| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.3 | Very low | 37.2 | Very low | 253 Ų | 253 | 154.9 Ų | 154.9 | 100% | 1.246 | 82% | 0.818 | S | S | * | * | 0 | 105.8 | 0 | -87.5 | 158.1 | 160.3 | 0 | 0 | 106 | |||||
| 2 | A | 36.8 | Very low | 37 | Very low | 86 Ų | 86 | 156.2 Ų | 156.2 | 71% | 0.711 | 82% | 0.816 | S | S | * | * | trans | -82.4 | 145.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 3 | D | 38.5 | Very low | 36.7 | Very low | 172 Ų | 172 | 153.8 Ų | 153.8 | 92% | 0.92 | 81% | 0.805 | S | S | * | * | trans | -128.5 | 112.2 | 147.4 | -90.2 | -35.8 | 0 | 0 | 0 | 107.6 | ||||
| 4 | N | 35.6 | Very low | 36.4 | Very low | 149 Ų | 149 | 153.3 Ų | 153.3 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | trans | -79.2 | 140 | 165.2 | -91.8 | -6.5 | 0 | 0 | 0 | 108.1 | ||||
| 5 | S | 43.6 | Very low | 36.2 | Very low | 125 Ų | 125 | 155.4 Ų | 155.4 | 87% | 0.874 | 80% | 0.803 | S | S | * | * | trans | -134 | 105.9 | 148.4 | -163.2 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 6 | S | 41.3 | Very low | 35.8 | Very low | 84 Ų | 84 | 152.5 Ų | 152.5 | 59% | 0.587 | 79% | 0.794 | S | S | * | * | trans | -87.4 | 152.1 | 167.5 | -67.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 7 | D | 37.2 | Very low | 35.3 | Very low | 157 Ų | 157 | 152.4 Ų | 152.4 | 84% | 0.84 | 79% | 0.794 | S | S | * | * | trans | 173.8 | 91.7 | 145 | -82.8 | -16.7 | 0 | 0 | 0 | 105.4 | ||||
| 8 | E | 37.4 | Very low | 35.1 | Very low | 141 Ų | 141 | 156.4 Ų | 156.4 | 66% | 0.659 | 80% | 0.797 | S | S | * | * | 75.9 | 109.8 | 78.9 | -76.6 | -156.9 | 162.5 | 0 | 0 | 116 | |||||
| 9 | Y | 30.7 | Very low | 34.8 | Very low | 193 Ų | 193 | 158.8 Ų | 158.8 | 76% | 0.757 | 81% | 0.805 | S | S | * | * | trans | 56.7 | 146.3 | 146.1 | -44.7 | -67.8 | 0 | 0 | 0 | 120.1 | ||||
| 10 | E | 33 | Very low | 34.4 | Very low | 177 Ų | 177 | 154.9 Ų | 154.9 | 83% | 0.827 | 81% | 0.806 | S | S | * | * | cis | -149.5 | 153.5 | 41.3 | -59.5 | -136.9 | 136.9 | 0 | 0 | 114.9 | ||||
| 11 | E | 35.5 | Very low | 34.3 | Very low | 167 Ų | 167 | 155.7 Ų | 155.7 | 78% | 0.78 | 81% | 0.808 | S | S | * | * | trans | -99.2 | 122.6 | 164.4 | 178.7 | -179.7 | -177.9 | 0 | 0 | 107.9 | ||||
| 12 | E | 34.7 | Very low | 34.2 | Very low | 170 Ų | 170 | 149.2 Ų | 149.2 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | trans | -119.5 | 111.1 | 170.8 | -154.3 | 179.6 | 173.1 | 0 | 0 | 110.8 | ||||
| 13 | N | 34.1 | Very low | 33.8 | Very low | 126 Ų | 126 | 154.1 Ų | 154.1 | 67% | 0.674 | 79% | 0.793 | S | S | * | * | trans | -87.1 | 129.4 | 170.5 | -98.5 | -66.7 | 0 | 0 | 0 | 110 | ||||
| 14 | N | 32.1 | Very low | 33.5 | Very low | 146 Ų | 146 | 150.3 Ų | 150.3 | 78% | 0.781 | 79% | 0.785 | S | S | * | * | trans | -153.4 | 85.9 | 158.1 | -106.2 | -28.4 | 0 | 0 | 0 | 114.8 | ||||
| 15 | K | 32.7 | Very low | 33.6 | Very low | 185 Ų | 185 | 148.3 Ų | 148.3 | 80% | 0.804 | 78% | 0.78 | S | S | * | * | 27.8 | 123.5 | 123.7 | -109.2 | -161.3 | 170.1 | -172.2 | 0 | 122.8 | |||||
| 16 | V | 30 | Very low | 32.9 | Very low | 109 Ų | 109 | 145.9 Ų | 145.9 | 66% | 0.661 | 78% | 0.775 | S | S | * | * | trans | 68.9 | 143.2 | 138.9 | -137.1 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 17 | L | 27.9 | Very low | 32.4 | Very low | 151 Ų | 151 | 150.6 Ų | 150.6 | 79% | 0.791 | 79% | 0.787 | S | S | * | * | cis | -152.5 | 136.9 | 31.9 | -106 | 99 | 0 | 0 | 0 | 110.1 | ||||
| 18 | R | 31.4 | Very low | 32.1 | Very low | 224 Ų | 224 | 154.6 Ų | 154.6 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | 61.8 | 112.5 | 85 | -89.3 | -158.3 | -165.2 | -137.7 | 4.7 | 117.4 | |||||
| 19 | E | 28.7 | Very low | 31.7 | Very low | 203 Ų | 203 | 151.6 Ų | 151.6 | 95% | 0.949 | 80% | 0.798 | S | S | * | * | trans | -165.8 | 131.7 | 138.9 | -105.6 | -175 | 164.2 | 0 | 0 | 106.2 | ||||
| 20 | G | 27.9 | Very low | 31.9 | Very low | 79 Ų | 79 | 151.1 Ų | 151.1 | 81% | 0.814 | 80% | 0.799 | S | S | * | * | cis | -165.6 | 147.8 | -2.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 21 | M | 31.5 | Very low | 31.9 | Very low | 172 Ų | 172 | 150.3 Ų | 150.3 | 85% | 0.847 | 80% | 0.801 | S | S | * | * | trans | -83.3 | 171.7 | 166.9 | -89 | 173.1 | 73.2 | 0 | 0 | 109.6 | ||||
| 22 | P | 36.9 | Very low | 31.9 | Very low | 117 Ų | 117 | 149.9 Ų | 149.9 | 76% | 0.76 | 80% | 0.801 | S | S | * | * | cis | -145.4 | 176.9 | 25.4 | 36.2 | -12.5 | 0 | 0 | 0 | 117.8 | ||||
| 23 | Q | 29.3 | Very low | 32 | Very low | 190 Ų | 190 | 148.5 Ų | 148.5 | 89% | 0.888 | 80% | 0.798 | S | S | * | * | trans | -80.1 | 166.2 | 166.3 | -88.2 | -174.4 | 2.9 | 0 | 0 | 114.4 | ||||
| 24 | A | 32.3 | Very low | 32.6 | Very low | 92 Ų | 92 | 147.9 Ų | 147.9 | 76% | 0.76 | 80% | 0.801 | S | S | * | * | trans | 119 | 157.3 | 141.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 25 | P | 38 | Very low | 32.6 | Very low | 106 Ų | 106 | 147.1 Ų | 147.1 | 69% | 0.688 | 80% | 0.802 | S | S | * | * | cis | -135.2 | 170.7 | 8.2 | 38.9 | -19.9 | 0 | 0 | 0 | 116.1 | ||||
| 26 | G | 27.4 | Very low | 33.2 | Very low | 74 Ų | 74 | 143.5 Ų | 143.5 | 76% | 0.763 | 80% | 0.797 | S | S | * | * | trans | -72.9 | 149.7 | 164.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 27 | H | 32.3 | Very low | 33.5 | Very low | 184 Ų | 184 | 144.1 Ų | 144.1 | 85% | 0.852 | 80% | 0.803 | S | S | * | * | trans | -131.6 | 131.4 | 166.9 | -96.8 | -79.2 | 0 | 0 | 0 | 110.8 | ||||
| 28 | R | 29.6 | Very low | 33.6 | Very low | 241 Ų | 241 | 141.6 Ų | 141.6 | 91% | 0.909 | 80% | 0.804 | S | S | * | * | trans | -98.1 | 132.2 | 172 | -167.6 | -172.9 | -153.8 | -163.7 | 7.9 | 107.6 | ||||
| 29 | G | 30.3 | Very low | 33.8 | Very low | 78 Ų | 78 | 137 Ų | 137 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | -162.2 | 121.9 | 169.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 30 | K | 34.4 | Very low | 33.6 | Very low | 183 Ų | 183 | 135.9 Ų | 135.9 | 80% | 0.796 | 80% | 0.798 | S | S | * | * | trans | -98.4 | 146.8 | 172.1 | -70.2 | 175.7 | 171 | -177.1 | 0 | 108.1 | ||||
| 31 | D | 33.6 | Very low | 33.6 | Very low | 160 Ų | 160 | 137.3 Ų | 137.3 | 86% | 0.856 | 80% | 0.796 | S | S | * | * | trans | 173.7 | 103.7 | 150.8 | -76.1 | -35 | 0 | 0 | 0 | 105.7 | ||||
| 32 | M | 35 | Very low | 33.3 | Very low | 158 Ų | 158 | 137.7 Ų | 137.7 | 78% | 0.778 | 80% | 0.8 | S | S | * | * | 45.9 | 125.4 | 83.9 | -60.3 | -64.2 | 106.1 | 0 | 0 | 112.7 | |||||
| 33 | D | 36 | Very low | 32.8 | Very low | 140 Ų | 140 | 141.5 Ų | 141.5 | 75% | 0.749 | 81% | 0.805 | S | S | * | * | cis | -161.5 | -157.2 | 26.6 | -77.4 | -55.1 | 0 | 0 | 0 | 110.2 | ||||
| 34 | P | 47.2 | Very low | 32.5 | Very low | 113 Ų | 113 | 137.3 Ų | 137.3 | 73% | 0.734 | 80% | 0.795 | S | S | * | * | -128.3 | -157.6 | -82.3 | 40.4 | -21.2 | 0 | 0 | 0 | 113.3 | |||||
| 35 | V | 31.9 | Very low | 32.3 | Very low | 130 Ų | 130 | 140.3 Ų | 140.3 | 79% | 0.788 | 79% | 0.793 | S | S | * | * | trans | 110 | 138.6 | 160.4 | -174.8 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 36 | P | 45.5 | Very low | 31.7 | Very low | 110 Ų | 110 | 143.8 Ų | 143.8 | 71% | 0.714 | 80% | 0.801 | S | S | * | * | cis | -137.2 | -169.4 | -45.2 | 43.7 | -22.5 | 0 | 0 | 0 | 111.3 | ||||
| 37 | P | 35.5 | Very low | 31.7 | Very low | 121 Ų | 121 | 146.4 Ų | 146.4 | 79% | 0.786 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -92.9 | 155.5 | -168.4 | 36.2 | -29.5 | 0 | 0 | 0 | 114 | ||
| 38 | A | 31.5 | Very low | 32.2 | Very low | 98 Ų | 98 | 143.1 Ų | 143.1 | 81% | 0.81 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -89.2 | 140.6 | 167.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 39 | P | 34.8 | Very low | 32 | Very low | 127 Ų | 127 | 137 Ų | 137 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -90.7 | 160.6 | -166.6 | 35.6 | -35.4 | 0 | 0 | 0 | 114.7 | ||
| 40 | E | 24.6 | Very low | 31.9 | Very low | 180 Ų | 180 | 142.6 Ų | 142.6 | 84% | 0.841 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 153.1 | 170.5 | -72.7 | -176.7 | 138.4 | 0 | 0 | 114.1 | ||
| 41 | S | 28.2 | Very low | 31.5 | Very low | 109 Ų | 109 | 137 Ų | 137 | 76% | 0.762 | 79% | 0.79 | S | S | * | * | trans | 80.1 | 130.4 | 141.4 | 72 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 42 | L | 25.8 | Very low | 31.2 | Very low | 180 Ų | 180 | 137.9 Ų | 137.9 | 94% | 0.942 | 79% | 0.794 | S | S | * | * | trans | -153.5 | 123.2 | 132.3 | -97.1 | 167.8 | 0 | 0 | 0 | 109.6 | ||||
| 43 | K | 25.7 | Very low | 30.9 | Very low | 197 Ų | 197 | 139.1 Ų | 139.1 | 86% | 0.857 | 80% | 0.798 | S | S | * | * | trans | -104.3 | 148.2 | 167.5 | -109.8 | 178 | 178.3 | 174 | 0 | 108.1 | ||||
| 44 | C | 23.9 | Very low | 30.7 | Very low | 102 Ų | 102 | 144.1 Ų | 144.1 | 69% | 0.689 | 81% | 0.806 | S | S | * | * | trans | 132.9 | 137.7 | 156.6 | -77.6 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 45 | H | 26.5 | Very low | 29.9 | Very low | 155 Ų | 155 | 144.1 Ų | 144.1 | 72% | 0.718 | 80% | 0.804 | S | S | * | * | cis | -163.6 | 144.2 | -2.3 | -94.3 | -62.9 | 0 | 0 | 0 | 108.6 | ||||
| 46 | Q | 26.3 | Very low | 29.7 | Very low | 180 Ų | 180 | 141.5 Ų | 141.5 | 84% | 0.841 | 80% | 0.803 | S | S | * | * | trans | 63 | 145.7 | 143.5 | -70.4 | 173.9 | 15.2 | 0 | 0 | 124.2 | ||||
| 47 | T | 26.2 | Very low | 28.8 | Very low | 129 Ų | 129 | 145.8 Ų | 145.8 | 79% | 0.791 | 81% | 0.805 | S | S | * | * | trans | -89.7 | -163.5 | -164.2 | 57 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 48 | P | 43.4 | Very low | 28.4 | Very low | 114 Ų | 114 | 151.2 Ų | 151.2 | 74% | 0.74 | 81% | 0.812 | S | S | * | * | cis | -137.6 | 171.1 | -9.7 | 33.9 | -12.8 | 0 | 0 | 0 | 116.2 | ||||
| 49 | S | 26.6 | Very low | 28.2 | Very low | 113 Ų | 113 | 155.3 Ų | 155.3 | 79% | 0.79 | 81% | 0.806 | S | S | * | * | -173.5 | 135.5 | 129.8 | 45.7 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 50 | H | 27.1 | Very low | 27.9 | Very low | 196 Ų | 196 | 158.2 Ų | 158.2 | 91% | 0.907 | 81% | 0.809 | S | S | * | * | trans | 17.7 | 128.4 | 157.7 | -83.5 | -100.8 | 0 | 0 | 0 | 118.9 | ||||
| 51 | G | 25.9 | Very low | 28.1 | Very low | 65 Ų | 65 | 153.8 Ų | 153.8 | 67% | 0.67 | 80% | 0.798 | S | S | * | * | cis | 122.7 | 113.7 | 27.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 52 | L | 27.4 | Very low | 28.1 | Very low | 179 Ų | 179 | 157.2 Ų | 157.2 | 94% | 0.937 | 80% | 0.802 | S | S | * | * | trans | -168.1 | 114.9 | 143.6 | -137 | 79.9 | 0 | 0 | 0 | 109.8 | ||||
| 53 | E | 28.5 | Very low | 28.3 | Very low | 184 Ų | 184 | 157 Ų | 157 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | -75.9 | 148.4 | 176.9 | -77.8 | 178.9 | 142.3 | 0 | 0 | 112.2 | ||||
| 54 | R | 31.8 | Very low | 28.3 | Very low | 244 Ų | 244 | 155.8 Ų | 155.8 | 92% | 0.921 | 79% | 0.79 | S | S | * | * | trans | -62 | 119.4 | 169.5 | -179.8 | -180 | -62.8 | 179.9 | -0.3 | 109.9 | ||||
| 55 | V | 30 | Very low | 28.3 | Very low | 113 Ų | 113 | 162.6 Ų | 162.6 | 69% | 0.685 | 80% | 0.802 | S | S | * | * | trans | -123.1 | 113.9 | 164.4 | -67.6 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 56 | G | 27.8 | Very low | 28.5 | Very low | 76 Ų | 76 | 164.6 Ų | 164.6 | 78% | 0.784 | 81% | 0.808 | S | S | * | * | trans | -74.7 | 136 | 168.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 57 | W | 26.6 | Very low | 28.6 | Very low | 200 Ų | 200 | 164.8 Ų | 164.8 | 76% | 0.758 | 81% | 0.809 | S | S | * | * | trans | -97.5 | 102.6 | 171.2 | -70.8 | 95.1 | 0 | 0 | 0 | 108.7 | ||||
| 58 | Y | 27.3 | Very low | 28.6 | Very low | 234 Ų | 234 | 167.9 Ų | 167.9 | 92% | 0.918 | 81% | 0.811 | S | S | * | * | trans | -101.1 | 117.7 | 148.6 | -121.4 | -97.3 | 0 | 0 | 0 | 105.5 | ||||
| 59 | R | 28.4 | Very low | 27.9 | Very low | 184 Ų | 184 | 171.2 Ų | 171.2 | 69% | 0.694 | 81% | 0.814 | S | S | * | * | trans | -115 | 91.2 | 178.5 | -176.5 | -178.6 | -72.9 | -126.5 | -0.2 | 108.7 | ||||
| 60 | E | 27.4 | Very low | 27.9 | Very low | 188 Ų | 188 | 174.3 Ų | 174.3 | 88% | 0.879 | 81% | 0.814 | S | S | * | * | trans | -80.9 | 125.5 | 156.2 | -170.7 | 165.8 | -158.2 | 0 | 0 | 107.6 | ||||
| 61 | S | 28.8 | Very low | 27.7 | Very low | 88 Ų | 88 | 170.2 Ų | 170.2 | 62% | 0.615 | 80% | 0.802 | S | S | * | * | trans | -114.3 | 102.5 | -179.1 | -59.1 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 62 | Q | 29.1 | Very low | 27.8 | Very low | 181 Ų | 181 | 171.7 Ų | 171.7 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | trans | -142.6 | 153.1 | 156.8 | -86.9 | -63.8 | -8.2 | 0 | 0 | 110.1 | ||||
| 63 | K | 28.6 | Very low | 27.8 | Very low | 176 Ų | 176 | 171.3 Ų | 171.3 | 77% | 0.765 | 80% | 0.796 | S | S | * | * | trans | 99.4 | 127.5 | -173 | -59.4 | 177.4 | 176.2 | 175.9 | 0 | 112.9 | ||||
| 64 | H | 25.6 | Very low | 27.8 | Very low | 170 Ų | 170 | 170.1 Ų | 170.1 | 79% | 0.787 | 80% | 0.795 | S | S | * | * | cis | -155.8 | 139.5 | 47.7 | -85.8 | -91.8 | 0 | 0 | 0 | 113.6 | ||||
| 65 | R | 25.4 | Very low | 27.6 | Very low | 246 Ų | 246 | 164.7 Ų | 164.7 | 93% | 0.928 | 79% | 0.789 | S | S | * | * | trans | -119.6 | 128.4 | 141.9 | -170.8 | 169.9 | 171.6 | 174.3 | -3.9 | 108.4 | ||||
| 66 | K | 29.9 | Very low | 28 | Very low | 196 Ų | 196 | 164.4 Ų | 164.4 | 85% | 0.852 | 79% | 0.789 | S | S | * | * | trans | -71.8 | 147.1 | -174.5 | -86.3 | 174.9 | 173.4 | 170.8 | 0 | 112.8 | ||||
| 67 | E | 28.1 | Very low | 28 | Very low | 185 Ų | 185 | 168.5 Ų | 168.5 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | trans | -60.7 | 160.8 | 173.7 | -56.2 | 168.6 | 117.7 | 0 | 0 | 114.9 | ||||
| 68 | K | 27.8 | Very low | 27.9 | Very low | 193 Ų | 193 | 170.2 Ų | 170.2 | 84% | 0.839 | 79% | 0.794 | S | S | * | * | -161.5 | 118.2 | 121.7 | -110.1 | 175 | -175.2 | 177.2 | 0 | 113.4 | |||||
| 69 | K | 27.6 | Very low | 27.9 | Very low | 185 Ų | 185 | 162.3 Ų | 162.3 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | 54 | 137.2 | 136.5 | -84.2 | 176.8 | 170.3 | 175.3 | 0 | 118.7 | ||||
| 70 | K | 26.5 | Very low | 27.8 | Very low | 178 Ų | 178 | 163.6 Ų | 163.6 | 77% | 0.774 | 80% | 0.795 | S | S | * | * | cis | -174.1 | 139 | 39.6 | -147.4 | -174.2 | 176.1 | -175.9 | 0 | 111.1 | ||||
| 71 | T | 22.6 | Very low | 27.9 | Very low | 109 Ų | 109 | 159.9 Ų | 159.9 | 67% | 0.669 | 79% | 0.79 | S | S | * | * | trans | 44.8 | 130.2 | 139.8 | -155.6 | 0 | 0 | 0 | 0 | 120 | ||||
| 72 | S | 28.8 | Very low | 28 | Very low | 97 Ų | 97 | 163.7 Ų | 163.7 | 68% | 0.678 | 80% | 0.798 | S | S | * | * | -172 | 127.2 | 59.8 | -50.7 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 73 | Q | 27.3 | Very low | 28.2 | Very low | 171 Ų | 171 | 162.6 Ų | 162.6 | 80% | 0.799 | 80% | 0.798 | S | S | * | * | 72.9 | 113.5 | 92.3 | -139.3 | -173 | 16.5 | 0 | 0 | 115.6 | |||||
| 74 | L | 28.1 | Very low | 28.5 | Very low | 158 Ų | 158 | 161 Ų | 161 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | trans | 135.9 | 115.3 | 134.9 | -68.8 | 169.6 | 0 | 0 | 0 | 114.5 | ||||
| 75 | T | 27.2 | Very low | 29.3 | Very low | 131 Ų | 131 | 160.7 Ų | 160.7 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | trans | -87.8 | 175.4 | 153.6 | 50.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 76 | P | 38.3 | Very low | 30.3 | Very low | 107 Ų | 107 | 155.9 Ų | 155.9 | 70% | 0.695 | 80% | 0.795 | S | S | * | * | cis | -152.5 | -176.9 | 20.6 | 44.6 | -22.6 | 0 | 0 | 0 | 118.7 | ||||
