CG1 3.45Å; L224-I228 PolarHBondContact O-N 3.31Å |
| 225 | Q | 68.1 | Low | 67.6 | Low | 142 Ų | 142 | 109.1 Ų | 109.1 | 66% | 0.664 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -57.3 | -41.9 | 174.9 | -64.4 | 173.4 | -13.3 | 0 | 0 | 113.7 | T223 L229 | T223-Q225 CarbonylContact O-C 3.23Å; T223-Q225 PolarHBondContact O-N 3.28Å; Q225-L229 WeakPolarHBondContact O-CB 3.37Å; Q225-L229 WeakPolarHBondContact O-CD1 3.47Å; Q225-L229 WeakPolarHBondContact O-CG 3.34Å; Q225-L229 PolarHBondContact O-N 3.07Å |
| 226 | K | 70.3 | Confident | 68.3 | Low | 142 Ų | 142 | 111.7 Ų | 111.7 | 62% | 0.617 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -69 | -34.5 | 177.4 | -70 | -174.7 | 177.2 | 178.5 | 0 | 112.1 | P222 T223 L224 A230 | P222-K226 HydrophobicContact CB-CB 3.97Å; P222-K226 HydrophobicContact CB-CD 4.45Å; T223-K226 WeakPolarHBondContact O-CA 3.38Å; T223-K226 WeakPolarHBondContact O-CB 3.47Å; T223-K226 PolarHBondContact O-N 3.02Å; L224-K226 PolarHBondContact O-N 3.37Å; K226-A230 PolarHBondContact O-N 2.99Å |
| 227 | E | 71.8 | Confident | 69 | Low | 120 Ų | 120 | 106.3 Ų | 106.3 | 56% | 0.561 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -71.9 | -43.9 | 177.2 | -168.1 | 172.2 | -168 | 0 | 0 | 111.3 | T223 L224 L229 A230 L231 | T223-E227 PolarHBondContact O-N 3.39Å; L224-E227 PolarHBondContact O-N 3.16Å; E227-L229 VanDerWaalsContact C-N 3.34Å; E227-L229 PolarHBondContact O-N 2.91Å; E227-A230 PolarHBondContact O-N 3.42Å; E227-L231 PolarHBondContact O-N 3.45Å |
| 228 | I | 71.6 | Confident | 69.8 | Low | 94 Ų | 94 | 102 Ų | 102 | 48% | 0.482 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -61.2 | -42.9 | 174.3 | -67.9 | 168.7 | 0 | 0 | 0 | 110.9 | L224 A230 L231 I232 | L224-I228 HydrophobicContact CD2-CD1 4.11Å; L224-I228 HydrophobicContact CG-CD1 3.79Å; L224-I228 HydrophobicContact CG-CG1 4.37Å; L224-I228 VanDerWaalsContact O-CG1 3.29Å; L224-I228 WeakPolarHBondContact O-CG1 3.45Å; L224-I228 PolarHBondContact O-N 3.31Å; I228-A230 VanDerWaalsContact C-N 3.31Å; I228-A230 PolarHBondContact O-N 3.39Å; I228-L231 PolarHBondContact O-N 2.92Å; I228-I232 HydrophobicContact CG2-CD1 4.49Å |
| 229 | L | 67.5 | Low | 70.8 | Confident | 60 Ų | 60 | 100.4 Ų | 100.4 | 31% | 0.314 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.8 | -32.6 | 178.6 | -78.3 | 169.3 | 0 | 0 | 0 | 113.2 | Q225 E227 L231 Q235 | Q225-L229 WeakPolarHBondContact O-CB 3.37Å; Q225-L229 WeakPolarHBondContact O-CD1 3.47Å; Q225-L229 WeakPolarHBondContact O-CG 3.34Å; Q225-L229 PolarHBondContact O-N 3.07Å; E227-L229 VanDerWaalsContact C-N 3.34Å; E227-L229 PolarHBondContact O-N 2.91Å; L229-L231 VanDerWaalsContact C-N 3.27Å; L229-L231 PolarHBondContact O-N 3.34Å; L229-Q235 HydrophobicContact CB-CG 4.39Å; L229-Q235 HydrophobicContact CD2-CG 4.23Å; L229-Q235 PolarHBondContact O-OE1 3.01Å |
| 230 | A | 68.8 | Low | 71.8 | Confident | 76 Ų | 76 | 100.4 Ų | 100.4 | 63% | 0.628 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -72.1 | -19.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | K226 E227 I228 | K226-A230 PolarHBondContact O-N 2.99Å; E227-A230 PolarHBondContact O-N 3.42Å; I228-A230 VanDerWaalsContact C-N 3.31Å; I228-A230 PolarHBondContact O-N 3.39Å |
| 231 | L | 73.2 | Confident | 72.8 | Confident | 145 Ų | 145 | 97.2 Ų | 97.2 | 76% | 0.759 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.7 | -15.3 | 178.8 | -115.8 | 75.1 | 0 | 0 | 0 | 113.7 | E227 I228 L229 P233 | E227-L231 PolarHBondContact O-N 3.45Å; I228-L231 PolarHBondContact O-N 2.92Å; L229-L231 VanDerWaalsContact C-N 3.27Å; L229-L231 PolarHBondContact O-N 3.34Å; L231-P233 WeakPolarHBondContact O-CD 3.46Å |
| 232 | I | 75.9 | Confident | 73.6 | Confident | 71 Ų | 71 | 99.7 Ų | 99.7 | 36% | 0.364 | 53% | 0.533 | S | S | . | . | S | Bend | trans | -94.3 | 119.4 | -172.9 | -58.7 | 169.1 | 0 | 0 | 0 | 110.6 | I228 N234 L238 | I228-I232 HydrophobicContact CG2-CD1 4.49Å; I232-N234 PolarHBondContact O-N 2.87Å; I232-L238 HydrophobicContact CG2-CD1 3.44Å; I232-L238 VanDerWaalsContact CG2-CD1 3.44Å |
| 233 | P | 71.9 | Confident | 74.6 | Confident | 117 Ų | 117 | 100.3 Ų | 100.3 | 76% | 0.76 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.1 | 134.8 | 173.5 | -19.2 | 31.9 | 0 | 0 | 0 | 111 | L231 | L231-P233 WeakPolarHBondContact O-CD 3.46Š|
| 234 | N | 71.6 | Confident | 75.4 | Confident | 120 Ų | 120 | 101.8 Ų | 101.8 | 64% | 0.642 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.1 | 39.1 | -177.8 | -156.9 | 10.1 | 0 | 0 | 0 | 115.5 | I232 N236 A237 L238 | I232-N234 PolarHBondContact O-N 2.87Å; N234-N236 VanDerWaalsContact C-N 3.26Å; N234-N236 PolarHBondContact O-N 3.46Å; N234-A237 PolarHBondContact O-N 3.24Å; N234-A237 VanDerWaalsContact O-N 3.15Å; N234-A237 VanDerWaalsContact OD1-CB 3.27Å; N234-A237 WeakPolarHBondContact OD1-CB 3.39Å; N234-L238 PolarHBondContact O-N 2.83Å |
| 235 | Q | 72.5 | Confident | 76.1 | Confident | 67 Ų | 67 | 100.4 Ų | 100.4 | 31% | 0.313 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -47.4 | -41.6 | 176.9 | -173.6 | -169.4 | -10 | 0 | 0 | 114.4 | L229 A237 L238 L239 | L229-Q235 HydrophobicContact CB-CG 4.39Å; L229-Q235 HydrophobicContact CD2-CG 4.23Å; L229-Q235 PolarHBondContact O-OE1 3.01Å; Q235-A237 VanDerWaalsContact C-N 3.34Å; Q235-A237 PolarHBondContact O-N 3.46Å; Q235-L238 PolarHBondContact O-N 3.4Å; Q235-L239 HydrophobicContact CG-CD1 4.02Å; Q235-L239 PolarHBondContact O-N 3.41Å |
| 236 | N | 76.6 | Confident | 76.7 | Confident | 116 Ų | 116 | 98.9 Ų | 98.9 | 62% | 0.62 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -71.4 | -27 | -175 | -68.4 | -26.4 | 0 | 0 | 0 | 113.4 | N234 K240 | N234-N236 VanDerWaalsContact C-N 3.26Å; N234-N236 PolarHBondContact O-N 3.46Å; N236-K240 VanDerWaalsContact O-CG 3.29Å; N236-K240 WeakPolarHBondContact O-CG 3.25Å; N236-K240 PolarHBondContact O-N 2.88Å |