| 77 | Q | 27.8 | Very low | 31.1 | Very low | 161 Ų | 161 | 154.3 Ų | 154.3 | 75% | 0.752 | 80% | 0.795 | S | S | * | * | trans | 82.2 | 113.9 | 149.2 | -67.6 | -156.7 | -75.2 | 0 | 0 | 123.6 | ||||
| 78 | R | 26.1 | Very low | 32.1 | Very low | 236 Ų | 236 | 152.9 Ų | 152.9 | 89% | 0.891 | 79% | 0.794 | S | S | * | * | 63.9 | 116.8 | 113.8 | -158.4 | -178.8 | -165 | -178.5 | 4 | 120.6 | |||||
| 79 | G | 27.1 | Very low | 32.9 | Very low | 68 Ų | 68 | 151.3 Ų | 151.3 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | trans | 144.9 | 114.2 | 142.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 80 | F | 25.7 | Very low | 33.8 | Very low | 211 Ų | 211 | 150.1 Ų | 150.1 | 93% | 0.925 | 80% | 0.797 | S | S | * | * | trans | 20.2 | 125.4 | 145.9 | -78.9 | -94.8 | 0 | 0 | 0 | 121.1 | ||||
| 81 | S | 30.1 | Very low | 34.7 | Very low | 110 Ų | 110 | 148.6 Ų | 148.6 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | 160.8 | 149.2 | 101.9 | 60.6 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 82 | E | 29.9 | Very low | 35.7 | Very low | 169 Ų | 169 | 150.1 Ų | 150.1 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | -46.2 | 143.5 | -178.6 | -68.3 | 116.1 | 119 | 0 | 0 | 116.8 | ||||
| 83 | N | 33.8 | Very low | 36.4 | Very low | 157 Ų | 157 | 149.5 Ų | 149.5 | 84% | 0.84 | 80% | 0.797 | S | S | * | * | -166.7 | 139.3 | 111.6 | -113.5 | 15.2 | 0 | 0 | 0 | 111.2 | |||||
| 84 | D | 35.6 | Very low | 37.2 | Very low | 142 Ų | 142 | 145.7 Ų | 145.7 | 76% | 0.759 | 79% | 0.79 | S | S | * | * | trans | -56.3 | 143.1 | 171.1 | -60.4 | -63 | 0 | 0 | 0 | 112.2 | ||||
| 85 | D | 41.8 | Very low | 37.7 | Very low | 164 Ų | 164 | 146 Ų | 146 | 88% | 0.877 | 79% | 0.787 | S | S | * | * | trans | -156.6 | 127.6 | 139.2 | -88.6 | -37.5 | 0 | 0 | 0 | 107.8 | ||||
| 86 | D | 45.8 | Very low | 38.3 | Very low | 145 Ų | 145 | 145.2 Ų | 145.2 | 78% | 0.775 | 78% | 0.782 | S | S | * | * | trans | -59.2 | 139.5 | -179.6 | -59.6 | -64 | 0 | 0 | 0 | 112.3 | ||||
| 87 | D | 47.2 | Very low | 38.6 | Very low | 163 Ų | 163 | 147 Ų | 147 | 87% | 0.872 | 79% | 0.785 | S | S | * | * | trans | -157.6 | 109.1 | 145.5 | -92.7 | -33 | 0 | 0 | 0 | 108.2 | ||||
| 88 | D | 48.7 | Very low | 39.2 | Very low | 155 Ų | 155 | 144.2 Ų | 144.2 | 83% | 0.829 | 78% | 0.784 | S | S | * | * | trans | -67.2 | 121.9 | 169.8 | -73.2 | -49.6 | 0 | 0 | 0 | 109.4 | ||||
| 89 | D | 45.8 | Very low | 40.3 | Very low | 160 Ų | 160 | 140.5 Ų | 140.5 | 86% | 0.856 | 78% | 0.782 | S | S | * | * | trans | -129.4 | 89.2 | 161.3 | -87 | -36.9 | 0 | 0 | 0 | 108.6 | D91 | D89-D91 PolarHBondContact O-N 2.65Š| ||
| 90 | D | 46.8 | Very low | 40.9 | Very low | 160 Ų | 160 | 141.8 Ų | 141.8 | 86% | 0.856 | 78% | 0.78 | S | S | * | * | trans | -67.7 | 101.9 | 160.6 | -87.7 | -38.6 | 0 | 0 | 0 | 108.6 | D92 | D90-D92 VanDerWaalsContact C-N 3.29Å; D90-D92 PolarHBondContact O-N 3.37Å; D90-D92 VanDerWaalsContact O-N 3.14Å | ||
| 91 | D | 44.4 | Very low | 42 | Very low | 147 Ų | 147 | 139.8 Ų | 139.8 | 79% | 0.786 | 78% | 0.779 | S | S | * | * | trans | -83.7 | 75 | 168.5 | -164.2 | -1.4 | 0 | 0 | 0 | 109.2 | D89 S93 | D89-D91 PolarHBondContact O-N 2.65Å; D91-S93 PolarHBondContact O-N 2.93Å; D91-S93 PolarHBondContact OD1-OG 3.46Å | ||
| 92 | D | 44.2 | Very low | 42.6 | Very low | 141 Ų | 141 | 140.3 Ų | 140.3 | 75% | 0.754 | 77% | 0.773 | S | S | * | * | trans | -82.9 | 87 | 167.8 | -167.7 | 12 | 0 | 0 | 0 | 108.6 | D90 S94 | D90-D92 VanDerWaalsContact C-N 3.29Å; D90-D92 PolarHBondContact O-N 3.37Å; D90-D92 VanDerWaalsContact O-N 3.14Å; D92-S94 VanDerWaalsContact C-N 3.33Å; D92-S94 PolarHBondContact O-N 3.18Å | ||
| 93 | S | 43.8 | Very low | 43.5 | Very low | 83 Ų | 83 | 140.4 Ų | 140.4 | 58% | 0.58 | 78% | 0.779 | S | S | * | * | trans | -68.9 | 88.5 | 171.2 | -76.5 | 0 | 0 | 0 | 0 | 110.2 | D91 E95 | D91-S93 PolarHBondContact O-N 2.93Å; D91-S93 PolarHBondContact OD1-OG 3.46Å; S93-E95 PolarHBondContact O-N 2.73Å | ||
| 94 | S | 42.8 | Very low | 43.9 | Very low | 92 Ų | 92 | 138.9 Ų | 138.9 | 64% | 0.643 | 77% | 0.771 | S | S | * | * | trans | -78.9 | 94 | 168 | 66.3 | 0 | 0 | 0 | 0 | 110.1 | D92 T96 | D92-S94 VanDerWaalsContact C-N 3.33Å; D92-S94 PolarHBondContact O-N 3.18Å; S94-T96 PolarHBondContact O-N 3.49Å; S94-T96 VanDerWaalsContact O-N 3.09Å | ||
| 95 | E | 38.3 | Very low | 44.7 | Very low | 164 Ų | 164 | 141.2 Ų | 141.2 | 77% | 0.766 | 78% | 0.777 | S | S | * | * | trans | -68.6 | 99.2 | 164.9 | -64.6 | -67.1 | 159.4 | 0 | 0 | 108.3 | S93 D97 | S93-E95 PolarHBondContact O-N 2.73Å; E95-D97 PolarHBondContact O-N 2.91Å | ||
| 96 | T | 39.5 | Very low | 44.7 | Very low | 115 Ų | 115 | 141.9 Ų | 141.9 | 71% | 0.706 | 78% | 0.775 | S | S | * | * | trans | -91 | 90.4 | 170.4 | 69.9 | 0 | 0 | 0 | 0 | 108.2 | S94 S98 | S94-T96 PolarHBondContact O-N 3.49Å; S94-T96 VanDerWaalsContact O-N 3.09Å; T96-S98 VanDerWaalsContact C-N 3.34Å; T96-S98 PolarHBondContact O-N 3.45Å | ||
| 97 | D | 44.9 | Very low | 44.6 | Very low | 143 Ų | 143 | 143.9 Ų | 143.9 | 77% | 0.765 | 78% | 0.78 | S | S | * | * | trans | -68 | 97.5 | 162.2 | -80 | -48.5 | 0 | 0 | 0 | 107.9 | E95 | E95-D97 PolarHBondContact O-N 2.91Š| ||
| 98 | S | 42.1 | Very low | 44.3 | Very low | 104 Ų | 104 | 138.3 Ų | 138.3 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | trans | -102.3 | 85.1 | 170.7 | -162.1 | 0 | 0 | 0 | 0 | 107.6 | T96 S100 | T96-S98 VanDerWaalsContact C-N 3.34Å; T96-S98 PolarHBondContact O-N 3.45Å; S98-S100 PolarHBondContact O-N 3.02Å | ||
| 99 | D | 47.5 | Very low | 44.6 | Very low | 157 Ų | 157 | 134.7 Ų | 134.7 | 84% | 0.84 | 75% | 0.753 | S | S | * | * | trans | -63.2 | 99.7 | 165.7 | -65.7 | -57.1 | 0 | 0 | 0 | 108.7 | ||||
| 100 | S | 40.4 | Very low | 44.9 | Very low | 96 Ų | 96 | 132.9 Ų | 132.9 | 67% | 0.671 | 75% | 0.749 | S | S | * | * | trans | -117.1 | 95.4 | 165.5 | -160.8 | 0 | 0 | 0 | 0 | 107.1 | S98 D102 | S98-S100 PolarHBondContact O-N 3.02Å; S100-D102 VanDerWaalsContact C-N 3.32Å; S100-D102 PolarHBondContact O-N 3.43Å | ||
| 101 | D | 49.7 | Very low | 45.4 | Very low | 168 Ų | 168 | 132.1 Ų | 132.1 | 90% | 0.898 | 74% | 0.744 | S | S | * | * | trans | -59.4 | 97.8 | 158.9 | -78.3 | -43.3 | 0 | 0 | 0 | 107.6 | ||||
| 102 | D | 40.8 | Very low | 46 | Very low | 122 Ų | 122 | 135 Ų | 135 | 65% | 0.652 | 75% | 0.753 | S | S | * | * | trans | -117.7 | 108.3 | 161.4 | -139.6 | -8.8 | 0 | 0 | 0 | 107.2 | S100 D104 | S100-D102 VanDerWaalsContact C-N 3.32Å; S100-D102 PolarHBondContact O-N 3.43Å; D102-D104 PolarHBondContact O-N 3.06Å | ||
| 103 | D | 50.8 | Low | 46.8 | Very low | 171 Ų | 171 | 132.3 Ų | 132.3 | 91% | 0.914 | 76% | 0.759 | S | S | * | * | trans | -65.8 | 68.7 | 170.1 | -84.5 | -49.7 | 0 | 0 | 0 | 109.4 | ||||
| 104 | D | 42.2 | Very low | 47.8 | Very low | 125 Ų | 125 | 131.1 Ų | 131.1 | 67% | 0.668 | 75% | 0.754 | S | S | * | * | trans | -104.6 | 120.6 | 168.4 | -87 | -32.5 | 0 | 0 | 0 | 109 | D102 E106 | D102-D104 PolarHBondContact O-N 3.06Å; D104-E106 VanDerWaalsContact C-N 3.3Å; D104-E106 PolarHBondContact O-N 3Å | ||
| 105 | E | 51.6 | Low | 49.3 | Very low | 190 Ų | 190 | 130.6 Ų | 130.6 | 89% | 0.888 | 74% | 0.738 | S | S | * | * | trans | -50.3 | 93.1 | 171.3 | -75.7 | 162 | 139.6 | 0 | 0 | 109.9 | H107 | E105-H107 VanDerWaalsContact C-N 3.31Å; E105-H107 PolarHBondContact O-N 3.11Å | ||
| 106 | E | 40.7 | Very low | 51.1 | Low | 179 Ų | 179 | 126.5 Ų | 126.5 | 84% | 0.836 | 72% | 0.722 | S | S | * | * | trans | -64.7 | 92.4 | 178.5 | -169 | -176 | 174.8 | 0 | 0 | 108.5 | D104 G108 | D104-E106 VanDerWaalsContact C-N 3.3Å; D104-E106 PolarHBondContact O-N 3Å; E106-G108 PolarHBondContact O-N 2.82Å | ||
| 107 | H | 44.4 | Very low | 52.8 | Low | 186 Ų | 186 | 123.8 Ų | 123.8 | 86% | 0.861 | 71% | 0.706 | S | S | * | * | trans | -62 | 84.7 | 149.4 | -80.6 | -60.9 | 0 | 0 | 0 | 107.2 | E105 A109 | E105-H107 VanDerWaalsContact C-N 3.31Å; E105-H107 PolarHBondContact O-N 3.11Å; H107-A109 PolarHBondContact O-N 2.69Å | ||
| 108 | G | 41.3 | Very low | 54.2 | Low | 46 Ų | 46 | 119.3 Ų | 119.3 | 47% | 0.474 | 69% | 0.689 | S | S | . | * | trans | -47.7 | 137 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110 | E106 | E106-G108 PolarHBondContact O-N 2.82Š| ||
| 109 | A | 53.8 | Low | 55.8 | Low | 80 Ų | 80 | 120.1 Ų | 120.1 | 66% | 0.661 | 69% | 0.685 | S | S | * | * | trans | -44.6 | 139.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | H107 L111 | H107-A109 PolarHBondContact O-N 2.69Å; A109-L111 PolarHBondContact O-N 3.41Å | ||
| 110 | P | 53.8 | Low | 57 | Low | 121 Ų | 121 | 117.8 Ų | 117.8 | 79% | 0.786 | 67% | 0.665 | S | S | * | * | trans | -52.6 | 120.2 | 179.9 | -25 | 33.1 | 0 | 0 | 0 | 109.9 | E112 | P110-E112 PolarHBondContact O-N 3.3Š| ||
| 111 | L | 57.5 | Low | 58.5 | Low | 144 Ų | 144 | 119.6 Ų | 119.6 | 75% | 0.754 | 66% | 0.663 | S | S | * | * | trans | -53.4 | 126.4 | 178.9 | -36.4 | 175.4 | 0 | 0 | 0 | 107.6 | A109 G113 A114 | A109-L111 PolarHBondContact O-N 3.41Å; L111-G113 PolarHBondContact O-N 2.86Å; L111-A114 VanDerWaalsContact O-CB 3.3Å; L111-A114 WeakPolarHBondContact O-CB 3.32Å; L111-A114 PolarHBondContact O-N 2.88Å | ||
| 112 | E | 55.6 | Low | 59.6 | Low | 208 Ų | 208 | 119.8 Ų | 119.8 | 97% | 0.972 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59 | 108.5 | -176.5 | -158.7 | 174.3 | -170.2 | 0 | 0 | 109.6 | P110 | P110-E112 PolarHBondContact O-N 3.3Š|
| 113 | G | 61.9 | Low | 61.4 | Low | 84 Ų | 84 | 118.1 Ų | 118.1 | 87% | 0.866 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 107.7 | 6.4 | -171.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | L111 | L111-G113 PolarHBondContact O-N 2.86Š|
| 114 | A | 65.3 | Low | 62.6 | Low | 58 Ų | 58 | 116.3 Ų | 116.3 | 48% | 0.479 | 65% | 0.646 | S | S | . | * | trans | -67.3 | 150.2 | 172 | 0 | 0 | 0 | 0 | 0 | 112.2 | L111 D116 | L111-A114 VanDerWaalsContact O-CB 3.3Å; L111-A114 WeakPolarHBondContact O-CB 3.32Å; L111-A114 PolarHBondContact O-N 2.88Å; A114-D116 PolarHBondContact O-N 3.42Å | ||
| 115 | Y | 72.8 | Confident | 64.3 | Low | 81 Ų | 81 | 112.1 Ų | 112.1 | 32% | 0.318 | 63% | 0.626 | S | S | . | * | trans | -68.7 | 113.4 | 179.1 | 175.5 | -98.6 | 0 | 0 | 0 | 110.8 | P117 Y120 F133 I136 | Y115-P117 HydrophobicContact CD1-CG 4.36Å; Y115-P117 HydrophobicContact CE1-CB 4.38Å; Y115-P117 HydrophobicContact CE1-CG 4.01Å; Y115-Y120 HydrophobicContact CD2-CD2 4.01Å; Y115-Y120 AromaticContact CD2-CE2 3.71Å; Y115-Y120 HydrophobicContact CD2-CE2 3.71Å; Y115-Y120 AromaticContact CE2-CD2 3.43Å; Y115-Y120 HydrophobicContact CE2-CD2 3.43Å; Y115-Y120 VanDerWaalsContact CE2-CD2 3.43Å; Y115-Y120 AromaticContact CE2-CE2 3.61Å; Y115-Y120 HydrophobicContact CE2-CE2 3.61Å; Y115-Y120 HydrophobicContact CE2-CG 4.21Å; Y115-F133 HydrophobicContact CE2-CD1 4.3Å; Y115-F133 HydrophobicContact CE2-CE1 4.45Å; Y115-F133 WeakPolarHBondContact OH-CD1 3.4Å; Y115-I136 HydrophobicContact CD1-CG2 3.88Å; Y115-I136 HydrophobicContact CE1-CB 4.44Å; Y115-I136 HydrophobicContact CE1-CG2 4.1Å; Y115-I136 HydrophobicContact CG-CG2 4.37Å | ||
| 116 | D | 77.4 | Confident | 65.7 | Low | 78 Ų | 78 | 106 Ų | 106 | 42% | 0.417 | 60% | 0.604 | S | S | . | * | trans | -95.4 | 116.8 | 169.8 | -168.9 | -17.8 | 0 | 0 | 0 | 110.1 | A114 A118 D119 Y120 | A114-D116 PolarHBondContact O-N 3.42Å; D116-A118 PolarHBondContact O-N 3.43Å; D116-A118 WeakPolarHBondContact OD1-CB 3.21Å; D116-A118 PolarHBondContact OD1-N 2.99Å; D116-D119 PolarHBondContact O-N 3.3Å; D116-Y120 VanDerWaalsContact O-CD2 3.23Å; D116-Y120 WeakPolarHBondContact O-CD2 3.3Å | ||
| 117 | P | 73.4 | Confident | 67.5 | Low | 59 Ų | 59 | 101.4 Ų | 101.4 | 38% | 0.383 | 60% | 0.596 | S | S | . | * | G | 310 helix | trans | -55.8 | -31.4 | 175.9 | -25.1 | 34.8 | 0 | 0 | 0 | 114.2 | Y115 D119 Y120 E121 | Y115-P117 HydrophobicContact CD1-CG 4.36Å; Y115-P117 HydrophobicContact CE1-CB 4.38Å; Y115-P117 HydrophobicContact CE1-CG 4.01Å; P117-D119 VanDerWaalsContact C-N 3.34Å; P117-D119 PolarHBondContact O-N 3.47Å; P117-Y120 PolarHBondContact O-N 2.88Å; P117-E121 VanDerWaalsContact O-CG 3.31Å; P117-E121 WeakPolarHBondContact O-CG 3.35Å |
| 118 | A | 74.4 | Confident | 69.3 | Low | 49 Ų | 49 | 100.1 Ų | 100.1 | 41% | 0.405 | 59% | 0.591 | S | S | . | * | G | 310 helix | trans | -67.3 | -32.9 | -175 | 0 | 0 | 0 | 0 | 0 | 112.9 | D116 Y120 | D116-A118 PolarHBondContact O-N 3.43Å; D116-A118 WeakPolarHBondContact OD1-CB 3.21Å; D116-A118 PolarHBondContact OD1-N 2.99Å; A118-Y120 PolarHBondContact O-N 2.89Å |
| 119 | D | 75.9 | Confident | 71.1 | Confident | 120 Ų | 120 | 101.5 Ų | 101.5 | 64% | 0.642 | 59% | 0.586 | S | S | * | * | G | 310 helix | trans | -69 | -20.5 | -178.4 | -75.7 | -18.9 | 0 | 0 | 0 | 113.2 | D116 P117 | D116-D119 PolarHBondContact O-N 3.3Å; P117-D119 VanDerWaalsContact C-N 3.34Å; P117-D119 PolarHBondContact O-N 3.47Å |
| 120 | Y | 73.3 | Confident | 72.3 | Confident | 109 Ų | 109 | 103 Ų | 103 | 43% | 0.427 | 58% | 0.578 | S | S | . | * | G | 310 helix | trans | -110.2 | -0.2 | -174.3 | -57.1 | -80.2 | 0 | 0 | 0 | 114.1 | Y115 D116 P117 A118 H122 L123 | Y115-Y120 HydrophobicContact CD2-CD2 4.01Å; Y115-Y120 AromaticContact CD2-CE2 3.71Å; Y115-Y120 HydrophobicContact CD2-CE2 3.71Å; Y115-Y120 AromaticContact CE2-CD2 3.43Å; Y115-Y120 HydrophobicContact CE2-CD2 3.43Å; Y115-Y120 VanDerWaalsContact CE2-CD2 3.43Å; Y115-Y120 AromaticContact CE2-CE2 3.61Å; Y115-Y120 HydrophobicContact CE2-CE2 3.61Å; Y115-Y120 HydrophobicContact CE2-CG 4.21Å; D116-Y120 VanDerWaalsContact O-CD2 3.23Å; D116-Y120 WeakPolarHBondContact O-CD2 3.3Å; P117-Y120 PolarHBondContact O-N 2.88Å; A118-Y120 PolarHBondContact O-N 2.89Å; Y120-H122 VanDerWaalsContact C-N 3.28Å; Y120-H122 PolarHBondContact O-N 3.27Å; Y120-L123 WeakPolarHBondContact O-CB 3.37Å; Y120-L123 PolarHBondContact O-N 3.39Å |
| 121 | E | 72.4 | Confident | 73.6 | Confident | 134 Ų | 134 | 102.8 Ų | 102.8 | 63% | 0.626 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.3 | -30 | -177.9 | -63.3 | -168.2 | 161.8 | 0 | 0 | 113.5 | P117 L123 | P117-E121 VanDerWaalsContact O-CG 3.31Å; P117-E121 WeakPolarHBondContact O-CG 3.35Å; E121-L123 VanDerWaalsContact C-N 3.29Å; E121-L123 PolarHBondContact O-N 2.86Å |
| 122 | H | 73 | Confident | 74.7 | Confident | 172 Ų | 172 | 101.3 Ų | 101.3 | 80% | 0.796 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.5 | 2.6 | -176.3 | -60.5 | -53.4 | 0 | 0 | 0 | 114 | Y120 | Y120-H122 VanDerWaalsContact C-N 3.28Å; Y120-H122 PolarHBondContact O-N 3.27Å |
| 123 | L | 77.9 | Confident | 75.9 | Confident | 86 Ų | 86 | 94.3 Ų | 94.3 | 45% | 0.45 | 53% | 0.525 | S | S | . | . | trans | -76 | 129.7 | -177.5 | -136.2 | 70.4 | 0 | 0 | 0 | 111.1 | Y120 E121 V125 | Y120-L123 WeakPolarHBondContact O-CB 3.37Å; Y120-L123 PolarHBondContact O-N 3.39Å; E121-L123 VanDerWaalsContact C-N 3.29Å; E121-L123 PolarHBondContact O-N 2.86Å; L123-V125 HydrophobicContact CB-CG1 4.23Å; L123-V125 HydrophobicContact CD2-CG1 3.99Å; L123-V125 HydrophobicContact CG-CG1 4.28Å; L123-V125 PolarHBondContact O-N 3.35Å | ||
| 124 | P | 75.1 | Confident | 76.8 | Confident | 133 Ų | 133 | 95.2 Ų | 95.2 | 86% | 0.864 | 51% | 0.507 | S | S | * | . | trans | -77.4 | 73.2 | 178.4 | 31.4 | -34.4 | 0 | 0 | 0 | 110.8 | ||||