| 237 | A | 76.9 | Confident | 77.4 | Confident | 31 Ų | 31 | 96.5 Ų | 96.5 | 26% | 0.256 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -75.7 | -44.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | N234 Q235 L239 K240 D241 | N234-A237 PolarHBondContact O-N 3.24Å; N234-A237 VanDerWaalsContact O-N 3.15Å; N234-A237 VanDerWaalsContact OD1-CB 3.27Å; N234-A237 WeakPolarHBondContact OD1-CB 3.39Å; Q235-A237 VanDerWaalsContact C-N 3.34Å; Q235-A237 PolarHBondContact O-N 3.46Å; A237-L239 VanDerWaalsContact C-N 3.34Å; A237-L239 PolarHBondContact O-N 3.11Å; A237-K240 WeakPolarHBondContact O-CB 3.44Å; A237-K240 PolarHBondContact O-N 3.37Å; A237-K240 VanDerWaalsContact O-N 3.12Å; A237-D241 PolarHBondContact O-N 3.35Å |
| 238 | L | 78.8 | Confident | 78.2 | Confident | 91 Ų | 91 | 92.6 Ų | 92.6 | 48% | 0.476 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.3 | -39.3 | 176.8 | -76.3 | 168.4 | 0 | 0 | 0 | 113 | I232 N234 Q235 K240 D241 L242 | I232-L238 HydrophobicContact CG2-CD1 3.44Å; I232-L238 VanDerWaalsContact CG2-CD1 3.44Å; N234-L238 PolarHBondContact O-N 2.83Å; Q235-L238 PolarHBondContact O-N 3.4Å; L238-K240 VanDerWaalsContact C-N 3.35Å; L238-D241 PolarHBondContact O-N 2.91Å; L238-L242 VanDerWaalsContact O-CB 3.26Å; L238-L242 WeakPolarHBondContact O-CB 3.14Å; L238-L242 PolarHBondContact O-N 2.88Å |
| 239 | L | 80.6 | Confident | 78.8 | Confident | 63 Ų | 63 | 92 Ų | 92 | 33% | 0.33 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.8 | -41.4 | 174.5 | -80.7 | 166.7 | 0 | 0 | 0 | 111.8 | Q235 A237 L242 D243 | Q235-L239 HydrophobicContact CG-CD1 4.02Å; Q235-L239 PolarHBondContact O-N 3.41Å; A237-L239 VanDerWaalsContact C-N 3.34Å; A237-L239 PolarHBondContact O-N 3.11Å; L239-L242 PolarHBondContact O-N 2.87Å; L239-D243 WeakPolarHBondContact O-CB 3.37Å; L239-D243 PolarHBondContact O-N 2.86Å |
| 240 | K | 82.2 | Confident | 79.7 | Confident | 144 Ų | 144 | 96.5 Ų | 96.5 | 63% | 0.626 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -66.1 | -42.4 | 176.6 | -72.6 | 174.2 | -178 | -176.3 | 0 | 112 | N236 A237 L238 L242 D243 I244 | N236-K240 VanDerWaalsContact O-CG 3.29Å; N236-K240 WeakPolarHBondContact O-CG 3.25Å; N236-K240 PolarHBondContact O-N 2.88Å; A237-K240 WeakPolarHBondContact O-CB 3.44Å; A237-K240 PolarHBondContact O-N 3.37Å; A237-K240 VanDerWaalsContact O-N 3.12Å; L238-K240 VanDerWaalsContact C-N 3.35Å; K240-L242 VanDerWaalsContact C-N 3.34Å; K240-D243 PolarHBondContact O-N 3.45Å; K240-I244 WeakPolarHBondContact O-CD1 3.46Å; K240-I244 WeakPolarHBondContact O-CG1 3.42Å; K240-I244 PolarHBondContact O-N 3.23Å |
| 241 | D | 81.9 | Confident | 80.7 | Confident | 97 Ų | 97 | 95.7 Ų | 95.7 | 52% | 0.519 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.6 | -40.2 | 177.9 | -67.6 | -18.2 | 0 | 0 | 0 | 111 | A237 L238 I244 L245 | A237-D241 PolarHBondContact O-N 3.35Å; L238-D241 PolarHBondContact O-N 2.91Å; D241-I244 PolarHBondContact O-N 3.39Å; D241-L245 WeakPolarHBondContact O-CB 3.49Å; D241-L245 PolarHBondContact O-N 3.24Å |