| 125 | V | 78.1 | Confident | 77.5 | Confident | 38 Ų | 38 | 98.2 Ų | 98.2 | 23% | 0.23 | 51% | 0.507 | C | S | . | . | trans | -107.2 | 155 | 179.1 | -65.7 | 0 | 0 | 0 | 0 | 112.1 | L123 I129 K130 F133 | L123-V125 HydrophobicContact CB-CG1 4.23Å; L123-V125 HydrophobicContact CD2-CG1 3.99Å; L123-V125 HydrophobicContact CG-CG1 4.28Å; L123-V125 PolarHBondContact O-N 3.35Å; V125-I129 HydrophobicContact CB-CB 4.15Å; V125-I129 HydrophobicContact CB-CG2 4.03Å; V125-I129 HydrophobicContact CG1-CG2 4.3Å; V125-I129 HydrophobicContact CG2-CB 4.49Å; V125-I129 HydrophobicContact CG2-CG2 4.29Å; V125-K130 HydrophobicContact CG2-CD 4.4Å; V125-K130 HydrophobicContact CG2-CG 3.6Å; V125-K130 WeakPolarHBondContact O-CE 3.32Å; V125-F133 HydrophobicContact CG2-CE2 4.44Å | ||
| 126 | S | 81.6 | Confident | 78 | Confident | 61 Ų | 61 | 98.3 Ų | 98.3 | 43% | 0.427 | 51% | 0.512 | S | S | . | . | trans | -65.8 | 157.7 | 177.8 | 62.2 | 0 | 0 | 0 | 0 | 111.8 | E128 I129 K130 | S126-E128 PolarHBondContact O-N 3.23Å; S126-I129 PolarHBondContact O-N 3.28Å; S126-I129 VanDerWaalsContact OG-CD1 3.29Å; S126-I129 WeakPolarHBondContact OG-CD1 3.21Å; S126-I129 WeakPolarHBondContact OG-CG1 3.46Å; S126-K130 PolarHBondContact O-N 2.85Å; S126-K130 VanDerWaalsContact O-N 3.15Å | ||
| 127 | A | 78.6 | Confident | 78 | Confident | 83 Ų | 83 | 98 Ų | 98 | 69% | 0.686 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -58 | -35.7 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | I129 K130 E131 | A127-I129 VanDerWaalsContact C-N 3.32Å; A127-I129 PolarHBondContact O-N 2.9Å; A127-K130 PolarHBondContact O-N 3.29Å; A127-E131 PolarHBondContact O-N 3.39Å; A127-E131 VanDerWaalsContact O-N 3.09Å |
| 128 | E | 82.1 | Confident | 78.4 | Confident | 159 Ų | 159 | 103.1 Ų | 103.1 | 74% | 0.743 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.3 | -37.2 | 176.8 | -63 | 178.5 | 165.6 | 0 | 0 | 112.3 | S126 E131 L132 | S126-E128 PolarHBondContact O-N 3.23Å; E128-E131 PolarHBondContact O-N 3.29Å; E128-L132 PolarHBondContact O-N 3.41Å; E128-L132 VanDerWaalsContact O-N 3.16Å |
| 129 | I | 79.8 | Confident | 78.8 | Confident | 74 Ų | 74 | 108.7 Ų | 108.7 | 38% | 0.379 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -75.3 | -34 | 179.8 | -60.6 | 169 | 0 | 0 | 0 | 110.4 | V125 S126 A127 E131 L132 F133 | V125-I129 HydrophobicContact CB-CB 4.15Å; V125-I129 HydrophobicContact CB-CG2 4.03Å; V125-I129 HydrophobicContact CG1-CG2 4.3Å; V125-I129 HydrophobicContact CG2-CB 4.49Å; V125-I129 HydrophobicContact CG2-CG2 4.29Å; S126-I129 PolarHBondContact O-N 3.28Å; S126-I129 VanDerWaalsContact OG-CD1 3.29Å; S126-I129 WeakPolarHBondContact OG-CD1 3.21Å; S126-I129 WeakPolarHBondContact OG-CG1 3.46Å; A127-I129 VanDerWaalsContact C-N 3.32Å; A127-I129 PolarHBondContact O-N 2.9Å; I129-E131 VanDerWaalsContact C-N 3.32Å; I129-E131 PolarHBondContact O-N 2.82Å; I129-L132 WeakPolarHBondContact O-CB 3.48Å; I129-L132 PolarHBondContact O-N 2.86Å; I129-L132 VanDerWaalsContact O-N 3.17Å; I129-F133 HydrophobicContact CG2-CD2 4.2Å; I129-F133 HydrophobicContact CG2-CE2 3.69Å; I129-F133 HydrophobicContact CG2-CZ 4.45Å; I129-F133 WeakPolarHBondContact O-CD2 3.4Å; I129-F133 PolarHBondContact O-N 3.48Å |
| 130 | K | 78.6 | Confident | 78.9 | Confident | 113 Ų | 113 | 108.7 Ų | 108.7 | 49% | 0.491 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63.1 | -39.3 | 172.4 | -64.3 | -169.7 | 179.3 | -168.5 | 0 | 112 | V125 S126 A127 L132 F133 Q134 | V125-K130 HydrophobicContact CG2-CD 4.4Å; V125-K130 HydrophobicContact CG2-CG 3.6Å; V125-K130 WeakPolarHBondContact O-CE 3.32Å; S126-K130 PolarHBondContact O-N 2.85Å; S126-K130 VanDerWaalsContact O-N 3.15Å; A127-K130 PolarHBondContact O-N 3.29Å; K130-L132 VanDerWaalsContact C-N 3.28Å; K130-L132 PolarHBondContact O-N 3.05Å; K130-F133 PolarHBondContact O-N 3.31Å; K130-Q134 PolarHBondContact O-N 2.8Å |
| 131 | E | 80.6 | Confident | 79.3 | Confident | 115 Ų | 115 | 107.4 Ų | 107.4 | 54% | 0.537 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.7 | -35 | 174.2 | -164.9 | -178.4 | 168 | 0 | 0 | 111.5 | A127 E128 I129 F133 Q134 Y135 | A127-E131 PolarHBondContact O-N 3.39Å; A127-E131 VanDerWaalsContact O-N 3.09Å; E128-E131 PolarHBondContact O-N 3.29Å; I129-E131 VanDerWaalsContact C-N 3.32Å; I129-E131 PolarHBondContact O-N 2.82Å; E131-F133 PolarHBondContact O-N 2.87Å; E131-Q134 VanDerWaalsContact O-CB 3.27Å; E131-Q134 WeakPolarHBondContact O-CB 3.32Å; E131-Q134 PolarHBondContact O-N 2.79Å; E131-Y135 HydrophobicContact CG-CE2 4.12Å; E131-Y135 WeakPolarHBondContact O-CD2 3.36Å; E131-Y135 PolarHBondContact OE1-OH 3.23Å |
| 132 | L | 82 | Confident | 79.4 | Confident | 113 Ų | 113 | 108.9 Ų | 108.9 | 59% | 0.592 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -62.5 | -42.7 | 175.4 | -169 | 60.4 | 0 | 0 | 0 | 112.8 | E128 I129 K130 Q134 Y135 | E128-L132 PolarHBondContact O-N 3.41Å; E128-L132 VanDerWaalsContact O-N 3.16Å; I129-L132 WeakPolarHBondContact O-CB 3.48Å; I129-L132 PolarHBondContact O-N 2.86Å; I129-L132 VanDerWaalsContact O-N 3.17Å; K130-L132 VanDerWaalsContact C-N 3.28Å; K130-L132 PolarHBondContact O-N 3.05Å; L132-Q134 PolarHBondContact O-N 3.45Å; L132-Y135 HydrophobicContact CD1-CD2 4.4Å; L132-Y135 WeakPolarHBondContact O-CB 3.33Å; L132-Y135 PolarHBondContact O-N 3.31Å; L132-Y135 VanDerWaalsContact O-N 3.08Å |
| 133 | F | 80.9 | Confident | 79.6 | Confident | 61 Ų | 61 | 109.1 Ų | 109.1 | 27% | 0.268 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -61.5 | -31.2 | 175.9 | -73.4 | -62.7 | 0 | 0 | 0 | 112.7 | Y115 V125 I129 K130 E131 Y135 I136 | Y115-F133 HydrophobicContact CE2-CD1 4.3Å; Y115-F133 HydrophobicContact CE2-CE1 4.45Å; Y115-F133 WeakPolarHBondContact OH-CD1 3.4Å; V125-F133 HydrophobicContact CG2-CE2 4.44Å; I129-F133 HydrophobicContact CG2-CD2 4.2Å; I129-F133 HydrophobicContact CG2-CE2 3.69Å; I129-F133 HydrophobicContact CG2-CZ 4.45Å; I129-F133 WeakPolarHBondContact O-CD2 3.4Å; I129-F133 PolarHBondContact O-N 3.48Å; K130-F133 PolarHBondContact O-N 3.31Å; E131-F133 PolarHBondContact O-N 2.87Å; F133-Y135 VanDerWaalsContact C-N 3.25Å; F133-Y135 PolarHBondContact O-N 2.82Å; F133-I136 HydrophobicContact CD1-CD1 3.91Å; F133-I136 WeakPolarHBondContact O-CB 3.48Å; F133-I136 PolarHBondContact O-N 3.29Å |
| 134 | Q | 79.3 | Confident | 79.7 | Confident | 104 Ų | 104 | 111.3 Ų | 111.3 | 49% | 0.486 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -62.7 | -31.7 | 175.1 | -167.3 | 89 | 90.9 | 0 | 0 | 112.4 | K130 E131 L132 I136 R138 | K130-Q134 PolarHBondContact O-N 2.8Å; E131-Q134 VanDerWaalsContact O-CB 3.27Å; E131-Q134 WeakPolarHBondContact O-CB 3.32Å; E131-Q134 PolarHBondContact O-N 2.79Å; L132-Q134 PolarHBondContact O-N 3.45Å; Q134-I136 VanDerWaalsContact C-N 3.3Å; Q134-I136 PolarHBondContact O-N 3.05Å; Q134-R138 WeakPolarHBondContact O-CG 3.33Å; Q134-R138 PolarHBondContact O-N 2.84Å |
| 135 | Y | 81.2 | Confident | 79.6 | Confident | 121 Ų | 121 | 112 Ų | 112 | 48% | 0.475 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -71.4 | -24.9 | 178.5 | -69.1 | -71.7 | 0 | 0 | 0 | 112.9 | E131 L132 F133 R138 Y139 | E131-Y135 HydrophobicContact CG-CE2 4.12Å; E131-Y135 WeakPolarHBondContact O-CD2 3.36Å; E131-Y135 PolarHBondContact OE1-OH 3.23Å; L132-Y135 HydrophobicContact CD1-CD2 4.4Å; L132-Y135 WeakPolarHBondContact O-CB 3.33Å; L132-Y135 PolarHBondContact O-N 3.31Å; L132-Y135 VanDerWaalsContact O-N 3.08Å; F133-Y135 VanDerWaalsContact C-N 3.25Å; F133-Y135 PolarHBondContact O-N 2.82Å; Y135-R138 PolarHBondContact O-N 3.33Å; Y135-Y139 WeakPolarHBondContact O-CB 3.35Å; Y135-Y139 PolarHBondContact O-N 3.41Å; Y135-Y139 VanDerWaalsContact O-N 3.1Å |
| 136 | I | 82.2 | Confident | 79.5 | Confident | 82 Ų | 82 | 116 Ų | 116 | 42% | 0.421 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.9 | -49.1 | 175.7 | -56 | 179.9 | 0 | 0 | 0 | 109.5 | Y115 F133 Q134 R138 Y139 | Y115-I136 HydrophobicContact CD1-CG2 3.88Å; Y115-I136 HydrophobicContact CE1-CB 4.44Å; Y115-I136 HydrophobicContact CE1-CG2 4.1Å; Y115-I136 HydrophobicContact CG-CG2 4.37Å; F133-I136 HydrophobicContact CD1-CD1 3.91Å; F133-I136 WeakPolarHBondContact O-CB 3.48Å; F133-I136 PolarHBondContact O-N 3.29Å; Q134-I136 VanDerWaalsContact C-N 3.3Å; Q134-I136 PolarHBondContact O-N 3.05Å; I136-R138 PolarHBondContact O-N 3.3Å; I136-Y139 PolarHBondContact O-N 2.96Å; I136-Y139 VanDerWaalsContact O-N 3.17Å |
| 137 | S | 78.6 | Confident | 78.9 | Confident | 72 Ų | 72 | 121.2 Ų | 121.2 | 50% | 0.503 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -66.6 | -23 | 177.7 | -51.9 | 0 | 0 | 0 | 0 | 113.5 | ||
| 138 | R | 80.4 | Confident | 78.7 | Confident | 166 Ų | 166 | 123.2 Ų | 123.2 | 63% | 0.626 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -87.9 | -11.6 | 176.8 | -71.9 | 178.7 | -178.6 | 175.4 | 3.5 | 113.4 | Q134 Y135 I136 T140 | Q134-R138 WeakPolarHBondContact O-CG 3.33Å; Q134-R138 PolarHBondContact O-N 2.84Å; Y135-R138 PolarHBondContact O-N 3.33Å; I136-R138 PolarHBondContact O-N 3.3Å; R138-T140 PolarHBondContact O-N 3.39Å |
| 139 | Y | 83.9 | Confident | 78.1 | Confident | 166 Ų | 166 | 125.8 Ų | 125.8 | 65% | 0.651 | 62% | 0.615 | S | S | * | * | trans | -83.4 | 104 | -178.5 | -179.8 | -101.5 | 0 | 0 | 0 | 110.1 | Y135 I136 P141 | Y135-Y139 WeakPolarHBondContact O-CB 3.35Å; Y135-Y139 PolarHBondContact O-N 3.41Å; Y135-Y139 VanDerWaalsContact O-N 3.1Å; I136-Y139 PolarHBondContact O-N 2.96Å; I136-Y139 VanDerWaalsContact O-N 3.17Å; Y139-P141 HydrophobicContact CE1-CB 4.05Å | ||
| 140 | T | 77.7 | Confident | 77.6 | Confident | 120 Ų | 120 | 129.7 Ų | 129.7 | 74% | 0.736 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -88.9 | 117.3 | 165.1 | -51.1 | 0 | 0 | 0 | 0 | 108.3 | R138 Q142 | R138-T140 PolarHBondContact O-N 3.39Å; T140-Q142 PolarHBondContact O-N 3.3Å |
| 141 | P | 80.6 | Confident | 77.3 | Confident | 82 Ų | 82 | 133.4 Ų | 133.4 | 53% | 0.532 | 65% | 0.652 | S | S | . | * | P | Polyproline II helix | trans | -59.9 | 136.5 | 177 | 23.5 | -31.2 | 0 | 0 | 0 | 109.9 | Y139 L143 | Y139-P141 HydrophobicContact CE1-CB 4.05Å; P141-L143 PolarHBondContact O-N 3.28Å |
| 142 | Q | 75.4 | Confident | 76.7 | Confident | 166 Ų | 166 | 132.9 Ų | 132.9 | 78% | 0.776 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 117.4 | 174.3 | -66.3 | -169.5 | 7.5 | 0 | 0 | 108.9 | T140 I144 | T140-Q142 PolarHBondContact O-N 3.3Å; Q142-I144 PolarHBondContact O-N 2.89Å; Q142-I144 VanDerWaalsContact O-N 3.09Å |
| 143 | L | 76.3 | Confident | 76.2 | Confident | 176 Ų | 176 | 136 Ų | 136 | 92% | 0.921 | 67% | 0.668 | S | S | * | * | trans | -71.8 | 100 | 169.2 | -68.7 | 172.3 | 0 | 0 | 0 | 108 | P141 D145 | P141-L143 PolarHBondContact O-N 3.28Å; L143-D145 PolarHBondContact O-N 2.74Å | ||
| 144 | I | 81.4 | Confident | 75.9 | Confident | 132 Ų | 132 | 139.8 Ų | 139.8 | 68% | 0.677 | 69% | 0.689 | S | S | * | * | trans | -88.1 | 102.6 | 171 | -57.8 | 173.3 | 0 | 0 | 0 | 106.4 | Q142 L146 | Q142-I144 PolarHBondContact O-N 2.89Å; Q142-I144 VanDerWaalsContact O-N 3.09Å; I144-L146 PolarHBondContact O-N 2.9Å | ||
| 145 | D | 71.6 | Confident | 75.7 | Confident | 149 Ų | 149 | 137.7 Ų | 137.7 | 80% | 0.797 | 69% | 0.685 | S | S | * | * | trans | -71.3 | 113.7 | 170.1 | -166.1 | 16.3 | 0 | 0 | 0 | 108.5 | L143 | L143-D145 PolarHBondContact O-N 2.74Š| ||
| 146 | L | 77.4 | Confident | 75.3 | Confident | 122 Ų | 122 | 139.1 Ų | 139.1 | 64% | 0.639 | 70% | 0.701 | S | S | * | * | trans | -81 | 127.9 | 179.8 | -70.8 | 164 | 0 | 0 | 0 | 107.8 | I144 H148 | I144-L146 PolarHBondContact O-N 2.9Å; L146-H148 PolarHBondContact O-CE1 3.32Å; L146-H148 PolarHBondContact O-N 3.18Å; L146-H148 VanDerWaalsContact O-N 3.09Å; L146-H148 PolarHBondContact O-ND1 3.49Å | ||
| 147 | D | 69.3 | Low | 74.8 | Confident | 169 Ų | 169 | 143.7 Ų | 143.7 | 90% | 0.904 | 72% | 0.718 | S | S | * | * | trans | -72 | 109.9 | 178.9 | -154.4 | 7.1 | 0 | 0 | 0 | 109.8 | ||||
| 148 | H | 72.9 | Confident | 74.5 | Confident | 126 Ų | 126 | 147.6 Ų | 147.6 | 58% | 0.583 | 73% | 0.732 | S | S | * | * | trans | -90.2 | 124.6 | -174.9 | -50 | 87.4 | 0 | 0 | 0 | 109.8 | L146 L150 | L146-H148 PolarHBondContact O-CE1 3.32Å; L146-H148 PolarHBondContact O-N 3.18Å; L146-H148 VanDerWaalsContact O-N 3.09Å; L146-H148 PolarHBondContact O-ND1 3.49Å; H148-L150 PolarHBondContact O-N 3.4Å; H148-L150 VanDerWaalsContact O-N 3.1Å | ||
| 149 | K | 70.3 | Confident | 73.9 | Confident | 212 Ų | 212 | 144.5 Ų | 144.5 | 92% | 0.922 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -63.7 | -17.6 | 177.1 | -66.8 | -171.5 | 178.4 | -176.3 | 0 | 114.3 | ||
| 150 | L | 68.9 | Low | 73.4 | Confident | 157 Ų | 157 | 141.5 Ų | 141.5 | 82% | 0.822 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -135.4 | 106.2 | 179.7 | -65.2 | 172.1 | 0 | 0 | 0 | 107.8 | H148 | H148-L150 PolarHBondContact O-N 3.4Å; H148-L150 VanDerWaalsContact O-N 3.1Å |
| 151 | K | 72.2 | Confident | 72.8 | Confident | 190 Ų | 190 | 141.6 Ų | 141.6 | 83% | 0.826 | 74% | 0.743 | S | S | * | * | trans | -86.3 | 128.9 | 169.1 | -172.7 | 175.8 | 180 | 179.2 | 0 | 107.8 | F153 | K151-F153 PolarHBondContact O-N 2.85Å; K151-F153 VanDerWaalsContact O-N 3.12Å | ||
| 152 | P | 68.1 | Low | 72.2 | Confident | 104 Ų | 104 | 140.5 Ų | 140.5 | 68% | 0.675 | 75% | 0.746 | S | S | * | * | trans | -53.6 | 120.6 | 169.5 | -22 | 32.2 | 0 | 0 | 0 | 109 | I154 | P152-I154 PolarHBondContact O-N 2.98Š| ||
| 153 | F | 72.6 | Confident | 72 | Confident | 178 Ų | 178 | 140.4 Ų | 140.4 | 78% | 0.781 | 75% | 0.751 | S | S | * | * | trans | -78.2 | 102 | 174 | 178.7 | -105.9 | 0 | 0 | 0 | 107.4 | K151 P155 | K151-F153 PolarHBondContact O-N 2.85Å; K151-F153 VanDerWaalsContact O-N 3.12Å; F153-P155 HydrophobicContact CD1-CG 4.01Å; F153-P155 HydrophobicContact CE1-CB 3.85Å; F153-P155 HydrophobicContact CE1-CG 3.62Å; F153-P155 HydrophobicContact CZ-CB 4.09Å; F153-P155 HydrophobicContact CZ-CG 4.35Å | ||
| 154 | I | 72.9 | Confident | 71.6 | Confident | 141 Ų | 141 | 139.2 Ų | 139.2 | 72% | 0.723 | 74% | 0.744 | S | S | * | * | trans | -98.4 | 107.5 | 168.2 | -55.6 | 172.1 | 0 | 0 | 0 | 104.5 | P152 | P152-I154 PolarHBondContact O-N 2.98Š| ||
| 155 | P | 76.7 | Confident | 71.2 | Confident | 60 Ų | 60 | 138.3 Ų | 138.3 | 39% | 0.39 | 74% | 0.74 | S | S | . | * | trans | -65.4 | 135.8 | 178.7 | -4.5 | 15.8 | 0 | 0 | 0 | 109.8 | F153 F157 | F153-P155 HydrophobicContact CD1-CG 4.01Å; F153-P155 HydrophobicContact CE1-CB 3.85Å; F153-P155 HydrophobicContact CE1-CG 3.62Å; F153-P155 HydrophobicContact CZ-CB 4.09Å; F153-P155 HydrophobicContact CZ-CG 4.35Å; P155-F157 PolarHBondContact O-N 2.83Å; P155-F157 VanDerWaalsContact O-N 3.1Å | ||
| 156 | D | 72.9 | Confident | 71.1 | Confident | 152 Ų | 152 | 135.3 Ų | 135.3 | 81% | 0.813 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -62 | -16.6 | 174.7 | -57.3 | -24.4 | 0 | 0 | 0 | 112.7 | ||
| 157 | F | 71 | Confident | 70.4 | Confident | 178 Ų | 178 | 137.2 Ų | 137.2 | 78% | 0.781 | 74% | 0.739 | S | S | * | * | trans | -126.1 | 110.3 | 179 | -57.1 | -76.2 | 0 | 0 | 0 | 109.5 | P155 | P155-F157 PolarHBondContact O-N 2.83Å; P155-F157 VanDerWaalsContact O-N 3.1Å | ||
| 158 | I | 71.3 | Confident | 70.3 | Confident | 154 Ų | 154 | 136.4 Ų | 136.4 | 79% | 0.79 | 73% | 0.734 | S | S | * | * | trans | -75.7 | 121.7 | 163.5 | -58.4 | 170 | 0 | 0 | 0 | 105.6 | A160 | I158-A160 PolarHBondContact O-N 3.29Š| ||
| 159 | P | 69.6 | Low | 70.3 | Confident | 101 Ų | 101 | 134.9 Ų | 134.9 | 66% | 0.656 | 73% | 0.726 | S | S | * | * | trans | -57.1 | 121.2 | 171.9 | 22.8 | -30 | 0 | 0 | 0 | 107.2 | V161 | P159-V161 PolarHBondContact O-N 3.43Š| ||
| 160 | A | 71.9 | Confident | 70.4 | Confident | 102 Ų | 102 | 130.8 Ų | 130.8 | 84% | 0.843 | 72% | 0.718 | S | S | * | * | trans | -62.1 | 93.3 | 169.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | I158 G162 | I158-A160 PolarHBondContact O-N 3.29Å; A160-G162 PolarHBondContact O-N 3.41Å | ||
| 161 | V | 66.6 | Low | 70.5 | Confident | 123 Ų | 123 | 128.2 Ų | 128.2 | 75% | 0.745 | 71% | 0.711 | S | S | * | * | trans | -65.1 | 98.5 | 164.1 | -178.9 | 0 | 0 | 0 | 0 | 103 | P159 | P159-V161 PolarHBondContact O-N 3.43Š| ||
| 162 | G | 68 | Low | 70.8 | Confident | 58 Ų | 58 | 124 Ų | 124 | 60% | 0.598 | 69% | 0.69 | S | S | * | * | trans | -51.4 | 145.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | A160 I164 | A160-G162 PolarHBondContact O-N 3.41Å; G162-I164 PolarHBondContact O-N 3.49Å | ||
| 163 | D | 70.8 | Confident | 71.4 | Confident | 165 Ų | 165 | 126 Ų | 126 | 88% | 0.882 | 70% | 0.703 | S | S | * | * | trans | -45.5 | 133.6 | -178.9 | -71.7 | -35.9 | 0 | 0 | 0 | 110.5 | D165 | D163-D165 PolarHBondContact O-N 2.91Š| ||
| 164 | I | 66.7 | Low | 71.8 | Confident | 151 Ų | 151 | 121.4 Ų | 121.4 | 77% | 0.774 | 69% | 0.687 | S | S | * | * | trans | -59.4 | 111.4 | 175 | -52.8 | 170.2 | 0 | 0 | 0 | 105.4 | G162 A166 | G162-I164 PolarHBondContact O-N 3.49Å; I164-A166 PolarHBondContact O-N 2.96Å | ||
| 165 | D | 73.2 | Confident | 72.1 | Confident | 113 Ų | 113 | 118.1 Ų | 118.1 | 60% | 0.604 | 69% | 0.687 | S | S | * | * | trans | -49.8 | 118.4 | 172.5 | 178.9 | -3.8 | 0 | 0 | 0 | 107.1 | D163 F167 | D163-D165 PolarHBondContact O-N 2.91Å; D165-F167 WeakPolarHBondContact O-CD2 3.12Å; D165-F167 PolarHBondContact O-N 3.48Å; D165-F167 PolarHBondContact OD1-N 3.27Å | ||
| 166 | A | 70.5 | Confident | 72.3 | Confident | 85 Ų | 85 | 121.1 Ų | 121.1 | 70% | 0.702 | 69% | 0.694 | S | S | * | * | trans | -66.5 | 7.5 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | I164 L168 | I164-A166 PolarHBondContact O-N 2.96Å; A166-L168 PolarHBondContact O-N 2.94Å | ||
| 167 | F | 61.3 | Low | 72.3 | Confident | 163 Ų | 163 | 118.5 Ų | 118.5 | 72% | 0.715 | 69% | 0.685 | S | S | * | * | trans | 54 | 32.9 | -170.7 | -67 | -85.1 | 0 | 0 | 0 | 110.9 | D165 K169 | D165-F167 WeakPolarHBondContact O-CD2 3.12Å; D165-F167 PolarHBondContact O-N 3.48Å; D165-F167 PolarHBondContact OD1-N 3.27Å; F167-K169 PolarHBondContact O-N 2.81Å | ||
| 168 | L | 68.8 | Low | 72.3 | Confident | 151 Ų | 151 | 112.5 Ų | 112.5 | 79% | 0.791 | 66% | 0.661 | S | S | * | * | trans | -75.4 | 75.5 | 177.8 | -166.4 | 74.5 | 0 | 0 | 0 | 108.7 | A166 V170 | A166-L168 PolarHBondContact O-N 2.94Å; L168-V170 PolarHBondContact O-N 3.35Å | ||
| 169 | K | 71 | Confident | 72.3 | Confident | 95 Ų | 95 | 108.5 Ų | 108.5 | 41% | 0.413 | 64% | 0.642 | S | S | . | * | trans | -70.8 | 113.7 | 176.2 | -67.6 | -155 | 173.5 | 178 | 0 | 108.9 | F167 P171 L180 | F167-K169 PolarHBondContact O-N 2.81Å; K169-P171 WeakPolarHBondContact O-CD 3.49Å; K169-P171 VanDerWaalsContact O-N 3.13Å; K169-L180 PolarHBondContact NZ-O 3.42Å | ||
| 170 | V | 74.1 | Confident | 72.1 | Confident | 126 Ų | 126 | 108.9 Ų | 108.9 | 76% | 0.764 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 119 | 170.4 | -179.4 | 0 | 0 | 0 | 0 | 107.4 | L168 | L168-V170 PolarHBondContact O-N 3.35Š|
| 171 | P | 71.1 | Confident | 71.6 | Confident | 103 Ų | 103 | 106 Ų | 106 | 67% | 0.669 | 62% | 0.618 | S | S | * | * | P | Polyproline II helix | trans | -62 | 147.5 | -179.3 | 25.8 | -33.5 | 0 | 0 | 0 | 109.2 | K169 | K169-P171 WeakPolarHBondContact O-CD 3.49Å; K169-P171 VanDerWaalsContact O-N 3.13Å |
| 172 | R | 77 | Confident | 71.6 | Confident | 102 Ų | 102 | 107.1 Ų | 107.1 | 39% | 0.385 | 62% | 0.619 | S | S | . | * | P | Polyproline II helix | trans | -54.1 | 135.5 | 178.1 | -79.8 | -167.8 | -86.8 | -158.8 | -9.8 | 110.2 | D174 G175 K176 P177 | R172-D174 WeakPolarHBondContact CB-OD1 3.45Å; R172-D174 IonicContact NE-OD1 3.9Å; R172-D174 PolarHBondContact O-N 3.35Å; R172-G175 PolarHBondContact O-N 3.48Å; R172-K176 PolarHBondContact NE-O 3.44Å; R172-P177 PolarHBondContact NH2-O 3.22Å |
| 173 | P | 80.8 | Confident | 71.4 | Confident | 146 Ų | 146 | 111.1 Ų | 111.1 | 95% | 0.948 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.2 | -18.2 | 175.9 | -23 | 31.6 | 0 | 0 | 0 | 113.6 | ||
| 174 | D | 81.5 | Confident | 71.2 | Confident | 81 Ų | 81 | 106.7 Ų | 106.7 | 43% | 0.433 | 61% | 0.605 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.8 | -1.3 | 179.5 | 80 | -10.7 | 0 | 0 | 0 | 114.3 | R172 K176 | R172-D174 WeakPolarHBondContact CB-OD1 3.45Å; R172-D174 IonicContact NE-OD1 3.9Å; R172-D174 PolarHBondContact O-N 3.35Å; D174-K176 PolarHBondContact O-N 3.3Å; D174-K176 WeakPolarHBondContact OD1-CB 3.46Å; D174-K176 PolarHBondContact OD1-N 3.13Å; D174-K176 WeakPolarHBondContact OD2-CD 3.45Å; D174-K176 WeakPolarHBondContact OD2-CE 3.29Å; D174-K176 WeakPolarHBondContact OD2-CG 3.39Å; D174-K176 IonicContact OD2-NZ 3.94Å; D174-K176 PolarHBondContact OD2-NZ 2.87Å |
| 175 | G | 79.9 | Confident | 71.4 | Confident | 71 Ų | 71 | 105.4 Ų | 105.4 | 73% | 0.732 | 60% | 0.598 | S | S | * | * | trans | 68.7 | 9.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | R172 | R172-G175 PolarHBondContact O-N 3.48Š| ||
| 176 | K | 80.2 | Confident | 71.2 | Confident | 123 Ų | 123 | 106.7 Ų | 106.7 | 54% | 0.535 | 61% | 0.605 | S | S | . | * | P | Polyproline II helix | trans | -79.9 | 141.8 | 175.5 | -65.4 | -171.6 | -164.6 | 110.3 | 0 | 110.9 | R172 D174 D178 | R172-K176 PolarHBondContact NE-O 3.44Å; D174-K176 PolarHBondContact O-N 3.3Å; D174-K176 WeakPolarHBondContact OD1-CB 3.46Å; D174-K176 PolarHBondContact OD1-N 3.13Å; D174-K176 WeakPolarHBondContact OD2-CD 3.45Å; D174-K176 WeakPolarHBondContact OD2-CE 3.29Å; D174-K176 WeakPolarHBondContact OD2-CG 3.39Å; D174-K176 IonicContact OD2-NZ 3.94Å; D174-K176 PolarHBondContact OD2-NZ 2.87Å; K176-D178 PolarHBondContact O-N 3.45Å; K176-D178 VanDerWaalsContact O-N 3.14Å |
| 177 | P | 73.4 | Confident | 71.4 | Confident | 97 Ų | 97 | 104.8 Ų | 104.8 | 63% | 0.63 | 58% | 0.582 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 120.3 | -178.3 | 24.4 | -34.2 | 0 | 0 | 0 | 110.2 | R172 N179 | R172-P177 PolarHBondContact NH2-O 3.22Å; P177-N179 PolarHBondContact O-ND2 3.04Å |
| 178 | D | 70.6 | Confident | 71.5 | Confident | 52 Ų | 52 | 104 Ų | 104 | 28% | 0.278 | 59% | 0.593 | S | S | . | * | P | Polyproline II helix | trans | -77.6 | 123.7 | 175.6 | -171.5 | 11.1 | 0 | 0 | 0 | 109.9 | K176 L180 | K176-D178 PolarHBondContact O-N 3.45Å; K176-D178 VanDerWaalsContact O-N 3.14Å; D178-L180 WeakPolarHBondContact OD1-CB 3.47Å; D178-L180 WeakPolarHBondContact OD1-CD1 3.5Å; D178-L180 WeakPolarHBondContact OD1-CG 3.41Å; D178-L180 PolarHBondContact OD1-N 2.86Å; D178-L180 VanDerWaalsContact OD1-N 3.09Å |
| 179 | N | 71.3 | Confident | 71.4 | Confident | 71 Ų | 71 | 100.1 Ų | 100.1 | 38% | 0.38 | 58% | 0.578 | S | S | . | * | trans | -109 | 11.9 | -178.3 | -59.1 | -60.9 | 0 | 0 | 0 | 112.1 | P177 G181 L182 L183 | P177-N179 PolarHBondContact O-ND2 3.04Å; N179-G181 PolarHBondContact O-N 3.21Å; N179-L182 PolarHBondContact O-N 2.97Å; N179-L183 HydrophobicContact CB-CD1 3.59Å; N179-L183 PolarHBondContact O-N 3.21Å; N179-L183 VanDerWaalsContact O-N 3.14Å | ||
| 180 | L | 64.7 | Low | 71.3 | Confident | 109 Ų | 109 | 103 Ų | 103 | 57% | 0.571 | 61% | 0.605 | S | S | * | * | B | Isolated β-bridge | trans | -63.2 | 119.2 | 175.4 | -73.1 | 167.7 | 0 | 0 | 0 | 110.2 | K169 D178 | K169-L180 PolarHBondContact NZ-O 3.42Å; D178-L180 WeakPolarHBondContact OD1-CB 3.47Å; D178-L180 WeakPolarHBondContact OD1-CD1 3.5Å; D178-L180 WeakPolarHBondContact OD1-CG 3.41Å; D178-L180 PolarHBondContact OD1-N 2.86Å; D178-L180 VanDerWaalsContact OD1-N 3.09Å |
| 181 | G | 62.3 | Low | 71.1 | Confident | 41 Ų | 41 | 105.4 Ų | 105.4 | 42% | 0.423 | 60% | 0.604 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 98.3 | -19.2 | -172.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | N179 V184 | N179-G181 PolarHBondContact O-N 3.21Å; G181-V184 VanDerWaalsContact CA-O 3.23Å; G181-V184 WeakPolarHBondContact CA-O 3.47Å; G181-V184 PolarHBondContact N-O 3.33Å |
| 182 | L | 66.6 | Low | 71.2 | Confident | 147 Ų | 147 | 107.1 Ų | 107.1 | 77% | 0.77 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.4 | -39 | 174.8 | -66.1 | 175.6 | 0 | 0 | 0 | 112.6 | N179 | N179-L182 PolarHBondContact O-N 2.97Š|
| 183 | L | 64.9 | Low | 71.3 | Confident | 142 Ų | 142 | 104.1 Ų | 104.1 | 74% | 0.743 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.7 | -32.8 | 176.1 | -89.2 | 112.1 | 0 | 0 | 0 | 113.6 | N179 | N179-L183 HydrophobicContact CB-CD1 3.59Å; N179-L183 PolarHBondContact O-N 3.21Å; N179-L183 VanDerWaalsContact O-N 3.14Å |
| 184 | V | 66.5 | Low | 71.2 | Confident | 72 Ų | 72 | 99.8 Ų | 99.8 | 44% | 0.436 | 57% | 0.567 | S | S | . | * | B | Isolated β-bridge | trans | -129.4 | 118.4 | -179.3 | -178 | 0 | 0 | 0 | 0 | 107 | G181 | G181-V184 VanDerWaalsContact CA-O 3.23Å; G181-V184 WeakPolarHBondContact CA-O 3.47Å; G181-V184 PolarHBondContact N-O 3.33Å |
| 185 | L | 69.8 | Low | 71 | Confident | 123 Ų | 123 | 99.9 Ų | 99.9 | 64% | 0.644 | 57% | 0.572 | S | S | * | * | trans | -69.2 | 132.2 | 174.6 | -145.9 | 92.2 | 0 | 0 | 0 | 108.3 | E187 | L185-E187 HydrophobicContact CD2-CG 4.46Å; L185-E187 PolarHBondContact O-N 2.64Å | ||
| 186 | D | 69.3 | Low | 71 | Confident | 140 Ų | 140 | 97.4 Ų | 97.4 | 75% | 0.749 | 54% | 0.543 | S | S | * | . | trans | -84 | 103.9 | 173.6 | -161.1 | 10.3 | 0 | 0 | 0 | 107.9 | ||||
| 187 | E | 74.6 | Confident | 70.9 | Confident | 46 Ų | 46 | 92.3 Ų | 92.3 | 22% | 0.215 | 52% | 0.522 | C | S | . | . | trans | -90.4 | 138 | 178.9 | -67 | 178.4 | 178 | 0 | 0 | 108.8 | L185 S189 S193 | L185-E187 HydrophobicContact CD2-CG 4.46Å; L185-E187 PolarHBondContact O-N 2.64Å; E187-S189 PolarHBondContact O-N 3.5Å; E187-S193 PolarHBondContact OE1-OG 2.76Å; E187-S193 VanDerWaalsContact OE2-CB 3.29Å; E187-S193 WeakPolarHBondContact OE2-CB 3.38Å; E187-S193 PolarHBondContact OE2-N 2.81Å; E187-S193 PolarHBondContact OE2-OG 3.11Å | ||
| 188 | P | 64 | Low | 71.2 | Confident | 146 Ų | 146 | 91 Ų | 91 | 95% | 0.948 | 51% | 0.509 | S | S | * | . | S | Bend | trans | -67.2 | 4.4 | 179.1 | 29.2 | -36.3 | 0 | 0 | 0 | 113.7 | ||
| 189 | S | 65.4 | Low | 71.5 | Confident | 69 Ų | 69 | 89.8 Ų | 89.8 | 48% | 0.483 | 51% | 0.505 | S | S | . | . | S | Bend | trans | -90.3 | 132.6 | 179.7 | 176.3 | 0 | 0 | 0 | 0 | 110.8 | E187 K191 | E187-S189 PolarHBondContact O-N 3.5Å; S189-K191 VanDerWaalsContact CB-O 3.28Å; S189-K191 WeakPolarHBondContact CB-O 3.4Å; S189-K191 PolarHBondContact O-N 3.42Å; S189-K191 PolarHBondContact OG-N 3.47Å; S189-K191 VanDerWaalsContact OG-N 3.16Å; S189-K191 PolarHBondContact OG-O 3.08Å |
| 190 | T | 68.9 | Low | 71.8 | Confident | 157 Ų | 157 | 88.4 Ų | 88.4 | 96% | 0.963 | 50% | 0.498 | S | S | * | . | S | Bend | trans | -58.5 | -17.9 | 170.8 | -39.8 | 0 | 0 | 0 | 0 | 112.6 | ||
| 191 | K | 71.1 | Confident | 72.4 | Confident | 175 Ų | 175 | 87.4 Ų | 87.4 | 76% | 0.761 | 49% | 0.486 | S | S | * | . | S | Bend | trans | -117.8 | 117.5 | 173.7 | -62.9 | 178.6 | -176.1 | 175 | 0 | 109.4 | S189 | S189-K191 VanDerWaalsContact CB-O 3.28Å; S189-K191 WeakPolarHBondContact CB-O 3.4Å; S189-K191 PolarHBondContact O-N 3.42Å; S189-K191 PolarHBondContact OG-N 3.47Å; S189-K191 VanDerWaalsContact OG-N 3.16Å; S189-K191 PolarHBondContact OG-O 3.08Å |
| 192 | Q | 73.3 | Confident | 73.2 | Confident | 139 Ų | 139 | 90.3 Ų | 90.3 | 65% | 0.65 | 49% | 0.492 | S | S | * | . | P | Polyproline II helix | trans | -64.2 | 136.2 | 176.3 | -170.1 | 176.8 | 7.5 | 0 | 0 | 111.1 | ||
| 193 | S | 78.6 | Confident | 73.6 | Confident | 40 Ų | 40 | 84.5 Ų | 84.5 | 28% | 0.28 | 46% | 0.462 | S | S | . | . | P | Polyproline II helix | trans | -62.5 | 149.3 | 174.3 | 75.1 | 0 | 0 | 0 | 0 | 112 | E187 P195 | E187-S193 PolarHBondContact OE1-OG 2.76Å; E187-S193 VanDerWaalsContact OE2-CB 3.29Å; E187-S193 WeakPolarHBondContact OE2-CB 3.38Å; E187-S193 PolarHBondContact OE2-N 2.81Å; E187-S193 PolarHBondContact OE2-OG 3.11Å; S193-P195 WeakPolarHBondContact O-CD 2.97Å |
| 194 | D | 79.3 | Confident | 74 | Confident | 54 Ų | 54 | 81.8 Ų | 81.8 | 29% | 0.289 | 45% | 0.446 | S | S | . | . | P | Polyproline II helix | trans | -73.8 | 122.5 | 170.5 | -171 | -62 | 0 | 0 | 0 | 108.8 | T196 V197 L198 K218 | D194-T196 PolarHBondContact O-N 2.7Å; D194-T196 VanDerWaalsContact O-N 3.11Å; D194-T196 WeakPolarHBondContact OD1-CA 3.44Å; D194-T196 WeakPolarHBondContact OD1-CB 3.39Å; D194-T196 PolarHBondContact OD1-N 3.4Å; D194-T196 PolarHBondContact OD1-OG1 2.93Å; D194-V197 HydrophobicContact CB-CB 4.17Å; D194-V197 HydrophobicContact CB-CG2 3.97Å; D194-V197 PolarHBondContact O-N 2.83Å; D194-V197 VanDerWaalsContact O-N 3.08Å; D194-L198 PolarHBondContact O-N 3.14Å; D194-K218 IonicContact OD2-NZ 2.75Å |
| 195 | P | 77.4 | Confident | 74.3 | Confident | 83 Ų | 83 | 83.4 Ų | 83.4 | 54% | 0.539 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -59.7 | -28.8 | -176.9 | 24.6 | -35.1 | 0 | 0 | 0 | 112.7 | S193 S199 | S193-P195 WeakPolarHBondContact O-CD 2.97Å; P195-S199 VanDerWaalsContact O-CB 3.27Å; P195-S199 WeakPolarHBondContact O-CB 3.48Å; P195-S199 PolarHBondContact O-N 2.87Å; P195-S199 PolarHBondContact O-OG 3.31Å |
| 196 | T | 78.3 | Confident | 74.4 | Confident | 20 Ų | 20 | 79.8 Ų | 79.8 | 12% | 0.123 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -69.3 | -48.4 | 176.9 | -37.8 | 0 | 0 | 0 | 0 | 110.6 | D194 S199 L200 | D194-T196 PolarHBondContact O-N 2.7Å; D194-T196 VanDerWaalsContact O-N 3.11Å; D194-T196 WeakPolarHBondContact OD1-CA 3.44Å; D194-T196 WeakPolarHBondContact OD1-CB 3.39Å; D194-T196 PolarHBondContact OD1-N 3.4Å; D194-T196 PolarHBondContact OD1-OG1 2.93Å; T196-S199 PolarHBondContact O-N 3.21Å; T196-S199 PolarHBondContact O-OG 2.94Å; T196-L200 PolarHBondContact O-N 3.35Å |
| 197 | V | 79.2 | Confident | 74.3 | Confident | 15 Ų | 15 | 81.6 Ų | 81.6 | 9% | 0.091 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -65.8 | -42.5 | 179.3 | 175.5 | 0 | 0 | 0 | 0 | 110 | D194 L200 W201 I237 | D194-V197 HydrophobicContact CB-CB 4.17Å; D194-V197 HydrophobicContact CB-CG2 3.97Å; D194-V197 PolarHBondContact O-N 2.83Å; D194-V197 VanDerWaalsContact O-N 3.08Å; V197-L200 WeakPolarHBondContact O-CB 3.08Å; V197-L200 PolarHBondContact O-N 2.97Å; V197-W201 PolarHBondContact O-N 3.38Å; V197-I237 HydrophobicContact CG2-CD1 4.46Å |
| 198 | L | 78.9 | Confident | 73.6 | Confident | 69 Ų | 69 | 85 Ų | 85 | 36% | 0.361 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62.5 | -43.3 | 176.1 | -177.5 | 63.3 | 0 | 0 | 0 | 111.4 | D194 L200 W201 L202 | D194-L198 PolarHBondContact O-N 3.14Å; L198-L200 VanDerWaalsContact C-N 3.25Å; L198-L200 PolarHBondContact O-N 3.2Å; L198-W201 WeakPolarHBondContact O-CB 3.47Å; L198-W201 PolarHBondContact O-N 3.34Å; L198-L202 HydrophobicContact CD1-CD1 4.47Å; L198-L202 HydrophobicContact CD1-CG 4.35Å; L198-L202 HydrophobicContact CG-CD1 4.08Å; L198-L202 HydrophobicContact CG-CG 4.4Å; L198-L202 WeakPolarHBondContact O-CB 3.46Å; L198-L202 WeakPolarHBondContact O-CG 3.45Å; L198-L202 PolarHBondContact O-N 3.04Å |