| 242 | L | 82.9 | Confident | 81.4 | Confident | 108 Ų | 108 | 93.8 Ų | 93.8 | 57% | 0.565 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.2 | -41 | 174.8 | -172.5 | 66.1 | 0 | 0 | 0 | 111.9 | L238 L239 K240 I244 L245 H246 | L238-L242 VanDerWaalsContact O-CB 3.26Å; L238-L242 WeakPolarHBondContact O-CB 3.14Å; L238-L242 PolarHBondContact O-N 2.88Å; L239-L242 PolarHBondContact O-N 2.87Å; K240-L242 VanDerWaalsContact C-N 3.34Å; L242-I244 VanDerWaalsContact C-N 3.34Å; L242-L245 PolarHBondContact O-N 3.37Å; L242-H246 VanDerWaalsContact O-CB 3.31Å; L242-H246 WeakPolarHBondContact O-CB 3.43Å; L242-H246 PolarHBondContact O-N 3.48Å |
| 243 | D | 83.9 | Confident | 81.9 | Confident | 96 Ų | 96 | 94 Ų | 94 | 51% | 0.513 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.4 | -40 | 174.5 | -80.3 | -21.8 | 0 | 0 | 0 | 111.5 | L239 K240 L245 N247 | L239-D243 WeakPolarHBondContact O-CB 3.37Å; L239-D243 PolarHBondContact O-N 2.86Å; K240-D243 PolarHBondContact O-N 3.45Å; D243-L245 VanDerWaalsContact C-N 3.35Å; D243-N247 VanDerWaalsContact O-CB 3.23Å; D243-N247 WeakPolarHBondContact O-CB 3.32Å; D243-N247 PolarHBondContact O-N 3.29Å; D243-N247 PolarHBondContact O-ND2 3.2Å |
| 244 | I | 86.8 | Confident | 82.8 | Confident | 118 Ų | 118 | 93.2 Ų | 93.2 | 61% | 0.605 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64 | -42.6 | 174.7 | -67.9 | 162 | 0 | 0 | 0 | 110.2 | K240 D241 L242 N247 S248 | K240-I244 WeakPolarHBondContact O-CD1 3.46Å; K240-I244 WeakPolarHBondContact O-CG1 3.42Å; K240-I244 PolarHBondContact O-N 3.23Å; D241-I244 PolarHBondContact O-N 3.39Å; L242-I244 VanDerWaalsContact C-N 3.34Å; I244-N247 PolarHBondContact O-N 2.99Å; I244-S248 PolarHBondContact O-N 3.47Å |
| 245 | L | 84.1 | Confident | 83.5 | Confident | 91 Ų | 91 | 90.4 Ų | 90.4 | 48% | 0.476 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -67.1 | -45 | 179.9 | -148.2 | 168.9 | 0 | 0 | 0 | 111.3 | D241 L242 D243 N247 S248 M251 | D241-L245 WeakPolarHBondContact O-CB 3.49Å; D241-L245 PolarHBondContact O-N 3.24Å; L242-L245 PolarHBondContact O-N 3.37Å; D243-L245 VanDerWaalsContact C-N 3.35Å; L245-N247 VanDerWaalsContact C-N 3.28Å; L245-N247 PolarHBondContact O-N 2.9Å; L245-S248 VanDerWaalsContact O-CB 3.25Å; L245-S248 WeakPolarHBondContact O-CB 3.26Å; L245-S248 PolarHBondContact O-N 2.94Å; L245-S248 PolarHBondContact O-OG 3.17Å; L245-M251 HydrophobicContact CD2-CE 3.34Å; L245-M251 WeakPolarHBondContact O-CB 3.48Å |
| 246 | H | 81.2 | Confident | 84.3 | Confident | 110 Ų | 110 | 90.9 Ų | 90.9 | 51% | 0.509 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.4 | -34.5 | 175.7 | -169.9 | -90 | 0 | 0 | 0 | 112.2 | L242 S248 | L242-H246 VanDerWaalsContact O-CB 3.31Å; L242-H246 WeakPolarHBondContact O-CB 3.43Å; L242-H246 PolarHBondContact O-N 3.48Å; H246-S248 VanDerWaalsContact C-N 3.33Å |
| 247 | N | 83.7 | Confident | 85 | Confident | 92 Ų | 92 | 92 Ų | 92 | 49% | 0.492 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -83 | -6.7 | 177.5 | -75.6 | -55.4 | 0 | 0 | 0 | 114.7 | D243 I244 L245 K252 | D243-N247 VanDerWaalsContact O-CB 3.23Å; D243-N247 WeakPolarHBondContact O-CB 3.32Å; D243-N247 PolarHBondContact O-N 3.29Å; D243-N247 PolarHBondContact O-ND2 3.2Å; I244-N247 PolarHBondContact O-N 2.99Å; L245-N247 VanDerWaalsContact C-N 3.28Å; L245-N247 PolarHBondContact O-N 2.9Å; N247-K252 WeakPolarHBondContact O-CE 3.36Å; N247-K252 PolarHBondContact O-NZ 2.87Å |
| 248 | S | 89.3 | Confident | 85.6 | Confident | 38 Ų | 38 | 94.1 Ų | 94.1 | 27% | 0.266 | 49% | 0.492 | S | S | . | . | S | Bend | trans | -61.6 | 149.7 | 176.1 | 77.6 | 0 | 0 | 0 | 0 | 111.7 | I244 L245 H246 H250 M251 K252 | I244-S248 PolarHBondContact O-N 3.47Å; L245-S248 VanDerWaalsContact O-CB 3.25Å; L245-S248 WeakPolarHBondContact O-CB 3.26Å; L245-S248 PolarHBondContact O-N 2.94Å; L245-S248 PolarHBondContact O-OG 3.17Å; H246-S248 VanDerWaalsContact C-N 3.33Å; S248-H250 VanDerWaalsContact C-N 3.3Å; S248-H250 PolarHBondContact O-N 3Å; S248-M251 PolarHBondContact O-N 2.95Å; S248-M251 WeakPolarHBondContact OG-CB 3.44Å; S248-M251 PolarHBondContact OG-N 3.41Å; S248-K252 PolarHBondContact O-N 3.47Å; S248-K252 VanDerWaalsContact O-N 3.09Å |
| 249 | S | 85.5 | Confident | 86.1 | Confident | 81 Ų | 81 | 94.6 Ų | 94.6 | 57% | 0.566 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -57.9 | -43.5 | 178.6 | 52.2 | 0 | 0 | 0 | 0 | 111.8 | K252 S253 | S249-K252 PolarHBondContact O-N 3.42Å; S249-S253 PolarHBondContact O-N 3.41Å; S249-S253 PolarHBondContact O-OG 3.48Å; S249-S253 VanDerWaalsContact O-OG 3.05Å |
| 250 | H | 85.6 | Confident | 86.6 | Confident | 155 Ų | 155 | 97 Ų | 97 | 72% | 0.718 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.6 | -43.4 | -179.6 | -63.9 | -68 | 0 | 0 | 0 | 112.7 | S248 S253 M254 | S248-H250 VanDerWaalsContact C-N 3.3Å; S248-H250 PolarHBondContact O-N 3Å; H250-S253 PolarHBondContact O-N 3.37Å; H250-M254 WeakPolarHBondContact O-CB 3.44Å; H250-M254 PolarHBondContact O-N 2.73Å |
| 251 | M | 89.2 | Confident | 86.9 | Confident | 59 Ų | 59 | 92.5 Ų | 92.5 | 29% | 0.291 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -68.9 | -38.7 | 179.5 | -168.5 | 57.2 | 72.3 | 0 | 0 | 111.6 | L245 S248 M254 S255 | L245-M251 HydrophobicContact CD2-CE 3.34Å; L245-M251 WeakPolarHBondContact O-CB 3.48Å; S248-M251 PolarHBondContact O-N 2.95Å; S248-M251 WeakPolarHBondContact OG-CB 3.44Å; S248-M251 PolarHBondContact OG-N 3.41Å; M251-M254 HydrophobicContact CE-CE 4.45Å; M251-M254 PolarHBondContact O-N 2.89Å; M251-M254 HydrophobicContact SD-CE 3.88Å; M251-S255 WeakPolarHBondContact O-CB 3.34Å; M251-S255 PolarHBondContact O-N 2.94Å |
| 252 | K | 87.7 | Confident | 87.1 | Confident | 105 Ų | 105 | 94.8 Ų | 94.8 | 46% | 0.457 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.8 | -46 | 172.9 | -76.2 | 173.8 | 174.5 | 155.6 | 0 | 112 | N247 S248 S249 M254 S255 T256 | N247-K252 WeakPolarHBondContact O-CE 3.36Å; N247-K252 PolarHBondContact O-NZ 2.87Å; S248-K252 PolarHBondContact O-N 3.47Å; S248-K252 VanDerWaalsContact O-N 3.09Å; S249-K252 PolarHBondContact O-N 3.42Å; K252-M254 VanDerWaalsContact C-N 3.32Å; K252-M254 PolarHBondContact O-N 3.41Å; K252-S255 PolarHBondContact O-N 2.9Å; K252-T256 WeakPolarHBondContact O-CG2 3.49Å; K252-T256 PolarHBondContact O-N 3.34Å; K252-T256 PolarHBondContact O-OG1 2.87Å |