| 199 | S | 77 | Confident | 73.2 | Confident | 28 Ų | 28 | 85.7 Ų | 85.7 | 20% | 0.196 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -60.9 | -36.5 | 175.9 | 75.4 | 0 | 0 | 0 | 0 | 112.4 | P195 T196 T203 | P195-S199 VanDerWaalsContact O-CB 3.27Å; P195-S199 WeakPolarHBondContact O-CB 3.48Å; P195-S199 PolarHBondContact O-N 2.87Å; P195-S199 PolarHBondContact O-OG 3.31Å; T196-S199 PolarHBondContact O-N 3.21Å; T196-S199 PolarHBondContact O-OG 2.94Å; S199-T203 WeakPolarHBondContact O-CB 3.33Å; S199-T203 PolarHBondContact O-N 3.15Å; S199-T203 PolarHBondContact O-OG1 2.84Å |
| 200 | L | 78.1 | Confident | 72.6 | Confident | 42 Ų | 42 | 89.5 Ų | 89.5 | 22% | 0.22 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -69.7 | -43.1 | 176.1 | -176.7 | 57.8 | 0 | 0 | 0 | 111 | T196 V197 L198 T203 E204 M215 I237 L240 | T196-L200 PolarHBondContact O-N 3.35Å; V197-L200 WeakPolarHBondContact O-CB 3.08Å; V197-L200 PolarHBondContact O-N 2.97Å; L198-L200 VanDerWaalsContact C-N 3.25Å; L198-L200 PolarHBondContact O-N 3.2Å; L200-T203 PolarHBondContact O-N 3.38Å; L200-E204 WeakPolarHBondContact O-CB 3.39Å; L200-E204 PolarHBondContact O-N 3.16Å; L200-M215 HydrophobicContact CB-CE 4.03Å; L200-M215 HydrophobicContact CD1-CE 3.7Å; L200-M215 HydrophobicContact CD1-SD 4.49Å; L200-M215 HydrophobicContact CG-CE 4.3Å; L200-I237 HydrophobicContact CD2-CD1 3.9Å; L200-L240 HydrophobicContact CB-CD2 4.46Å; L200-L240 HydrophobicContact CD1-CD2 4.32Å; L200-L240 HydrophobicContact CD2-CD2 3.2Å; L200-L240 HydrophobicContact CG-CD2 3.4Å |
| 201 | W | 78.1 | Confident | 71.9 | Confident | 87 Ų | 87 | 85.3 Ų | 85.3 | 33% | 0.33 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -57.6 | -48 | 172.1 | -107.2 | 92.5 | 0 | 0 | 0 | 112.4 | V197 L198 E204 N205 L240 | V197-W201 PolarHBondContact O-N 3.38Å; L198-W201 WeakPolarHBondContact O-CB 3.47Å; L198-W201 PolarHBondContact O-N 3.34Å; W201-E204 PolarHBondContact O-N 3.42Å; W201-N205 WeakPolarHBondContact CZ3-ND2 3.46Å; W201-N205 WeakPolarHBondContact O-CB 3.27Å; W201-N205 PolarHBondContact O-N 3.39Å; W201-N205 PolarHBondContact O-ND2 2.88Å; W201-L240 HydrophobicContact CD2-CD1 4.27Å; W201-L240 HydrophobicContact CG-CD1 4.05Å |
| 202 | L | 77.3 | Confident | 71 | Confident | 103 Ų | 103 | 80.9 Ų | 80.9 | 54% | 0.539 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -65.4 | -41.2 | 179.2 | -71.9 | 171.8 | 0 | 0 | 0 | 111.8 | L198 E204 N205 S206 | L198-L202 HydrophobicContact CD1-CD1 4.47Å; L198-L202 HydrophobicContact CD1-CG 4.35Å; L198-L202 HydrophobicContact CG-CD1 4.08Å; L198-L202 HydrophobicContact CG-CG 4.4Å; L198-L202 WeakPolarHBondContact O-CB 3.46Å; L198-L202 WeakPolarHBondContact O-CG 3.45Å; L198-L202 PolarHBondContact O-N 3.04Å; L202-E204 VanDerWaalsContact C-N 3.34Å; L202-N205 PolarHBondContact O-N 3.36Å; L202-S206 WeakPolarHBondContact O-CB 3.41Å; L202-S206 PolarHBondContact O-N 3.42Å |
| 203 | T | 75.3 | Confident | 70 | Confident | 25 Ų | 25 | 82.6 Ų | 82.6 | 15% | 0.153 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -61.8 | -44.5 | 176.2 | -59.1 | 0 | 0 | 0 | 0 | 110.9 | S199 L200 K207 | S199-T203 WeakPolarHBondContact O-CB 3.33Å; S199-T203 PolarHBondContact O-N 3.15Å; S199-T203 PolarHBondContact O-OG1 2.84Å; L200-T203 PolarHBondContact O-N 3.38Å; T203-K207 PolarHBondContact O-N 3.49Å |
| 204 | E | 73.3 | Confident | 68.7 | Low | 85 Ų | 85 | 88.8 Ų | 88.8 | 40% | 0.397 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -63.5 | -47.3 | 178 | -170 | 66.8 | -134.4 | 0 | 0 | 111.6 | L200 W201 L202 S206 L240 K244 | L200-E204 WeakPolarHBondContact O-CB 3.39Å; L200-E204 PolarHBondContact O-N 3.16Å; W201-E204 PolarHBondContact O-N 3.42Å; L202-E204 VanDerWaalsContact C-N 3.34Å; E204-S206 PolarHBondContact O-N 3.37Å; E204-L240 HydrophobicContact CB-CD1 4.34Å; E204-L240 HydrophobicContact CG-CD1 4.45Å; E204-K244 WeakPolarHBondContact OE2-CE 3.34Å |
| 205 | N | 72.3 | Confident | 67.7 | Low | 105 Ų | 105 | 89.5 Ų | 89.5 | 56% | 0.561 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -69.8 | -35.2 | -178.7 | -81.5 | -90.2 | 0 | 0 | 0 | 113.1 | W201 L202 K207 | W201-N205 WeakPolarHBondContact CZ3-ND2 3.46Å; W201-N205 WeakPolarHBondContact O-CB 3.27Å; W201-N205 PolarHBondContact O-N 3.39Å; W201-N205 PolarHBondContact O-ND2 2.88Å; L202-N205 PolarHBondContact O-N 3.36Å; N205-K207 VanDerWaalsContact C-N 3.27Å; N205-K207 PolarHBondContact O-N 3.5Å |
| 206 | S | 73.2 | Confident | 66.8 | Low | 47 Ų | 47 | 94.4 Ų | 94.4 | 33% | 0.329 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -71.5 | -21.1 | -175.8 | -175.2 | 0 | 0 | 0 | 0 | 112.7 | L202 E204 Q208 | L202-S206 WeakPolarHBondContact O-CB 3.41Å; L202-S206 PolarHBondContact O-N 3.42Å; E204-S206 PolarHBondContact O-N 3.37Å; S206-Q208 WeakPolarHBondContact O-CG 3.33Å; S206-Q208 PolarHBondContact O-N 2.88Å; S206-Q208 WeakPolarHBondContact OG-CB 2.97Å; S206-Q208 WeakPolarHBondContact OG-CG 3.45Å |
| 207 | K | 66.2 | Low | 66.1 | Low | 178 Ų | 178 | 98.8 Ų | 98.8 | 77% | 0.774 | 49% | 0.492 | S | S | * | . | trans | 52.7 | 9.7 | -170.1 | -57.6 | -177.8 | -179.1 | -177.9 | 0 | 114 | T203 N205 | T203-K207 PolarHBondContact O-N 3.49Å; N205-K207 VanDerWaalsContact C-N 3.27Å; N205-K207 PolarHBondContact O-N 3.5Å | ||
| 208 | Q | 59.6 | Low | 65.5 | Low | 117 Ų | 117 | 104.6 Ų | 104.6 | 55% | 0.547 | 52% | 0.516 | S | S | . | . | trans | -94.1 | 105 | 179.6 | -68.7 | 179.5 | 15.7 | 0 | 0 | 109.1 | S206 N210 I211 | S206-Q208 WeakPolarHBondContact O-CG 3.33Å; S206-Q208 PolarHBondContact O-N 2.88Å; S206-Q208 WeakPolarHBondContact OG-CB 2.97Å; S206-Q208 WeakPolarHBondContact OG-CG 3.45Å; Q208-N210 PolarHBondContact O-N 3.45Å; Q208-I211 HydrophobicContact CB-CD1 4.42Å | ||
| 209 | H | 55.7 | Low | 64.9 | Low | 161 Ų | 161 | 105.7 Ų | 105.7 | 75% | 0.745 | 53% | 0.53 | S | S | * | . | G | 310 helix | trans | -67.2 | -3.3 | 178.8 | -68.7 | -71.6 | 0 | 0 | 0 | 114.8 | T212 | H209-T212 PolarHBondContact O-OG1 2.85Š|
| 210 | N | 54.4 | Low | 64.5 | Low | 149 Ų | 149 | 108.6 Ų | 108.6 | 80% | 0.797 | 54% | 0.542 | S | S | * | . | G | 310 helix | trans | -84.4 | -6.9 | -176.4 | -67.8 | -28.7 | 0 | 0 | 0 | 114.3 | Q208 T212 | Q208-N210 PolarHBondContact O-N 3.45Å; N210-T212 VanDerWaalsContact C-N 3.33Å |
| 211 | I | 53.9 | Low | 64 | Low | 70 Ų | 70 | 115.1 Ų | 115.1 | 36% | 0.359 | 57% | 0.572 | S | S | . | * | G | 310 helix | trans | -85.4 | -6.8 | 179.8 | -67.7 | 160.5 | 0 | 0 | 0 | 112.5 | Q208 Q213 H214 | Q208-I211 HydrophobicContact CB-CD1 4.42Å; I211-Q213 PolarHBondContact O-N 3.1Å; I211-H214 PolarHBondContact O-N 2.67Å |
| 212 | T | 51 | Low | 63.2 | Low | 81 Ų | 81 | 115.1 Ų | 115.1 | 50% | 0.497 | 58% | 0.578 | S | S | . | * | G | 310 helix | trans | -55 | -19.2 | -177.5 | -47.1 | 0 | 0 | 0 | 0 | 114.6 | H209 N210 H214 | H209-T212 PolarHBondContact O-OG1 2.85Å; N210-T212 VanDerWaalsContact C-N 3.33Å; T212-H214 VanDerWaalsContact C-N 3.27Å; T212-H214 PolarHBondContact O-N 3.32Å |
| 213 | Q | 53.1 | Low | 62.5 | Low | 176 Ų | 176 | 112.6 Ų | 112.6 | 82% | 0.822 | 57% | 0.572 | S | S | * | * | G | 310 helix | trans | -71.6 | -12.4 | -177.1 | -61.9 | -72.3 | -47.6 | 0 | 0 | 114.6 | I211 | I211-Q213 PolarHBondContact O-N 3.1Š|
| 214 | H | 51.8 | Low | 62.1 | Low | 169 Ų | 169 | 120.7 Ų | 120.7 | 78% | 0.782 | 61% | 0.608 | S | S | * | * | G | 310 helix | trans | -115.8 | 13.7 | -175.3 | -88.2 | -86.1 | 0 | 0 | 0 | 115.4 | I211 T212 K216 | I211-H214 PolarHBondContact O-N 2.67Å; T212-H214 VanDerWaalsContact C-N 3.27Å; T212-H214 PolarHBondContact O-N 3.32Å; H214-K216 VanDerWaalsContact C-N 3.29Å; H214-K216 PolarHBondContact O-N 3.26Å |
| 215 | M | 57.6 | Low | 62 | Low | 70 Ų | 70 | 124 Ų | 124 | 35% | 0.345 | 62% | 0.621 | S | S | . | * | trans | -76.6 | 79.3 | 175.2 | -70.1 | -165.9 | 78.6 | 0 | 0 | 111.4 | L200 V217 | L200-M215 HydrophobicContact CB-CE 4.03Å; L200-M215 HydrophobicContact CD1-CE 3.7Å; L200-M215 HydrophobicContact CD1-SD 4.49Å; L200-M215 HydrophobicContact CG-CE 4.3Å; M215-V217 PolarHBondContact O-N 3.44Å | ||
| 216 | K | 59 | Low | 62 | Low | 186 Ų | 186 | 122.9 Ų | 122.9 | 81% | 0.809 | 62% | 0.615 | S | S | * | * | trans | -80.1 | 97.3 | 167.4 | -171.5 | 175.3 | -178.5 | -177.9 | 0 | 108.3 | H214 K218 | H214-K216 VanDerWaalsContact C-N 3.29Å; H214-K216 PolarHBondContact O-N 3.26Å; K216-K218 PolarHBondContact O-N 3.03Å | ||
| 217 | V | 63.5 | Low | 62.4 | Low | 111 Ų | 111 | 124.2 Ų | 124.2 | 67% | 0.673 | 62% | 0.623 | S | S | * | * | trans | -63.7 | 123.4 | 175.2 | -177.2 | 0 | 0 | 0 | 0 | 108.9 | M215 S219 | M215-V217 PolarHBondContact O-N 3.44Å; V217-S219 PolarHBondContact O-N 3.28Å | ||
| 218 | K | 66.8 | Low | 63 | Low | 137 Ų | 137 | 124 Ų | 124 | 60% | 0.596 | 62% | 0.622 | S | S | * | * | trans | -69.2 | 115.8 | 177.1 | -150.1 | 175.6 | -176.2 | -177.7 | 0 | 109 | D194 K216 | D194-K218 IonicContact OD2-NZ 2.75Å; K216-K218 PolarHBondContact O-N 3.03Å | ||
| 219 | S | 65.9 | Low | 63.8 | Low | 93 Ų | 93 | 120.4 Ų | 120.4 | 65% | 0.65 | 61% | 0.612 | S | S | * | * | trans | -80.3 | 127.9 | 171.7 | 53.1 | 0 | 0 | 0 | 0 | 109.7 | V217 | V217-S219 PolarHBondContact O-N 3.28Š| ||
| 220 | L | 69.4 | Low | 65 | Low | 89 Ų | 89 | 115.5 Ų | 115.5 | 47% | 0.466 | 59% | 0.591 | S | S | . | * | trans | -85.1 | 111.6 | 169.3 | -95.5 | 135.2 | 0 | 0 | 0 | 108.5 | N226 A229 | L220-N226 HydrophobicContact CD2-CB 4.47Å; L220-A229 HydrophobicContact CD2-CB 4.19Å | ||
| 221 | E | 67 | Low | 66.4 | Low | 179 Ų | 179 | 113 Ų | 113 | 84% | 0.836 | 58% | 0.578 | S | S | * | * | S | Bend | trans | -77.4 | -20.8 | -178.4 | -60.5 | -166.2 | 159 | 0 | 0 | 113.1 | ||
| 222 | D | 60.2 | Low | 67.8 | Low | 86 Ų | 86 | 113.6 Ų | 113.6 | 46% | 0.46 | 58% | 0.584 | S | S | . | * | trans | -131.6 | 73 | 178.2 | -81.1 | -63.5 | 0 | 0 | 0 | 111.4 | E224 K225 N226 | D222-E224 PolarHBondContact O-N 3.34Å; D222-K225 HydrophobicContact CB-CB 4.39Å; D222-K225 HydrophobicContact CB-CD 4.47Å; D222-K225 IonicContact OD1-NZ 3.72Å; D222-N226 PolarHBondContact O-ND2 3.12Å | ||
| 223 | A | 63.3 | Low | 69.3 | Low | 51 Ų | 51 | 116 Ų | 116 | 42% | 0.421 | 58% | 0.584 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -65 | -36.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | K225 N226 I230 | A223-K225 VanDerWaalsContact C-N 3.32Å; A223-K225 PolarHBondContact O-N 2.89Å; A223-N226 PolarHBondContact O-N 2.93Å; A223-I230 HydrophobicContact CB-CD1 4.09Å |
| 224 | E | 66.6 | Low | 70.8 | Confident | 195 Ų | 195 | 111.4 Ų | 111.4 | 91% | 0.911 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.5 | -28.7 | -177.4 | -169.7 | 176.2 | -171.1 | 0 | 0 | 113.1 | D222 | D222-E224 PolarHBondContact O-N 3.34Š|
| 225 | K | 72.3 | Confident | 72.4 | Confident | 154 Ų | 154 | 109.8 Ų | 109.8 | 67% | 0.67 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.5 | -13.5 | 179.4 | -67 | 176.7 | -175.6 | 157.2 | 0 | 113.7 | D222 A223 P227 | D222-K225 HydrophobicContact CB-CB 4.39Å; D222-K225 HydrophobicContact CB-CD 4.47Å; D222-K225 IonicContact OD1-NZ 3.72Å; A223-K225 VanDerWaalsContact C-N 3.32Å; A223-K225 PolarHBondContact O-N 2.89Å; K225-P227 VanDerWaalsContact C-CD 3.45Å |
| 226 | N | 71 | Confident | 73.5 | Confident | 81 Ų | 81 | 108.3 Ų | 108.3 | 43% | 0.433 | 55% | 0.554 | S | S | . | * | trans | -129.1 | 59.4 | -173.8 | -67 | -56.5 | 0 | 0 | 0 | 113.1 | L220 D222 A223 K228 A229 | L220-N226 HydrophobicContact CD2-CB 4.47Å; D222-N226 PolarHBondContact O-ND2 3.12Å; A223-N226 PolarHBondContact O-N 2.93Å; N226-K228 PolarHBondContact O-N 3.17Å; N226-A229 HydrophobicContact CB-CB 4.1Å; N226-A229 PolarHBondContact O-N 3.07Å; N226-A229 VanDerWaalsContact O-N 3.13Å | ||
| 227 | P | 81.5 | Confident | 74.5 | Confident | 75 Ų | 75 | 100.9 Ų | 100.9 | 49% | 0.487 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.6 | -34.2 | 177.8 | 24.7 | -33.8 | 0 | 0 | 0 | 112.3 | K225 A229 I230 D231 | K225-P227 VanDerWaalsContact C-CD 3.45Å; P227-A229 VanDerWaalsContact C-N 3.29Å; P227-A229 PolarHBondContact O-N 3.24Å; P227-I230 WeakPolarHBondContact O-CB 3.37Å; P227-I230 PolarHBondContact O-N 3.35Å; P227-I230 VanDerWaalsContact O-N 3.09Å; P227-D231 PolarHBondContact O-N 2.93Å |
| 228 | K | 79.9 | Confident | 75.3 | Confident | 174 Ų | 174 | 98.8 Ų | 98.8 | 76% | 0.757 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.3 | -33.3 | 178 | -63.9 | -176 | 179.7 | -179.5 | 0 | 113.5 | N226 I230 T232 | N226-K228 PolarHBondContact O-N 3.17Å; K228-I230 VanDerWaalsContact C-N 3.32Å; K228-T232 WeakPolarHBondContact O-CB 3.41Å; K228-T232 PolarHBondContact O-N 3.4Å; K228-T232 PolarHBondContact O-OG1 3.13Å |
| 229 | A | 75.9 | Confident | 76 | Confident | 41 Ų | 41 | 96.9 Ų | 96.9 | 34% | 0.339 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -70.5 | -35 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | L220 N226 P227 W233 | L220-A229 HydrophobicContact CD2-CB 4.19Å; N226-A229 HydrophobicContact CB-CB 4.1Å; N226-A229 PolarHBondContact O-N 3.07Å; N226-A229 VanDerWaalsContact O-N 3.13Å; P227-A229 VanDerWaalsContact C-N 3.29Å; P227-A229 PolarHBondContact O-N 3.24Å; A229-W233 WeakPolarHBondContact O-CB 3.49Å; A229-W233 PolarHBondContact O-N 3.02Å |
| 230 | I | 80.9 | Confident | 76.5 | Confident | 59 Ų | 59 | 92.4 Ų | 92.4 | 30% | 0.303 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -67.2 | -49.7 | 174.7 | -57.8 | 172.4 | 0 | 0 | 0 | 109.6 | A223 P227 K228 T232 W233 I234 | A223-I230 HydrophobicContact CB-CD1 4.09Å; P227-I230 WeakPolarHBondContact O-CB 3.37Å; P227-I230 PolarHBondContact O-N 3.35Å; P227-I230 VanDerWaalsContact O-N 3.09Å; K228-I230 VanDerWaalsContact C-N 3.32Å; I230-T232 VanDerWaalsContact C-N 3.33Å; I230-T232 PolarHBondContact O-N 3.09Å; I230-W233 PolarHBondContact O-N 3.43Å; I230-W233 VanDerWaalsContact O-N 3.15Å; I230-I234 HydrophobicContact CG2-CD1 3.73Å; I230-I234 HydrophobicContact CG2-CG1 4.27Å; I230-I234 VanDerWaalsContact O-CG1 3.27Å; I230-I234 WeakPolarHBondContact O-CG1 3.07Å; I230-I234 PolarHBondContact O-N 3.27Å |
| 231 | D | 83.6 | Confident | 76.7 | Confident | 97 Ų | 97 | 93.3 Ų | 93.3 | 52% | 0.519 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -58.6 | -44.9 | 178.4 | -64.9 | -30.1 | 0 | 0 | 0 | 111.7 | P227 W233 I234 E235 | P227-D231 PolarHBondContact O-N 2.93Å; D231-W233 VanDerWaalsContact C-N 3.33Å; D231-W233 PolarHBondContact O-N 3.15Å; D231-I234 PolarHBondContact O-N 3.39Å; D231-E235 WeakPolarHBondContact O-CB 3.34Å; D231-E235 PolarHBondContact O-N 2.65Å |
| 232 | T | 83.7 | Confident | 77 | Confident | 81 Ų | 81 | 94.4 Ų | 94.4 | 50% | 0.497 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.9 | -41 | 177.1 | -54.9 | 0 | 0 | 0 | 0 | 111.6 | K228 I230 S236 | K228-T232 WeakPolarHBondContact O-CB 3.41Å; K228-T232 PolarHBondContact O-N 3.4Å; K228-T232 PolarHBondContact O-OG1 3.13Å; I230-T232 VanDerWaalsContact C-N 3.33Å; I230-T232 PolarHBondContact O-N 3.09Å; T232-S236 WeakPolarHBondContact O-CB 3.46Å; T232-S236 PolarHBondContact O-N 3.23Å; T232-S236 PolarHBondContact O-OG 2.75Å |
| 233 | W | 82.9 | Confident | 77.3 | Confident | 131 Ų | 131 | 93 Ų | 93 | 50% | 0.496 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -67.6 | -43.3 | 176.3 | 177.6 | 82.5 | 0 | 0 | 0 | 111.7 | A229 I230 D231 E235 S236 I237 | A229-W233 WeakPolarHBondContact O-CB 3.49Å; A229-W233 PolarHBondContact O-N 3.02Å; I230-W233 PolarHBondContact O-N 3.43Å; I230-W233 VanDerWaalsContact O-N 3.15Å; D231-W233 VanDerWaalsContact C-N 3.33Å; D231-W233 PolarHBondContact O-N 3.15Å; W233-E235 VanDerWaalsContact C-N 3.32Å; W233-E235 PolarHBondContact O-N 3.26Å; W233-S236 PolarHBondContact O-N 2.83Å; W233-I237 HydrophobicContact CD2-CG1 3.97Å; W233-I237 HydrophobicContact CG-CG1 4.39Å; W233-I237 HydrophobicContact CH2-CG1 4.33Å; W233-I237 HydrophobicContact CZ2-CD1 4.31Å; W233-I237 HydrophobicContact CZ2-CG1 3.74Å; W233-I237 WeakPolarHBondContact O-CG1 3.29Å; W233-I237 PolarHBondContact O-N 2.9Å |
| 234 | I | 83.5 | Confident | 77.3 | Confident | 80 Ų | 80 | 93.9 Ų | 93.9 | 41% | 0.41 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -58.7 | -46.5 | 176.4 | -69.8 | 168.6 | 0 | 0 | 0 | 110.2 | I230 D231 S236 I237 S238 | I230-I234 HydrophobicContact CG2-CD1 3.73Å; I230-I234 HydrophobicContact CG2-CG1 4.27Å; I230-I234 VanDerWaalsContact O-CG1 3.27Å; I230-I234 WeakPolarHBondContact O-CG1 3.07Å; I230-I234 PolarHBondContact O-N 3.27Å; D231-I234 PolarHBondContact O-N 3.39Å; I234-S236 VanDerWaalsContact C-N 3.35Å; I234-I237 PolarHBondContact O-N 2.83Å; I234-S238 VanDerWaalsContact O-CB 3.24Å; I234-S238 WeakPolarHBondContact O-CB 3.4Å; I234-S238 PolarHBondContact O-N 2.88Å; I234-S238 PolarHBondContact O-OG 2.98Å |
| 235 | E | 85.4 | Confident | 76.9 | Confident | 136 Ų | 136 | 89.3 Ų | 89.3 | 64% | 0.636 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -61.1 | -45.6 | 177.4 | -171 | 167.5 | -153.6 | 0 | 0 | 110.7 | D231 W233 I237 S238 E239 | D231-E235 WeakPolarHBondContact O-CB 3.34Å; D231-E235 PolarHBondContact O-N 2.65Å; W233-E235 VanDerWaalsContact C-N 3.32Å; W233-E235 PolarHBondContact O-N 3.26Å; E235-I237 PolarHBondContact O-N 3.21Å; E235-S238 PolarHBondContact O-N 3.41Å; E235-E239 WeakPolarHBondContact O-CB 3.39Å; E235-E239 PolarHBondContact O-N 3.14Å |
| 236 | S | 80.6 | Confident | 76.3 | Confident | 39 Ų | 39 | 87.2 Ų | 87.2 | 27% | 0.273 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62.6 | -39.6 | 178.7 | -58.8 | 0 | 0 | 0 | 0 | 113.7 | T232 W233 I234 L240 | T232-S236 WeakPolarHBondContact O-CB 3.46Å; T232-S236 PolarHBondContact O-N 3.23Å; T232-S236 PolarHBondContact O-OG 2.75Å; W233-S236 PolarHBondContact O-N 2.83Å; I234-S236 VanDerWaalsContact C-N 3.35Å; S236-L240 PolarHBondContact O-N 3.09Å; S236-L240 VanDerWaalsContact O-N 3.15Å |
| 237 | I | 81.2 | Confident | 75.8 | Confident | 29 Ų | 29 | 88.3 Ų | 88.3 | 15% | 0.149 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -75 | -35 | 175.8 | -64.4 | -60.8 | 0 | 0 | 0 | 111.3 | V197 L200 W233 I234 E235 E239 L240 H241 | V197-I237 HydrophobicContact CG2-CD1 4.46Å; L200-I237 HydrophobicContact CD2-CD1 3.9Å; W233-I237 HydrophobicContact CD2-CG1 3.97Å; W233-I237 HydrophobicContact CG-CG1 4.39Å; W233-I237 HydrophobicContact CH2-CG1 4.33Å; W233-I237 HydrophobicContact CZ2-CD1 4.31Å; W233-I237 HydrophobicContact CZ2-CG1 3.74Å; W233-I237 WeakPolarHBondContact O-CG1 3.29Å; W233-I237 PolarHBondContact O-N 2.9Å; I234-I237 PolarHBondContact O-N 2.83Å; E235-I237 PolarHBondContact O-N 3.21Å; I237-E239 VanDerWaalsContact C-N 3.35Å; I237-L240 WeakPolarHBondContact O-CB 3.47Å; I237-L240 PolarHBondContact O-N 3.22Å; I237-H241 PolarHBondContact O-N 3.42Å |
| 238 | S | 80.2 | Confident | 74.8 | Confident | 67 Ų | 67 | 89.1 Ų | 89.1 | 47% | 0.469 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65 | -40.8 | 174.7 | -59.9 | 0 | 0 | 0 | 0 | 110.9 | I234 E235 H241 R242 | I234-S238 VanDerWaalsContact O-CB 3.24Å; I234-S238 WeakPolarHBondContact O-CB 3.4Å; I234-S238 PolarHBondContact O-N 2.88Å; I234-S238 PolarHBondContact O-OG 2.98Å; E235-S238 PolarHBondContact O-N 3.41Å; S238-H241 CarbonylContact O-C 3.54Å; S238-H241 PolarHBondContact O-N 3.05Å; S238-H241 VanDerWaalsContact O-N 3.16Å; S238-R242 WeakPolarHBondContact O-CB 3.47Å; S238-R242 PolarHBondContact O-N 2.62Å |
| 239 | E | 80.3 | Confident | 74.4 | Confident | 97 Ų | 97 | 83.8 Ų | 83.8 | 45% | 0.453 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61 | -44.2 | 173.2 | -165 | 71.8 | -130.6 | 0 | 0 | 111.3 | E235 I237 H241 R242 S243 | E235-E239 WeakPolarHBondContact O-CB 3.39Å; E235-E239 PolarHBondContact O-N 3.14Å; I237-E239 VanDerWaalsContact C-N 3.35Å; E239-H241 VanDerWaalsContact C-N 3.3Å; E239-H241 PolarHBondContact O-N 3.32Å; E239-R242 WeakPolarHBondContact O-CB 3.45Å; E239-R242 PolarHBondContact O-N 3.33Å; E239-R242 VanDerWaalsContact O-N 3.16Å; E239-S243 PolarHBondContact O-N 3.15Å; E239-S243 PolarHBondContact O-OG 2.71Å |
| 240 | L | 76.8 | Confident | 74.1 | Confident | 0 Ų | 0 | 89.4 Ų | 89.4 | 0% | 0 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -59.6 | -41 | 172.7 | 175.7 | 75.5 | 0 | 0 | 0 | 111.8 | L200 W201 E204 S236 I237 R242 S243 K244 | L200-L240 HydrophobicContact CB-CD2 4.46Å; L200-L240 HydrophobicContact CD1-CD2 4.32Å; L200-L240 HydrophobicContact CD2-CD2 3.2Å; L200-L240 HydrophobicContact CG-CD2 3.4Å; W201-L240 HydrophobicContact CD2-CD1 4.27Å; W201-L240 HydrophobicContact CG-CD1 4.05Å; E204-L240 HydrophobicContact CB-CD1 4.34Å; E204-L240 HydrophobicContact CG-CD1 4.45Å; S236-L240 PolarHBondContact O-N 3.09Å; S236-L240 VanDerWaalsContact O-N 3.15Å; I237-L240 WeakPolarHBondContact O-CB 3.47Å; I237-L240 PolarHBondContact O-N 3.22Å; L240-R242 VanDerWaalsContact C-N 3.31Å; L240-S243 PolarHBondContact O-N 2.94Å; L240-S243 PolarHBondContact O-OG 2.9Å; L240-K244 WeakPolarHBondContact O-CG 3.37Å; L240-K244 PolarHBondContact O-N 2.89Å |
| 241 | H | 73.8 | Confident | 73.9 | Confident | 107 Ų | 107 | 89.6 Ų | 89.6 | 50% | 0.495 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -74 | -24.7 | 177.5 | -75.2 | -169.4 | 0 | 0 | 0 | 113 | I237 S238 E239 K244 | I237-H241 PolarHBondContact O-N 3.42Å; S238-H241 CarbonylContact O-C 3.54Å; S238-H241 PolarHBondContact O-N 3.05Å; S238-H241 VanDerWaalsContact O-N 3.16Å; E239-H241 VanDerWaalsContact C-N 3.3Å; E239-H241 PolarHBondContact O-N 3.32Å; H241-K244 PolarHBondContact CD2-NZ 2.8Å; H241-K244 VanDerWaalsContact CD2-NZ 3.31Å; H241-K244 PolarHBondContact NE2-NZ 3.16Å; H241-K244 VanDerWaalsContact NE2-NZ 3.15Å; H241-K244 PolarHBondContact O-N 3.23Å |
| 242 | R | 74.6 | Confident | 73.5 | Confident | 203 Ų | 203 | 90 Ų | 90 | 77% | 0.766 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -72.3 | -35.1 | 172.9 | -169.9 | -178.4 | -173 | 166 | 2.7 | 111.9 | S238 E239 L240 K244 | S238-R242 WeakPolarHBondContact O-CB 3.47Å; S238-R242 PolarHBondContact O-N 2.62Å; E239-R242 WeakPolarHBondContact O-CB 3.45Å; E239-R242 PolarHBondContact O-N 3.33Å; E239-R242 VanDerWaalsContact O-N 3.16Å; L240-R242 VanDerWaalsContact C-N 3.31Å; R242-K244 VanDerWaalsContact C-N 3.32Å |
| 243 | S | 64.8 | Low | 73.2 | Confident | 56 Ų | 56 | 92.6 Ų | 92.6 | 39% | 0.392 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -78.6 | -16.6 | 175 | 66.8 | 0 | 0 | 0 | 0 | 113.1 | E239 L240 P245 | E239-S243 PolarHBondContact O-N 3.15Å; E239-S243 PolarHBondContact O-OG 2.71Å; L240-S243 PolarHBondContact O-N 2.94Å; L240-S243 PolarHBondContact O-OG 2.9Å; S243-P245 WeakPolarHBondContact O-CD 3.14Å |
| 244 | K | 64.8 | Low | 72.9 | Confident | 69 Ų | 69 | 91.9 Ų | 91.9 | 30% | 0.3 | 50% | 0.495 | S | S | . | . | S | Bend | trans | -66.9 | 122.9 | 167.7 | -74.1 | 174.6 | -173.8 | 177.7 | 0 | 109.2 | E204 L240 H241 R242 | E204-K244 WeakPolarHBondContact OE2-CE 3.34Å; L240-K244 WeakPolarHBondContact O-CG 3.37Å; L240-K244 PolarHBondContact O-N 2.89Å; H241-K244 PolarHBondContact CD2-NZ 2.8Å; H241-K244 VanDerWaalsContact CD2-NZ 3.31Å; H241-K244 PolarHBondContact NE2-NZ 3.16Å; H241-K244 VanDerWaalsContact NE2-NZ 3.15Å; H241-K244 PolarHBondContact O-N 3.23Å; R242-K244 VanDerWaalsContact C-N 3.32Å |
| 245 | P | 57.9 | Low | 72.8 | Confident | 99 Ų | 99 | 89.2 Ų | 89.2 | 64% | 0.643 | 48% | 0.481 | S | S | * | . | P | Polyproline II helix | trans | -57.6 | 144.1 | 163.4 | 26 | -31.8 | 0 | 0 | 0 | 108.1 | S243 A247 | S243-P245 WeakPolarHBondContact O-CD 3.14Å; P245-A247 PolarHBondContact O-N 3.49Å |
| 246 | P | 58.8 | Low | 72.8 | Confident | 111 Ų | 111 | 84.7 Ų | 84.7 | 72% | 0.721 | 46% | 0.463 | S | S | * | . | P | Polyproline II helix | trans | -48.2 | 140.8 | 173.2 | -24.2 | 32.1 | 0 | 0 | 0 | 109.4 | T248 | P246-T248 VanDerWaalsContact C-N 3.29Å; P246-T248 PolarHBondContact O-N 3.41Å; P246-T248 PolarHBondContact O-OG1 3.47Å |
| 247 | A | 61.4 | Low | 73 | Confident | 104 Ų | 104 | 88.4 Ų | 88.4 | 86% | 0.86 | 48% | 0.48 | S | S | * | . | trans | -51.5 | 94.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | P245 V249 | P245-A247 PolarHBondContact O-N 3.49Å; A247-V249 PolarHBondContact O-N 3.16Å | ||
| 248 | T | 60.9 | Low | 73.2 | Confident | 91 Ų | 91 | 89.4 Ų | 89.4 | 56% | 0.558 | 49% | 0.485 | S | S | * | . | trans | -85.5 | 112.1 | -172.5 | -61.6 | 0 | 0 | 0 | 0 | 106 | P246 H250 | P246-T248 VanDerWaalsContact C-N 3.29Å; P246-T248 PolarHBondContact O-N 3.41Å; P246-T248 PolarHBondContact O-OG1 3.47Å; T248-H250 PolarHBondContact O-N 3.32Å; T248-H250 VanDerWaalsContact O-N 3.1Å | ||
| 249 | V | 71 | Confident | 73.3 | Confident | 62 Ų | 62 | 92.7 Ų | 92.7 | 38% | 0.376 | 50% | 0.497 | S | S | . | . | trans | -74.7 | 104.2 | 179.4 | 178.2 | 0 | 0 | 0 | 0 | 108.4 | A247 Y251 H311 | A247-V249 PolarHBondContact O-N 3.16Å; V249-Y251 HydrophobicContact CG1-CD1 4.16Å; V249-Y251 HydrophobicContact CG1-CE1 3.82Å; V249-Y251 PolarHBondContact O-N 2.92Å; V249-H311 WeakPolarHBondContact CG2-NE2 3.36Å | ||
| 250 | H | 69 | Low | 73.6 | Confident | 159 Ų | 159 | 92.1 Ų | 92.1 | 74% | 0.736 | 50% | 0.501 | S | S | * | . | trans | -77 | 108.9 | 172.6 | -64.5 | -65.5 | 0 | 0 | 0 | 109.9 | T248 | T248-H250 PolarHBondContact O-N 3.32Å; T248-H250 VanDerWaalsContact O-N 3.1Å | ||
| 251 | Y | 77.9 | Confident | 74 | Confident | 64 Ų | 64 | 93.5 Ų | 93.5 | 25% | 0.251 | 51% | 0.508 | S | S | . | . | trans | -71.4 | 143.4 | 172 | -57.3 | -63.9 | 0 | 0 | 0 | 110.6 | V249 R253 M255 Q308 H311 | V249-Y251 HydrophobicContact CG1-CD1 4.16Å; V249-Y251 HydrophobicContact CG1-CE1 3.82Å; V249-Y251 PolarHBondContact O-N 2.92Å; Y251-R253 WeakPolarHBondContact CB-O 3.36Å; Y251-R253 PolarHBondContact O-N 3.46Å; Y251-M255 HydrophobicContact CD1-CE 3.79Å; Y251-M255 HydrophobicContact CD2-CB 3.75Å; Y251-M255 HydrophobicContact CD2-CG 4.29Å; Y251-M255 HydrophobicContact CE1-CE 4.14Å; Y251-M255 HydrophobicContact CE2-CB 4.18Å; Y251-M255 HydrophobicContact CE2-CG 4.32Å; Y251-M255 HydrophobicContact CG-CB 4.09Å; Y251-M255 HydrophobicContact CG-CE 4.1Å; Y251-Q308 HydrophobicContact CD1-CB 3.89Å; Y251-Q308 HydrophobicContact CD1-CG 4.11Å; Y251-Q308 HydrophobicContact CE1-CB 4.32Å; Y251-Q308 WeakPolarHBondContact CE1-O 3.26Å; Y251-H311 AromaticContact CE1-ND1 3.9Å; Y251-H311 AromaticContact CZ-ND1 3.72Å; Y251-H311 PolarHBondContact OH-ND1 2.91Å | ||
| 252 | T | 73.7 | Confident | 74.5 | Confident | 105 Ų | 105 | 90.4 Ų | 90.4 | 64% | 0.644 | 49% | 0.494 | S | S | * | . | S | Bend | trans | -72.2 | -16.8 | -179.6 | 48.6 | 0 | 0 | 0 | 0 | 113.4 | Q308 | T252-Q308 VanDerWaalsContact N-OE1 3.1Å; T252-Q308 PolarHBondContact OG1-OE1 3.09Å |
| 253 | R | 77.6 | Confident | 75 | Confident | 136 Ų | 136 | 87.7 Ų | 87.7 | 51% | 0.513 | 49% | 0.49 | S | S | . | . | S | Bend | trans | -142.4 | 157.4 | -177.5 | -78.2 | -171.5 | 178.1 | -149.3 | -0.3 | 109.4 | Y251 M255 Y303 | Y251-R253 WeakPolarHBondContact CB-O 3.36Å; Y251-R253 PolarHBondContact O-N 3.46Å; R253-M255 PolarHBondContact O-N 2.94Å; R253-Y303 HydrophobicContact CB-CD1 4.48Å; R253-Y303 HydrophobicContact CB-CD2 3.76Å; R253-Y303 HydrophobicContact CB-CE1 4.18Å; R253-Y303 HydrophobicContact CB-CE2 3.4Å; R253-Y303 VanDerWaalsContact CB-CE2 3.4Å; R253-Y303 HydrophobicContact CB-CG 4.28Å; R253-Y303 VanDerWaalsContact CD-CE1 3.48Å; R253-Y303 HydrophobicContact CG-CD2 4.41Å; R253-Y303 HydrophobicContact CG-CE1 4.48Å; R253-Y303 HydrophobicContact CG-CE2 4.37Å; R253-Y303 HydrophobicContact CG-CG 4.46Å |
| 254 | P | 77.9 | Confident | 75.8 | Confident | 115 Ų | 115 | 92.8 Ų | 92.8 | 75% | 0.747 | 51% | 0.508 | S | S | * | . | trans | -57.7 | 124.5 | 178.2 | 25 | -34.6 | 0 | 0 | 0 | 109.4 | Y303 | P254-Y303 PolarHBondContact O-OH 2.82Š| ||
| 255 | M | 80.6 | Confident | 76.8 | Confident | 25 Ų | 25 | 93.8 Ų | 93.8 | 12% | 0.123 | 51% | 0.51 | C | S | . | . | trans | -109.5 | 145.9 | 178.8 | -164.7 | 70.2 | 79.3 | 0 | 0 | 107.5 | Y251 R253 I300 P301 Q308 L312 | Y251-M255 HydrophobicContact CD1-CE 3.79Å; Y251-M255 HydrophobicContact CD2-CB 3.75Å; Y251-M255 HydrophobicContact CD2-CG 4.29Å; Y251-M255 HydrophobicContact CE1-CE 4.14Å; Y251-M255 HydrophobicContact CE2-CB 4.18Å; Y251-M255 HydrophobicContact CE2-CG 4.32Å; Y251-M255 HydrophobicContact CG-CB 4.09Å; Y251-M255 HydrophobicContact CG-CE 4.1Å; R253-M255 PolarHBondContact O-N 2.94Å; M255-I300 HydrophobicContact SD-CG2 4.25Å; M255-P301 HydrophobicContact SD-CG 3.84Å; M255-Q308 HydrophobicContact CE-CB 4.15Å; M255-L312 HydrophobicContact CG-CB 4.43Å; M255-L312 HydrophobicContact CG-CD1 4.1Å; M255-L312 HydrophobicContact CG-CD2 3.33Å; M255-L312 HydrophobicContact CG-CG 4.15Å; M255-L312 HydrophobicContact SD-CD2 3.77Å | ||
| 256 | P | 85.1 | Confident | 78.1 | Confident | 40 Ų | 40 | 92.2 Ų | 92.2 | 26% | 0.26 | 50% | 0.501 | S | S | . | . | trans | -56.6 | 143.8 | 171.6 | -23.9 | 34 | 0 | 0 | 0 | 111.6 | L261 P301 | P256-L261 HydrophobicContact CB-CD1 4.31Å; P256-L261 HydrophobicContact CB-CD2 4.13Å; P256-L261 HydrophobicContact CB-CG 4.1Å; P256-P301 HydrophobicContact CG-CG 4.49Å | ||
| 257 | D | 84.4 | Confident | 79.2 | Confident | 118 Ų | 118 | 91.8 Ų | 91.8 | 63% | 0.631 | 50% | 0.498 | S | S | * | . | trans | -70 | 146.5 | 174.5 | -66.6 | -40.9 | 0 | 0 | 0 | 110.4 | D259 T260 L261 | D257-D259 PolarHBondContact O-N 2.96Å; D257-T260 WeakPolarHBondContact O-CB 3.27Å; D257-T260 PolarHBondContact O-N 3.47Å; D257-L261 PolarHBondContact O-N 3.18Å | ||
| 258 | I | 85.2 | Confident | 80.4 | Confident | 50 Ų | 50 | 94.7 Ų | 94.7 | 26% | 0.256 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.8 | -39.2 | -176.7 | -61.5 | 165.2 | 0 | 0 | 0 | 110.9 | T260 L261 M262 L312 L316 E319 | I258-T260 VanDerWaalsContact C-N 3.28Å; I258-T260 PolarHBondContact O-N 2.85Å; I258-L261 PolarHBondContact O-N 2.89Å; I258-L261 VanDerWaalsContact O-N 3.12Å; I258-M262 HydrophobicContact CG2-CG 4.36Å; I258-M262 HydrophobicContact CG2-SD 4.16Å; I258-M262 WeakPolarHBondContact O-CG 3.18Å; I258-M262 PolarHBondContact O-N 3.11Å; I258-L312 HydrophobicContact CG1-CD1 4Å; I258-L316 HydrophobicContact CG2-CD1 4.07Å; I258-E319 HydrophobicContact CG2-CB 4.16Å; I258-E319 HydrophobicContact CG2-CG 3.95Å |
| 259 | D | 83.9 | Confident | 81.5 | Confident | 135 Ų | 135 | 93.1 Ų | 93.1 | 72% | 0.722 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.1 | -34.7 | 178.1 | -62.8 | -24.9 | 0 | 0 | 0 | 112.7 | D257 L261 M262 | D257-D259 PolarHBondContact O-N 2.96Å; D259-L261 VanDerWaalsContact C-N 3.34Å; D259-M262 PolarHBondContact O-N 3.37Å |