| 253 | S | 87.7 | Confident | 87.3 | Confident | 75 Ų | 75 | 95.6 Ų | 95.6 | 52% | 0.524 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.7 | -40.4 | 175.4 | -62.1 | 0 | 0 | 0 | 0 | 112.4 | S249 H250 T256 F257 | S249-S253 PolarHBondContact O-N 3.41Å; S249-S253 PolarHBondContact O-OG 3.48Å; S249-S253 VanDerWaalsContact O-OG 3.05Å; H250-S253 PolarHBondContact O-N 3.37Å; S253-T256 WeakPolarHBondContact CA-OG1 3.43Å; S253-T256 PolarHBondContact O-OG1 3.46Å; S253-F257 WeakPolarHBondContact O-CB 3.2Å; S253-F257 PolarHBondContact O-N 2.9Å |
| 254 | M | 89.9 | Confident | 87.2 | Confident | 101 Ų | 101 | 98.3 Ų | 98.3 | 50% | 0.498 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.1 | -40.7 | 176.3 | -165.1 | 169 | 94.2 | 0 | 0 | 111.7 | H250 M251 K252 F257 I258 | H250-M254 WeakPolarHBondContact O-CB 3.44Å; H250-M254 PolarHBondContact O-N 2.73Å; M251-M254 HydrophobicContact CE-CE 4.45Å; M251-M254 PolarHBondContact O-N 2.89Å; M251-M254 HydrophobicContact SD-CE 3.88Å; K252-M254 VanDerWaalsContact C-N 3.32Å; K252-M254 PolarHBondContact O-N 3.41Å; M254-F257 WeakPolarHBondContact O-CB 3.42Å; M254-F257 PolarHBondContact O-N 3.02Å; M254-I258 HydrophobicContact CE-CD1 4.49Å; M254-I258 HydrophobicContact CG-CD1 4.16Å; M254-I258 VanDerWaalsContact O-CG1 3.32Å; M254-I258 WeakPolarHBondContact O-CG1 3.42Å; M254-I258 PolarHBondContact O-N 3.4Å |
| 255 | S | 87.1 | Confident | 87 | Confident | 60 Ų | 60 | 98.2 Ų | 98.2 | 42% | 0.42 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.4 | -41.5 | 177.9 | -153.3 | 0 | 0 | 0 | 0 | 111.9 | M251 K252 F257 I258 E259 | M251-S255 WeakPolarHBondContact O-CB 3.34Å; M251-S255 PolarHBondContact O-N 2.94Å; K252-S255 PolarHBondContact O-N 2.9Å; S255-F257 VanDerWaalsContact C-N 3.33Å; S255-F257 PolarHBondContact O-N 3.43Å; S255-I258 PolarHBondContact O-N 2.84Å; S255-E259 WeakPolarHBondContact O-CB 3.26Å; S255-E259 PolarHBondContact O-N 3.39Å |
| 256 | T | 88.3 | Confident | 86.1 | Confident | 77 Ų | 77 | 100.1 Ų | 100.1 | 47% | 0.472 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.8 | -38.1 | 174.2 | 49.9 | 0 | 0 | 0 | 0 | 112 | K252 S253 E259 E260 | K252-T256 WeakPolarHBondContact O-CG2 3.49Å; K252-T256 PolarHBondContact O-N 3.34Å; K252-T256 PolarHBondContact O-OG1 2.87Å; S253-T256 WeakPolarHBondContact CA-OG1 3.43Å; S253-T256 PolarHBondContact O-OG1 3.46Å; T256-E259 PolarHBondContact O-N 3.46Å; T256-E260 PolarHBondContact O-N 2.98Å |