| 260 | T | 86.3 | Confident | 82 | Confident | 85 Ų | 85 | 95.2 Ų | 95.2 | 52% | 0.521 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.8 | -38.6 | 176.8 | -57.2 | 0 | 0 | 0 | 0 | 110.6 | D257 I258 M262 Q263 | D257-T260 WeakPolarHBondContact O-CB 3.27Å; D257-T260 PolarHBondContact O-N 3.47Å; I258-T260 VanDerWaalsContact C-N 3.28Å; I258-T260 PolarHBondContact O-N 2.85Å; T260-M262 VanDerWaalsContact C-N 3.3Å; T260-M262 PolarHBondContact O-N 3.17Å; T260-Q263 WeakPolarHBondContact O-CB 3.37Å; T260-Q263 PolarHBondContact O-N 3.35Å |
| 261 | L | 85.7 | Confident | 82.7 | Confident | 29 Ų | 29 | 93.3 Ų | 93.3 | 15% | 0.152 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -75.6 | -17.4 | 177.8 | -64.3 | 177.9 | 0 | 0 | 0 | 113.6 | P256 D257 I258 D259 Q263 L298 I300 L312 L316 | P256-L261 HydrophobicContact CB-CD1 4.31Å; P256-L261 HydrophobicContact CB-CD2 4.13Å; P256-L261 HydrophobicContact CB-CG 4.1Å; D257-L261 PolarHBondContact O-N 3.18Å; I258-L261 PolarHBondContact O-N 2.89Å; I258-L261 VanDerWaalsContact O-N 3.12Å; D259-L261 VanDerWaalsContact C-N 3.34Å; L261-Q263 VanDerWaalsContact C-N 3.28Å; L261-L298 WeakPolarHBondContact CD2-O 3.44Å; L261-I300 HydrophobicContact CD1-CD1 4.34Å; L261-I300 HydrophobicContact CD1-CG1 4.02Å; L261-L312 HydrophobicContact CD1-CD2 3.48Å; L261-L312 VanDerWaalsContact CD1-CD2 3.48Å; L261-L312 HydrophobicContact CD1-CG 3.98Å; L261-L316 HydrophobicContact CB-CD1 3.86Å; L261-L316 HydrophobicContact CB-CD2 3.98Å; L261-L316 HydrophobicContact CD1-CD2 4.41Å |
| 262 | M | 83.1 | Confident | 82.9 | Confident | 42 Ų | 42 | 94.8 Ų | 94.8 | 21% | 0.207 | 49% | 0.489 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.4 | -3.9 | 174.4 | -73.7 | -175.2 | 62.1 | 0 | 0 | 113.4 | I258 D259 T260 L316 E319 F326 | I258-M262 HydrophobicContact CG2-CG 4.36Å; I258-M262 HydrophobicContact CG2-SD 4.16Å; I258-M262 WeakPolarHBondContact O-CG 3.18Å; I258-M262 PolarHBondContact O-N 3.11Å; D259-M262 PolarHBondContact O-N 3.37Å; T260-M262 VanDerWaalsContact C-N 3.3Å; T260-M262 PolarHBondContact O-N 3.17Å; M262-L316 HydrophobicContact CG-CD1 3.52Å; M262-E319 HydrophobicContact SD-CB 4.05Å; M262-F326 HydrophobicContact CE-CD2 3.97Å; M262-F326 HydrophobicContact CE-CE2 3.44Å; M262-F326 VanDerWaalsContact CE-CE2 3.44Å; M262-F326 HydrophobicContact CE-CZ 4.29Å |
| 263 | Q | 84.2 | Confident | 83.2 | Confident | 147 Ų | 147 | 92.7 Ų | 92.7 | 69% | 0.687 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -68.3 | 151 | 178.9 | -167.7 | 168.4 | -28.2 | 0 | 0 | 111.5 | T260 L261 | T260-Q263 WeakPolarHBondContact O-CB 3.37Å; T260-Q263 PolarHBondContact O-N 3.35Å; L261-Q263 VanDerWaalsContact C-N 3.28Å |
| 264 | E | 83.6 | Confident | 83.2 | Confident | 162 Ų | 162 | 89.8 Ų | 89.8 | 76% | 0.757 | 49% | 0.485 | S | S | * | . | P | Polyproline II helix | trans | -59.6 | 141.2 | 174.3 | -172.3 | 172.5 | -160.1 | 0 | 0 | 111.2 | ||
| 265 | W | 84.3 | Confident | 83.2 | Confident | 90 Ų | 90 | 91.3 Ų | 91.3 | 34% | 0.341 | 48% | 0.48 | S | S | . | . | P | Polyproline II helix | trans | -61.2 | 150.3 | 176.5 | -69.5 | 99.2 | 0 | 0 | 0 | 111.2 | F269 I297 L298 | W265-F269 HydrophobicContact CB-CD1 4.09Å; W265-F269 AromaticContact CD2-CD1 3.58Å; W265-F269 HydrophobicContact CD2-CD1 3.58Å; W265-F269 AromaticContact CD2-CE1 3.62Å; W265-F269 HydrophobicContact CD2-CE1 3.62Å; W265-F269 AromaticContact CE3-CD1 3.16Å; W265-F269 HydrophobicContact CE3-CD1 3.16Å; W265-F269 AromaticContact CE3-CE1 3.21Å; W265-F269 HydrophobicContact CE3-CE1 3.21Å; W265-F269 HydrophobicContact CE3-CG 4.05Å; W265-F269 HydrophobicContact CE3-CZ 4.15Å; W265-F269 AromaticContact CG-CD1 3.98Å; W265-F269 HydrophobicContact CG-CD1 3.98Å; W265-F269 HydrophobicContact CG-CE1 4.35Å; W265-F269 HydrophobicContact CH2-CE1 4.14Å; W265-F269 HydrophobicContact CZ2-CE1 4.45Å; W265-F269 AromaticContact CZ3-CD1 3.88Å; W265-F269 HydrophobicContact CZ3-CD1 3.88Å; W265-F269 AromaticContact CZ3-CE1 3.49Å; W265-F269 HydrophobicContact CZ3-CE1 3.49Å; W265-F269 VanDerWaalsContact CZ3-CE1 3.49Å; W265-F269 HydrophobicContact CZ3-CZ 4.03Å; W265-I297 WeakPolarHBondContact CH2-O 3.34Å; W265-I297 WeakPolarHBondContact CZ3-O 3.43Å; W265-L298 HydrophobicContact CH2-CD2 4.29Å; W265-L298 HydrophobicContact CZ2-CD2 3.8Å |
| 266 | S | 85.9 | Confident | 83 | Confident | 66 Ų | 66 | 94.1 Ų | 94.1 | 46% | 0.462 | 50% | 0.498 | S | S | . | . | P | Polyproline II helix | trans | -61.7 | 144.3 | 172.6 | 66.7 | 0 | 0 | 0 | 0 | 110 | E268 F269 E270 | S266-E268 PolarHBondContact O-N 3Å; S266-F269 WeakPolarHBondContact O-CA 3.48Å; S266-F269 WeakPolarHBondContact O-CB 3.34Å; S266-F269 PolarHBondContact O-N 2.9Å; S266-F269 VanDerWaalsContact OG-CB 3.29Å; S266-F269 WeakPolarHBondContact OG-CB 3.24Å; S266-E270 PolarHBondContact O-N 3.07Å |
| 267 | P | 82.3 | Confident | 82.2 | Confident | 102 Ų | 102 | 97 Ų | 97 | 66% | 0.662 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62 | -30.6 | -173.6 | 23.5 | -34.3 | 0 | 0 | 0 | 112.6 | F269 E271 | P267-F269 VanDerWaalsContact C-N 3.35Å; P267-E271 WeakPolarHBondContact O-CB 3.38Å; P267-E271 PolarHBondContact O-N 3.47Å; P267-E271 VanDerWaalsContact O-N 3.07Å |
| 268 | E | 85.2 | Confident | 81.6 | Confident | 165 Ų | 165 | 95.8 Ų | 95.8 | 77% | 0.771 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.6 | -38.7 | 174.1 | -61 | 179.2 | -175.9 | 0 | 0 | 111.8 | S266 L272 | S266-E268 PolarHBondContact O-N 3Å; E268-L272 PolarHBondContact O-N 2.88Å |
| 269 | F | 83.8 | Confident | 80.9 | Confident | 59 Ų | 59 | 94.8 Ų | 94.8 | 26% | 0.259 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -76.2 | -39.4 | 178.6 | -172.5 | -98.2 | 0 | 0 | 0 | 111.8 | W265 S266 P267 L272 L273 I297 | W265-F269 HydrophobicContact CB-CD1 4.09Å; W265-F269 AromaticContact CD2-CD1 3.58Å; W265-F269 HydrophobicContact CD2-CD1 3.58Å; W265-F269 AromaticContact CD2-CE1 3.62Å; W265-F269 HydrophobicContact CD2-CE1 3.62Å; W265-F269 AromaticContact CE3-CD1 3.16Å; W265-F269 HydrophobicContact CE3-CD1 3.16Å; W265-F269 AromaticContact CE3-CE1 3.21Å; W265-F269 HydrophobicContact CE3-CE1 3.21Å; W265-F269 HydrophobicContact CE3-CG 4.05Å; W265-F269 HydrophobicContact CE3-CZ 4.15Å; W265-F269 AromaticContact CG-CD1 3.98Å; W265-F269 HydrophobicContact CG-CD1 3.98Å; W265-F269 HydrophobicContact CG-CE1 4.35Å; W265-F269 HydrophobicContact CH2-CE1 4.14Å; W265-F269 HydrophobicContact CZ2-CE1 4.45Å; W265-F269 AromaticContact CZ3-CD1 3.88Å; W265-F269 HydrophobicContact CZ3-CD1 3.88Å; W265-F269 AromaticContact CZ3-CE1 3.49Å; W265-F269 HydrophobicContact CZ3-CE1 3.49Å; W265-F269 VanDerWaalsContact CZ3-CE1 3.49Å; W265-F269 HydrophobicContact CZ3-CZ 4.03Å; S266-F269 WeakPolarHBondContact O-CA 3.48Å; S266-F269 WeakPolarHBondContact O-CB 3.34Å; S266-F269 PolarHBondContact O-N 2.9Å; S266-F269 VanDerWaalsContact OG-CB 3.29Å; S266-F269 WeakPolarHBondContact OG-CB 3.24Å; P267-F269 VanDerWaalsContact C-N 3.35Å; F269-L272 WeakPolarHBondContact O-CB 3.23Å; F269-L272 PolarHBondContact O-N 3.34Å; F269-L273 WeakPolarHBondContact O-CB 3.43Å; F269-L273 PolarHBondContact O-N 3.39Å; F269-I297 HydrophobicContact CZ-CG2 4.27Å |
| 270 | E | 83.3 | Confident | 80.2 | Confident | 105 Ų | 105 | 92.7 Ų | 92.7 | 49% | 0.491 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.4 | -43.8 | 175.9 | -171.8 | -176.9 | 178.1 | 0 | 0 | 111.8 | S266 L272 L273 G274 | S266-E270 PolarHBondContact O-N 3.07Å; E270-L272 PolarHBondContact O-N 2.89Å; E270-L273 PolarHBondContact O-N 3.34Å; E270-G274 PolarHBondContact O-N 3.3Å |
| 271 | E | 83.1 | Confident | 79.2 | Confident | 119 Ų | 119 | 92.9 Ų | 92.9 | 56% | 0.556 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.4 | -36.7 | 175.7 | -167.9 | -170.1 | 161 | 0 | 0 | 111.5 | P267 K275 | P267-E271 WeakPolarHBondContact O-CB 3.38Å; P267-E271 PolarHBondContact O-N 3.47Å; P267-E271 VanDerWaalsContact O-N 3.07Å; E271-K275 WeakPolarHBondContact O-CG 2.74Å; E271-K275 PolarHBondContact O-N 3Å; E271-K275 WeakPolarHBondContact OE1-CE 3.4Å; E271-K275 IonicContact OE1-NZ 2.64Å; E271-K275 PolarHBondContact OE1-NZ 2.94Å |
| 272 | L | 81.9 | Confident | 78.1 | Confident | 96 Ų | 96 | 100 Ų | 100 | 50% | 0.503 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -69.7 | -41.8 | 176.6 | -173.3 | 62.3 | 0 | 0 | 0 | 111.6 | E268 F269 E270 G274 K275 V276 | E268-L272 PolarHBondContact O-N 2.88Å; F269-L272 WeakPolarHBondContact O-CB 3.23Å; F269-L272 PolarHBondContact O-N 3.34Å; E270-L272 PolarHBondContact O-N 2.89Å; L272-G274 VanDerWaalsContact C-N 3.29Å; L272-G274 PolarHBondContact O-N 2.72Å; L272-K275 PolarHBondContact O-N 3.03Å; L272-V276 HydrophobicContact CD1-CG2 4.01Å; L272-V276 HydrophobicContact CG-CG2 4.38Å; L272-V276 WeakPolarHBondContact O-CB 3.38Å; L272-V276 PolarHBondContact O-N 2.98Å |
| 273 | L | 79.9 | Confident | 77.5 | Confident | 61 Ų | 61 | 101.7 Ų | 101.7 | 32% | 0.319 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -67.6 | -30.5 | 177 | -166.8 | 64.8 | 0 | 0 | 0 | 112.2 | F269 E270 K275 L278 | F269-L273 WeakPolarHBondContact O-CB 3.43Å; F269-L273 PolarHBondContact O-N 3.39Å; E270-L273 PolarHBondContact O-N 3.34Å; L273-K275 PolarHBondContact O-N 3.49Å; L273-L278 HydrophobicContact CD1-CD2 3.62Å; L273-L278 HydrophobicContact CD1-CG 3.94Å |
| 274 | G | 77.9 | Confident | 76.8 | Confident | 74 Ų | 74 | 103.2 Ų | 103.2 | 76% | 0.763 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -64.7 | -23.9 | 170.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | E270 L272 | E270-G274 PolarHBondContact O-N 3.3Å; L272-G274 VanDerWaalsContact C-N 3.29Å; L272-G274 PolarHBondContact O-N 2.72Å |
| 275 | K | 77.7 | Confident | 76.5 | Confident | 148 Ų | 148 | 97.5 Ų | 97.5 | 64% | 0.643 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -97.7 | -32.8 | 179.4 | -66.2 | 169 | -172 | 168.5 | 0 | 112.9 | E271 L272 L273 | E271-K275 WeakPolarHBondContact O-CG 2.74Å; E271-K275 PolarHBondContact O-N 3Å; E271-K275 WeakPolarHBondContact OE1-CE 3.4Å; E271-K275 IonicContact OE1-NZ 2.64Å; E271-K275 PolarHBondContact OE1-NZ 2.94Å; L272-K275 PolarHBondContact O-N 3.03Å; L273-K275 PolarHBondContact O-N 3.49Å |
| 276 | V | 75.7 | Confident | 76.5 | Confident | 83 Ų | 83 | 95.9 Ų | 95.9 | 50% | 0.503 | 55% | 0.546 | S | S | . | . | S | Bend | trans | -110.5 | 111.2 | -175.8 | -177.7 | 0 | 0 | 0 | 0 | 108 | L272 | L272-V276 HydrophobicContact CD1-CG2 4.01Å; L272-V276 HydrophobicContact CG-CG2 4.38Å; L272-V276 WeakPolarHBondContact O-CB 3.38Å; L272-V276 PolarHBondContact O-N 2.98Å |
| 277 | S | 68.4 | Low | 76.4 | Confident | 101 Ų | 101 | 98.9 Ų | 98.9 | 71% | 0.706 | 56% | 0.557 | S | S | * | * | trans | -59.4 | 143.7 | 173.5 | 49 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 278 | L | 71.9 | Confident | 76.5 | Confident | 93 Ų | 93 | 95.8 Ų | 95.8 | 49% | 0.487 | 54% | 0.539 | S | S | . | . | trans | -55.1 | 144.7 | 172.8 | -75.6 | 170 | 0 | 0 | 0 | 110.7 | L273 T280 I297 | L273-L278 HydrophobicContact CD1-CD2 3.62Å; L273-L278 HydrophobicContact CD1-CG 3.94Å; L278-T280 PolarHBondContact O-N 2.71Å; L278-T280 PolarHBondContact O-OG1 2.99Å; L278-I297 HydrophobicContact CD2-CD1 4.33Å; L278-I297 HydrophobicContact CD2-CG2 4.17Å | ||
| 279 | P | 71.6 | Confident | 76.5 | Confident | 29 Ų | 29 | 93 Ų | 93 | 19% | 0.188 | 53% | 0.526 | C | S | . | . | trans | -50.9 | 106.1 | 175.3 | -27.3 | 35.3 | 0 | 0 | 0 | 110.9 | I283 Y290 I297 | P279-I283 VanDerWaalsContact CA-CD1 3.5Å; P279-I283 HydrophobicContact CB-CD1 3.51Å; P279-Y290 HydrophobicContact CB-CE2 4.13Å; P279-Y290 WeakPolarHBondContact O-CE2 3.18Å; P279-Y290 PolarHBondContact O-OH 3.43Å; P279-I297 HydrophobicContact CG-CD1 3.69Å | ||
| 280 | T | 68.6 | Low | 76.7 | Confident | 90 Ų | 90 | 93.3 Ų | 93.3 | 55% | 0.552 | 53% | 0.526 | S | S | * | . | trans | -78.7 | 155.3 | 178.5 | -56.1 | 0 | 0 | 0 | 0 | 109.1 | L278 E282 I283 | L278-T280 PolarHBondContact O-N 2.71Å; L278-T280 PolarHBondContact O-OG1 2.99Å; T280-E282 HydrophobicContact CG2-CG 4.45Å; T280-E282 PolarHBondContact O-N 2.9Å; T280-I283 PolarHBondContact O-N 2.9Å | ||
| 281 | A | 65.1 | Low | 76.8 | Confident | 90 Ų | 90 | 89.6 Ų | 89.6 | 74% | 0.744 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61 | 0.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 282 | E | 61.8 | Low | 77 | Confident | 178 Ų | 178 | 86 Ų | 86 | 83% | 0.832 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.2 | 2.2 | 176.4 | -58.3 | -152 | 162 | 0 | 0 | 113.9 | T280 D284 | T280-E282 HydrophobicContact CG2-CG 4.45Å; T280-E282 PolarHBondContact O-N 2.9Å; E282-D284 PolarHBondContact O-N 3.44Å |
| 283 | I | 70.8 | Confident | 77.1 | Confident | 78 Ų | 78 | 84.6 Ų | 84.6 | 40% | 0.4 | 49% | 0.486 | S | S | . | . | S | Bend | trans | -73.4 | 129.3 | 173.4 | -67.7 | 163.7 | 0 | 0 | 0 | 108.6 | P279 T280 C285 | P279-I283 VanDerWaalsContact CA-CD1 3.5Å; P279-I283 HydrophobicContact CB-CD1 3.51Å; T280-I283 PolarHBondContact O-N 2.9Å; I283-C285 HydrophobicContact CG2-CB 4.08Å; I283-C285 PolarHBondContact O-N 2.67Å; I283-C285 PolarHBondContact O-SG 2.84Å; I283-C285 VanDerWaalsContact O-SG 3.37Å |
| 284 | D | 69.9 | Low | 77.5 | Confident | 178 Ų | 178 | 83.3 Ų | 83.3 | 95% | 0.952 | 48% | 0.479 | S | S | * | . | S | Bend | trans | -66.1 | 66.3 | 175.8 | -72.1 | -38.5 | 0 | 0 | 0 | 112.1 | E282 | E282-D284 PolarHBondContact O-N 3.44Š|
| 285 | C | 77.1 | Confident | 78 | Confident | 42 Ų | 42 | 79.8 Ų | 79.8 | 28% | 0.284 | 44% | 0.442 | S | S | . | . | trans | -127.8 | 153.3 | 179.3 | 60.7 | 0 | 0 | 0 | 0 | 110.9 | I283 E289 M293 | I283-C285 HydrophobicContact CG2-CB 4.08Å; I283-C285 PolarHBondContact O-N 2.67Å; I283-C285 PolarHBondContact O-SG 2.84Å; I283-C285 VanDerWaalsContact O-SG 3.37Å; C285-E289 HydrophobicContact CB-CB 4.36Å; C285-M293 HydrophobicContact CB-CE 4.11Å; C285-M293 VanDerWaalsContact SG-CE 3.57Å | ||
| 286 | S | 83.8 | Confident | 78.4 | Confident | 56 Ų | 56 | 76 Ų | 76 | 39% | 0.392 | 44% | 0.438 | S | S | . | . | trans | -70.8 | 152.8 | 172.8 | 69.4 | 0 | 0 | 0 | 0 | 110.5 | A288 E289 Y290 | S286-A288 PolarHBondContact O-N 2.97Å; S286-A288 VanDerWaalsContact O-N 3.11Å; S286-E289 WeakPolarHBondContact CB-OE2 3.35Å; S286-E289 PolarHBondContact N-OE2 3.19Å; S286-E289 PolarHBondContact O-N 3.41Å; S286-E289 VanDerWaalsContact OG-CG 3.3Å; S286-E289 WeakPolarHBondContact OG-CG 3.48Å; S286-E289 PolarHBondContact OG-N 3.35Å; S286-E289 PolarHBondContact OG-OE2 3.38Å; S286-Y290 PolarHBondContact O-N 3.18Å | ||
| 287 | L | 85.1 | Confident | 78.9 | Confident | 130 Ų | 130 | 74 Ų | 74 | 68% | 0.681 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -52.9 | -36.8 | 178.8 | 177 | 61.9 | 0 | 0 | 0 | 112.4 | Y290 I291 | L287-Y290 PolarHBondContact O-N 3.27Å; L287-I291 HydrophobicContact CD1-CD1 4.15Å; L287-I291 HydrophobicContact CD1-CG1 4.37Å; L287-I291 HydrophobicContact CG-CD1 3.96Å; L287-I291 WeakPolarHBondContact O-CD1 3.45Å; L287-I291 WeakPolarHBondContact O-CG1 3.42Å; L287-I291 PolarHBondContact O-N 3.44Å |
| 288 | A | 84.6 | Confident | 79.8 | Confident | 36 Ų | 36 | 71.2 Ų | 71.2 | 30% | 0.298 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -66.5 | -43.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | S286 Y290 I291 D292 | S286-A288 PolarHBondContact O-N 2.97Å; S286-A288 VanDerWaalsContact O-N 3.11Å; A288-Y290 VanDerWaalsContact C-N 3.35Å; A288-I291 PolarHBondContact O-N 3.15Å; A288-D292 PolarHBondContact O-N 3.4Å |