| 257 | F | 91.9 | Very high | 85.1 | Confident | 141 Ų | 141 | 99 Ų | 99 | 62% | 0.618 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.7 | -45.3 | 176.2 | 172.8 | -99.5 | 0 | 0 | 0 | 111.9 | S253 M254 S255 E259 E260 A261 | S253-F257 WeakPolarHBondContact O-CB 3.2Å; S253-F257 PolarHBondContact O-N 2.9Å; M254-F257 WeakPolarHBondContact O-CB 3.42Å; M254-F257 PolarHBondContact O-N 3.02Å; S255-F257 VanDerWaalsContact C-N 3.33Å; S255-F257 PolarHBondContact O-N 3.43Å; F257-E259 VanDerWaalsContact C-N 3.35Å; F257-E260 PolarHBondContact O-N 2.98Å; F257-A261 WeakPolarHBondContact O-CB 2.84Å; F257-A261 PolarHBondContact O-N 2.9Å |
| 258 | I | 90.1 | Very high | 83.7 | Confident | 75 Ų | 75 | 102.2 Ų | 102.2 | 39% | 0.385 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.6 | -42.7 | 176.5 | -67.7 | 166.7 | 0 | 0 | 0 | 110.2 | M254 S255 E260 A261 Y262 | M254-I258 HydrophobicContact CE-CD1 4.49Å; M254-I258 HydrophobicContact CG-CD1 4.16Å; M254-I258 VanDerWaalsContact O-CG1 3.32Å; M254-I258 WeakPolarHBondContact O-CG1 3.42Å; M254-I258 PolarHBondContact O-N 3.4Å; S255-I258 PolarHBondContact O-N 2.84Å; I258-E260 PolarHBondContact O-N 3.35Å; I258-A261 WeakPolarHBondContact O-CB 3.26Å; I258-A261 PolarHBondContact O-N 2.91Å; I258-Y262 HydrophobicContact CG2-CD2 3.72Å; I258-Y262 HydrophobicContact CG2-CE2 3.84Å; I258-Y262 WeakPolarHBondContact O-CD2 3.47Å; I258-Y262 PolarHBondContact O-N 3.05Å |
| 259 | E | 89.6 | Confident | 83.4 | Confident | 101 Ų | 101 | 105.4 Ų | 105.4 | 47% | 0.472 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -61.9 | -42.4 | 178 | -167.4 | -175.1 | 155.3 | 0 | 0 | 112.1 | S255 T256 F257 Y262 K263 | S255-E259 WeakPolarHBondContact O-CB 3.26Å; S255-E259 PolarHBondContact O-N 3.39Å; T256-E259 PolarHBondContact O-N 3.46Å; F257-E259 VanDerWaalsContact C-N 3.35Å; E259-Y262 PolarHBondContact O-N 3.36Å; E259-K263 WeakPolarHBondContact O-CB 3.44Å; E259-K263 WeakPolarHBondContact O-CG 3.35Å; E259-K263 PolarHBondContact O-N 3.23Å; E259-K263 VanDerWaalsContact OE1-CE 3.23Å; E259-K263 WeakPolarHBondContact OE1-CE 3.18Å; E259-K263 IonicContact OE1-NZ 2.57Å; E259-K263 PolarHBondContact OE1-NZ 3.42Å |
| 260 | E | 89.1 | Confident | 83.3 | Confident | 113 Ų | 113 | 106.7 Ų | 106.7 | 53% | 0.528 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -63.6 | -40.5 | 173.4 | -77.9 | -173.2 | -175 | 0 | 0 | 112.6 | T256 F257 I258 K263 K264 | T256-E260 PolarHBondContact O-N 2.98Å; F257-E260 PolarHBondContact O-N 2.98Å; I258-E260 PolarHBondContact O-N 3.35Å; E260-K263 PolarHBondContact O-N 3.34Å; E260-K264 WeakPolarHBondContact O-CG 3.48Å; E260-K264 PolarHBondContact O-N 3.06Å |
| 261 | A | 89 | Confident | 83.1 | Confident | 49 Ų | 49 | 104 Ų | 104 | 41% | 0.405 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62.3 | -42.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | F257 I258 K264 L265 | F257-A261 WeakPolarHBondContact O-CB 2.84Å; F257-A261 PolarHBondContact O-N 2.9Å; I258-A261 WeakPolarHBondContact O-CB 3.26Å; I258-A261 PolarHBondContact O-N 2.91Å; A261-K264 PolarHBondContact O-N 3.16Å; A261-L265 PolarHBondContact O-N 2.91Å |
| 262 | Y | 86.1 | Confident | 82.8 | Confident | 146 Ų | 146 | 106.6 Ų | 106.6 | 57% | 0.573 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -67.5 | -39.8 | 175.1 | -91.9 | -80.1 | 0 | 0 | 0 | 112.9 | I258 E259 K264 L265 N266 | I258-Y262 HydrophobicContact CG2-CD2 3.72Å; I258-Y262 HydrophobicContact CG2-CE2 3.84Å; I258-Y262 WeakPolarHBondContact O-CD2 3.47Å; I258-Y262 PolarHBondContact O-N 3.05Å; E259-Y262 PolarHBondContact O-N 3.36Å; Y262-K264 PolarHBondContact O-N 3.45Å; Y262-L265 PolarHBondContact O-N 3.45Å; Y262-L265 VanDerWaalsContact O-N 3.14Å; Y262-N266 PolarHBondContact O-N 2.99Å |
| 263 | K | 86.8 | Confident | 82.5 | Confident | 124 Ų | 124 | 106.8 Ų | 106.8 | 54% | 0.539 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -59.6 | -38.3 | 173.7 | -78.2 | 175.8 | -176.3 | 164.8 | 0 | 111.6 | E259 E260 A267 | E259-K263 WeakPolarHBondContact O-CB 3.44Å; E259-K263 WeakPolarHBondContact O-CG 3.35Å; E259-K263 PolarHBondContact O-N 3.23Å; E259-K263 VanDerWaalsContact OE1-CE 3.23Å; E259-K263 WeakPolarHBondContact OE1-CE 3.18Å; E259-K263 IonicContact OE1-NZ 2.57Å; E259-K263 PolarHBondContact OE1-NZ 3.42Å; E260-K263 PolarHBondContact O-N 3.34Å; K263-A267 VanDerWaalsContact O-CB 3.28Å; K263-A267 WeakPolarHBondContact O-CB 3.12Å; K263-A267 PolarHBondContact O-N 3.46Å |
| 264 | K | 83.6 | Confident | 82.1 | Confident | 154 Ų | 154 | 108.9 Ų | 108.9 | 67% | 0.67 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -69.6 | -35 | 174.9 | -72.5 | 176.9 | -179 | 175.5 | 0 | 112.6 | E260 A261 Y262 | E260-K264 WeakPolarHBondContact O-CG 3.48Å; E260-K264 PolarHBondContact O-N 3.06Å; A261-K264 PolarHBondContact O-N 3.16Å; Y262-K264 PolarHBondContact O-N 3.45Å |
| 265 | L | 81.4 | Confident | 81.6 | Confident | 116 Ų | 116 | 109.4 Ų | 109.4 | 61% | 0.607 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -71.2 | -39 | 177.5 | -172.7 | 65.1 | 0 | 0 | 0 | 112.8 | A261 Y262 A267 | A261-L265 PolarHBondContact O-N 2.91Å; Y262-L265 PolarHBondContact O-N 3.45Å; Y262-L265 VanDerWaalsContact O-N 3.14Å; L265-A267 VanDerWaalsContact C-N 3.29Å; L265-A267 PolarHBondContact O-N 2.82Å |
| 266 | N | 66.3 | Low | 81.2 | Confident | 131 Ų | 131 | 113.2 Ų | 113.2 | 70% | 0.701 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -78.9 | -11 | 178.4 | -70.6 | -19.9 | 0 | 0 | 0 | 113.8 | Y262 | Y262-N266 PolarHBondContact O-N 2.99Å |
| 267 | A | 60.5 | Low | 80.6 | Confident | 87 Ų | 87 | 116.3 Ų | 116.3 | 72% | 0.719 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.3 | 1.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | K263 L265 | K263-A267 VanDerWaalsContact O-CB 3.28Å; K263-A267 WeakPolarHBondContact O-CB 3.12Å; K263-A267 PolarHBondContact O-N 3.46Å; L265-A267 VanDerWaalsContact C-N 3.29Å; L265-A267 PolarHBondContact O-N 2.82Å |
| 268 | S | 52.5 | Low | 79.5 | Confident | 158 Ų | 158 | 114 Ų | 114 | 100% | 1.105 | 61% | 0.609 | S | S | * | * | trans | -100.5 | 0 | 170.4 | -173.1 | 0 | 0 | 0 | 0 | 110.9 |
Retrieved 268 of 268 residues in 65.6 ms
(Link to these results)