| 289 | E | 85.5 | Confident | 80.5 | Confident | 106 Ų | 106 | 72.2 Ų | 72.2 | 50% | 0.495 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -68.4 | -36.8 | 176.4 | -68.5 | 161.3 | 147.3 | 0 | 0 | 111.1 | C285 S286 D292 M293 | C285-E289 HydrophobicContact CB-CB 4.36Å; S286-E289 WeakPolarHBondContact CB-OE2 3.35Å; S286-E289 PolarHBondContact N-OE2 3.19Å; S286-E289 PolarHBondContact O-N 3.41Å; S286-E289 VanDerWaalsContact OG-CG 3.3Å; S286-E289 WeakPolarHBondContact OG-CG 3.48Å; S286-E289 PolarHBondContact OG-N 3.35Å; S286-E289 PolarHBondContact OG-OE2 3.38Å; E289-D292 PolarHBondContact O-N 3.18Å; E289-M293 VanDerWaalsContact O-CG 3.32Å; E289-M293 WeakPolarHBondContact O-CG 3.42Å; E289-M293 PolarHBondContact O-N 2.79Å |
| 290 | Y | 86.9 | Confident | 81.3 | Confident | 67 Ų | 67 | 71.1 Ų | 71.1 | 26% | 0.263 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -60.9 | -46.5 | 174.2 | -170.6 | -104.6 | 0 | 0 | 0 | 111.9 | P279 S286 L287 A288 D292 M293 I294 | P279-Y290 HydrophobicContact CB-CE2 4.13Å; P279-Y290 WeakPolarHBondContact O-CE2 3.18Å; P279-Y290 PolarHBondContact O-OH 3.43Å; S286-Y290 PolarHBondContact O-N 3.18Å; L287-Y290 PolarHBondContact O-N 3.27Å; A288-Y290 VanDerWaalsContact C-N 3.35Å; Y290-D292 VanDerWaalsContact C-N 3.31Å; Y290-D292 PolarHBondContact O-N 3.49Å; Y290-M293 HydrophobicContact CD2-CE 3.91Å; Y290-M293 PolarHBondContact O-N 3.44Å; Y290-I294 HydrophobicContact CD1-CG1 4.21Å; Y290-I294 HydrophobicContact CE1-CD1 4.4Å; Y290-I294 HydrophobicContact CE1-CG1 3.81Å; Y290-I294 HydrophobicContact CE2-CD1 4.33Å; Y290-I294 HydrophobicContact CE2-CG1 4.3Å; Y290-I294 WeakPolarHBondContact O-CG1 3.36Å; Y290-I294 PolarHBondContact O-N 3.47Å |
| 291 | I | 86.6 | Confident | 82.2 | Confident | 26 Ų | 26 | 68.6 Ų | 68.6 | 13% | 0.133 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -59 | -45.1 | 175.3 | -67.9 | 159.9 | 0 | 0 | 0 | 110.4 | L287 A288 M293 I294 C295 R306 L310 | L287-I291 HydrophobicContact CD1-CD1 4.15Å; L287-I291 HydrophobicContact CD1-CG1 4.37Å; L287-I291 HydrophobicContact CG-CD1 3.96Å; L287-I291 WeakPolarHBondContact O-CD1 3.45Å; L287-I291 WeakPolarHBondContact O-CG1 3.42Å; L287-I291 PolarHBondContact O-N 3.44Å; A288-I291 PolarHBondContact O-N 3.15Å; I291-M293 VanDerWaalsContact C-N 3.35Å; I291-M293 PolarHBondContact O-N 3.2Å; I291-I294 PolarHBondContact O-N 3.2Å; I291-C295 VanDerWaalsContact O-CB 3.32Å; I291-C295 WeakPolarHBondContact O-CB 3.41Å; I291-C295 PolarHBondContact O-N 3.16Å; I291-C295 PolarHBondContact O-SG 3.02Å; I291-C295 VanDerWaalsContact O-SG 3.39Å; I291-R306 HydrophobicContact CG2-CB 4.48Å; I291-L310 HydrophobicContact CD1-CD1 4.14Å; I291-L310 HydrophobicContact CG1-CD2 4.31Å; I291-L310 HydrophobicContact CG2-CD1 4.5Å; I291-L310 HydrophobicContact CG2-CD2 3.9Å; I291-L310 HydrophobicContact CG2-CG 4.07Å |
| 292 | D | 86.8 | Confident | 83.1 | Confident | 45 Ų | 45 | 66.5 Ų | 66.5 | 24% | 0.241 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -64.6 | -39.3 | -179.5 | -63.8 | -11.9 | 0 | 0 | 0 | 111.8 | A288 E289 Y290 A296 R306 | A288-D292 PolarHBondContact O-N 3.4Å; E289-D292 PolarHBondContact O-N 3.18Å; Y290-D292 VanDerWaalsContact C-N 3.31Å; Y290-D292 PolarHBondContact O-N 3.49Å; D292-A296 WeakPolarHBondContact O-CB 3.34Å; D292-A296 PolarHBondContact O-N 2.86Å; D292-R306 IonicContact OD1-CZ 3.56Å; D292-R306 IonicContact OD1-NE 2.82Å; D292-R306 PolarHBondContact OD1-NE 3.3Å; D292-R306 IonicContact OD1-NH2 3.55Å; D292-R306 IonicContact OD2-CZ 3.46Å; D292-R306 IonicContact OD2-NE 3.41Å; D292-R306 PolarHBondContact OD2-NE 3.44Å; D292-R306 IonicContact OD2-NH2 2.69Å; D292-R306 PolarHBondContact OD2-NH2 3.04Å |
| 293 | M | 84.6 | Confident | 84.1 | Confident | 66 Ų | 66 | 61.1 Ų | 61.1 | 33% | 0.325 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63 | -47.3 | 174.6 | -73.4 | -171.1 | -62.6 | 0 | 0 | 112 | C285 E289 Y290 I291 A296 I297 | C285-M293 HydrophobicContact CB-CE 4.11Å; C285-M293 VanDerWaalsContact SG-CE 3.57Å; E289-M293 VanDerWaalsContact O-CG 3.32Å; E289-M293 WeakPolarHBondContact O-CG 3.42Å; E289-M293 PolarHBondContact O-N 2.79Å; Y290-M293 HydrophobicContact CD2-CE 3.91Å; Y290-M293 PolarHBondContact O-N 3.44Å; I291-M293 VanDerWaalsContact C-N 3.35Å; I291-M293 PolarHBondContact O-N 3.2Å; M293-A296 PolarHBondContact O-N 3.14Å; M293-I297 WeakPolarHBondContact O-CG1 3.28Å; M293-I297 PolarHBondContact O-N 3.04Å |
| 294 | I | 87.1 | Confident | 84.3 | Confident | 33 Ų | 33 | 66.8 Ų | 66.8 | 17% | 0.169 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -67.3 | -42.6 | -179.8 | -63.8 | -60.9 | 0 | 0 | 0 | 111 | Y290 I291 A296 I297 L298 L313 | Y290-I294 HydrophobicContact CD1-CG1 4.21Å; Y290-I294 HydrophobicContact CE1-CD1 4.4Å; Y290-I294 HydrophobicContact CE1-CG1 3.81Å; Y290-I294 HydrophobicContact CE2-CD1 4.33Å; Y290-I294 HydrophobicContact CE2-CG1 4.3Å; Y290-I294 WeakPolarHBondContact O-CG1 3.36Å; Y290-I294 PolarHBondContact O-N 3.47Å; I291-I294 PolarHBondContact O-N 3.2Å; I294-A296 VanDerWaalsContact C-N 3.3Å; I294-A296 PolarHBondContact O-N 2.94Å; I294-I297 HydrophobicContact CD1-CD1 4.44Å; I294-I297 PolarHBondContact O-N 3.01Å; I294-L298 HydrophobicContact CG2-CD1 3.95Å; I294-L298 WeakPolarHBondContact O-CG 3.38Å; I294-L298 PolarHBondContact O-N 2.84Å; I294-L313 HydrophobicContact CG2-CD2 4.46Å |
| 295 | C | 88.3 | Confident | 84.7 | Confident | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -62.4 | -37.9 | 174.2 | -74.3 | 0 | 0 | 0 | 0 | 111.8 | I291 L298 D299 I300 V302 | I291-C295 VanDerWaalsContact O-CB 3.32Å; I291-C295 WeakPolarHBondContact O-CB 3.41Å; I291-C295 PolarHBondContact O-N 3.16Å; I291-C295 PolarHBondContact O-SG 3.02Å; I291-C295 VanDerWaalsContact O-SG 3.39Å; C295-L298 CarbonylContact O-C 3.54Å; C295-L298 PolarHBondContact O-N 2.89Å; C295-D299 PolarHBondContact O-N 3.4Å; C295-I300 HydrophobicContact CB-CB 4.11Å; C295-I300 PolarHBondContact O-N 2.97Å; C295-V302 HydrophobicContact CB-CG2 3.61Å |
| 296 | A | 86.3 | Confident | 85 | Confident | 68 Ų | 68 | 62.8 Ų | 62.8 | 56% | 0.562 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -67.1 | -37.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | D292 M293 I294 L298 D299 | D292-A296 WeakPolarHBondContact O-CB 3.34Å; D292-A296 PolarHBondContact O-N 2.86Å; M293-A296 PolarHBondContact O-N 3.14Å; I294-A296 VanDerWaalsContact C-N 3.3Å; I294-A296 PolarHBondContact O-N 2.94Å; A296-L298 VanDerWaalsContact C-N 3.28Å; A296-L298 PolarHBondContact O-N 2.93Å; A296-D299 PolarHBondContact O-N 3.28Å |
| 297 | I | 86.4 | Confident | 85.1 | Confident | 42 Ų | 42 | 66.2 Ų | 66.2 | 22% | 0.215 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -63.1 | -38.8 | 173.8 | -71.9 | 166 | 0 | 0 | 0 | 110.7 | W265 F269 L278 P279 M293 I294 D299 | W265-I297 WeakPolarHBondContact CH2-O 3.34Å; W265-I297 WeakPolarHBondContact CZ3-O 3.43Å; F269-I297 HydrophobicContact CZ-CG2 4.27Å; L278-I297 HydrophobicContact CD2-CD1 4.33Å; L278-I297 HydrophobicContact CD2-CG2 4.17Å; P279-I297 HydrophobicContact CG-CD1 3.69Å; M293-I297 WeakPolarHBondContact O-CG1 3.28Å; M293-I297 PolarHBondContact O-N 3.04Å; I294-I297 HydrophobicContact CD1-CD1 4.44Å; I294-I297 PolarHBondContact O-N 3.01Å; I297-D299 VanDerWaalsContact C-N 3.28Å; I297-D299 PolarHBondContact O-N 3.08Å |
| 298 | L | 86.6 | Confident | 85.1 | Confident | 42 Ų | 42 | 61.5 Ų | 61.5 | 22% | 0.22 | 32% | 0.316 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.9 | 11.3 | -177.4 | -64.9 | 173.5 | 0 | 0 | 0 | 113.8 | L261 W265 I294 C295 A296 I300 L313 | L261-L298 WeakPolarHBondContact CD2-O 3.44Å; W265-L298 HydrophobicContact CH2-CD2 4.29Å; W265-L298 HydrophobicContact CZ2-CD2 3.8Å; I294-L298 HydrophobicContact CG2-CD1 3.95Å; I294-L298 WeakPolarHBondContact O-CG 3.38Å; I294-L298 PolarHBondContact O-N 2.84Å; C295-L298 CarbonylContact O-C 3.54Å; C295-L298 PolarHBondContact O-N 2.89Å; A296-L298 VanDerWaalsContact C-N 3.28Å; A296-L298 PolarHBondContact O-N 2.93Å; L298-I300 HydrophobicContact CB-CD1 4.12Å; L298-I300 HydrophobicContact CB-CG1 4.03Å; L298-I300 WeakPolarHBondContact O-CG1 3.43Å; L298-I300 PolarHBondContact O-N 2.75Å; L298-I300 VanDerWaalsContact O-N 3.13Å; L298-L313 HydrophobicContact CD1-CD1 3.16Å |
| 299 | D | 87.1 | Confident | 85.3 | Confident | 115 Ų | 115 | 59.8 Ų | 59.8 | 62% | 0.615 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54 | 28 | -175.7 | -72.9 | -45.2 | 0 | 0 | 0 | 114.5 | C295 A296 I297 | C295-D299 PolarHBondContact O-N 3.4Å; A296-D299 PolarHBondContact O-N 3.28Å; I297-D299 VanDerWaalsContact C-N 3.28Å; I297-D299 PolarHBondContact O-N 3.08Å |
| 300 | I | 88.8 | Confident | 85.5 | Confident | 5 Ų | 5 | 56.8 Ų | 56.8 | 3% | 0.026 | 29% | 0.289 | C | S | . | . | P | Polyproline II helix | trans | -92.9 | 116.9 | 176.9 | -54.9 | -179.2 | 0 | 0 | 0 | 109.4 | M255 L261 C295 L298 V302 L312 L313 | M255-I300 HydrophobicContact SD-CG2 4.25Å; L261-I300 HydrophobicContact CD1-CD1 4.34Å; L261-I300 HydrophobicContact CD1-CG1 4.02Å; C295-I300 HydrophobicContact CB-CB 4.11Å; C295-I300 PolarHBondContact O-N 2.97Å; L298-I300 HydrophobicContact CB-CD1 4.12Å; L298-I300 HydrophobicContact CB-CG1 4.03Å; L298-I300 WeakPolarHBondContact O-CG1 3.43Å; L298-I300 PolarHBondContact O-N 2.75Å; L298-I300 VanDerWaalsContact O-N 3.13Å; I300-V302 PolarHBondContact O-N 3Å; I300-L312 HydrophobicContact CD1-CD2 4.26Å; I300-L312 HydrophobicContact CG1-CD2 4.16Å; I300-L312 HydrophobicContact CG2-CD2 3.82Å; I300-L313 HydrophobicContact CD1-CB 4.1Å; I300-L313 HydrophobicContact CD1-CD1 4.21Å |
| 301 | P | 86.9 | Confident | 85.5 | Confident | 37 Ų | 37 | 57 Ų | 57 | 24% | 0.24 | 29% | 0.292 | C | S | . | . | P | Polyproline II helix | trans | -68.5 | 132.9 | 179.2 | 27.8 | -33.6 | 0 | 0 | 0 | 111.3 | M255 P256 Y303 S309 | M255-P301 HydrophobicContact SD-CG 3.84Å; P256-P301 HydrophobicContact CG-CG 4.49Å; P301-Y303 HydrophobicContact CB-CE1 4.14Å; P301-Y303 HydrophobicContact CB-CE2 4.07Å; P301-Y303 HydrophobicContact CG-CE2 3.93Å; P301-S309 PolarHBondContact O-OG 3.45Å |
| 302 | V | 85.4 | Confident | 85.6 | Confident | 46 Ų | 46 | 55.9 Ų | 55.9 | 28% | 0.279 | 29% | 0.287 | S | S | . | . | P | Polyproline II helix | trans | -98.5 | 118.2 | 171.1 | -175.8 | 0 | 0 | 0 | 0 | 109.6 | C295 I300 R306 | C295-V302 HydrophobicContact CB-CG2 3.61Å; I300-V302 PolarHBondContact O-N 3Å; V302-R306 HydrophobicContact CG1-CG 3.73Å |
| 303 | Y | 82.4 | Confident | 85.7 | Confident | 65 Ų | 65 | 55.3 Ų | 55.3 | 26% | 0.255 | 28% | 0.284 | S | S | . | . | trans | -101 | -140 | 177.2 | -58.2 | -61.9 | 0 | 0 | 0 | 111.3 | R253 P254 P301 S305 | R253-Y303 HydrophobicContact CB-CD1 4.48Å; R253-Y303 HydrophobicContact CB-CD2 3.76Å; R253-Y303 HydrophobicContact CB-CE1 4.18Å; R253-Y303 HydrophobicContact CB-CE2 3.4Å; R253-Y303 VanDerWaalsContact CB-CE2 3.4Å; R253-Y303 HydrophobicContact CB-CG 4.28Å; R253-Y303 VanDerWaalsContact CD-CE1 3.48Å; R253-Y303 HydrophobicContact CG-CD2 4.41Å; R253-Y303 HydrophobicContact CG-CE1 4.48Å; R253-Y303 HydrophobicContact CG-CE2 4.37Å; R253-Y303 HydrophobicContact CG-CG 4.46Å; P254-Y303 PolarHBondContact O-OH 2.82Å; P301-Y303 HydrophobicContact CB-CE1 4.14Å; P301-Y303 HydrophobicContact CB-CE2 4.07Å; P301-Y303 HydrophobicContact CG-CE2 3.93Å; Y303-S305 VanDerWaalsContact C-N 3.34Å | ||
| 304 | K | 74.3 | Confident | 86 | Confident | 198 Ų | 198 | 58.6 Ų | 58.6 | 86% | 0.861 | 30% | 0.296 | S | S | * | . | S | Bend | trans | -72 | -28 | 179.6 | -63.4 | -175.5 | 178.4 | -177.8 | 0 | 113.1 | ||
| 305 | S | 79.3 | Confident | 86 | Confident | 41 Ų | 41 | 58.4 Ų | 58.4 | 29% | 0.287 | 30% | 0.298 | S | S | . | . | trans | -121.2 | 115.6 | 179.9 | -177.2 | 0 | 0 | 0 | 0 | 109.9 | Y303 I307 Q308 | Y303-S305 VanDerWaalsContact C-N 3.34Å; S305-I307 PolarHBondContact O-N 2.96Å; S305-I307 WeakPolarHBondContact OG-CB 3.37Å; S305-I307 PolarHBondContact OG-N 3.24Å; S305-Q308 PolarHBondContact O-N 3.38Å | ||
| 306 | R | 83.4 | Confident | 86 | Confident | 95 Ų | 95 | 59.3 Ų | 59.3 | 36% | 0.358 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -65.4 | -20 | 173.4 | -70.2 | 172.5 | 174.5 | 84.8 | -0.1 | 112.4 | I291 D292 V302 Q308 S309 L310 | I291-R306 HydrophobicContact CG2-CB 4.48Å; D292-R306 IonicContact OD1-CZ 3.56Å; D292-R306 IonicContact OD1-NE 2.82Å; D292-R306 PolarHBondContact OD1-NE 3.3Å; D292-R306 IonicContact OD1-NH2 3.55Å; D292-R306 IonicContact OD2-CZ 3.46Å; D292-R306 IonicContact OD2-NE 3.41Å; D292-R306 PolarHBondContact OD2-NE 3.44Å; D292-R306 IonicContact OD2-NH2 2.69Å; D292-R306 PolarHBondContact OD2-NH2 3.04Å; V302-R306 HydrophobicContact CG1-CG 3.73Å; R306-Q308 VanDerWaalsContact C-N 3.28Å; R306-Q308 PolarHBondContact O-N 3.1Å; R306-S309 PolarHBondContact O-N 3.14Å; R306-L310 WeakPolarHBondContact O-CB 3.29Å; R306-L310 WeakPolarHBondContact O-CG 3.4Å; R306-L310 PolarHBondContact O-N 3.3Å |
| 307 | I | 85.9 | Confident | 86 | Confident | 127 Ų | 127 | 62.6 Ų | 62.6 | 65% | 0.651 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -63.8 | -36.9 | -179.8 | -56.9 | 168.3 | 0 | 0 | 0 | 110.6 | S305 L310 H311 | S305-I307 PolarHBondContact O-N 2.96Å; S305-I307 WeakPolarHBondContact OG-CB 3.37Å; S305-I307 PolarHBondContact OG-N 3.24Å; I307-L310 PolarHBondContact O-N 3.23Å; I307-H311 WeakPolarHBondContact O-CB 3.25Å; I307-H311 PolarHBondContact O-N 3.35Å |
| 308 | Q | 84.8 | Confident | 86 | Confident | 32 Ų | 32 | 63.9 Ų | 63.9 | 15% | 0.15 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -67.9 | -42.4 | 178.5 | -72.4 | -176.6 | 2.3 | 0 | 0 | 111.6 | Y251 T252 M255 S305 R306 H311 L312 | Y251-Q308 HydrophobicContact CD1-CB 3.89Å; Y251-Q308 HydrophobicContact CD1-CG 4.11Å; Y251-Q308 HydrophobicContact CE1-CB 4.32Å; Y251-Q308 WeakPolarHBondContact CE1-O 3.26Å; T252-Q308 VanDerWaalsContact N-OE1 3.1Å; T252-Q308 PolarHBondContact OG1-OE1 3.09Å; M255-Q308 HydrophobicContact CE-CB 4.15Å; S305-Q308 PolarHBondContact O-N 3.38Å; R306-Q308 VanDerWaalsContact C-N 3.28Å; R306-Q308 PolarHBondContact O-N 3.1Å; Q308-H311 PolarHBondContact O-N 3.02Å; Q308-L312 PolarHBondContact O-N 3.09Å |
| 309 | S | 88.2 | Confident | 85.9 | Confident | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -67.7 | -39.4 | 176 | -48.3 | 0 | 0 | 0 | 0 | 111.8 | P301 R306 L312 L313 | P301-S309 PolarHBondContact O-OG 3.45Å; R306-S309 PolarHBondContact O-N 3.14Å; S309-L312 PolarHBondContact O-N 2.99Å; S309-L313 PolarHBondContact O-N 3.46Å |
| 310 | L | 89.3 | Confident | 85.6 | Confident | 42 Ų | 42 | 64.3 Ų | 64.3 | 22% | 0.22 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -66.1 | -38.1 | 174.2 | -76.9 | 173.5 | 0 | 0 | 0 | 112.7 | I291 R306 I307 L312 L313 F314 | I291-L310 HydrophobicContact CD1-CD1 4.14Å; I291-L310 HydrophobicContact CG1-CD2 4.31Å; I291-L310 HydrophobicContact CG2-CD1 4.5Å; I291-L310 HydrophobicContact CG2-CD2 3.9Å; I291-L310 HydrophobicContact CG2-CG 4.07Å; R306-L310 WeakPolarHBondContact O-CB 3.29Å; R306-L310 WeakPolarHBondContact O-CG 3.4Å; R306-L310 PolarHBondContact O-N 3.3Å; I307-L310 PolarHBondContact O-N 3.23Å; L310-L312 VanDerWaalsContact C-N 3.32Å; L310-L312 PolarHBondContact O-N 3.47Å; L310-L313 HydrophobicContact CD2-CD2 4.07Å; L310-L313 WeakPolarHBondContact O-CB 3.38Å; L310-L313 PolarHBondContact O-N 3.23Å; L310-F314 HydrophobicContact CB-CE2 4.3Å; L310-F314 HydrophobicContact CD2-CE2 4.46Å; L310-F314 WeakPolarHBondContact O-CD2 3.4Å; L310-F314 WeakPolarHBondContact O-CG 3.3Å; L310-F314 PolarHBondContact O-N 2.83Å |
| 311 | H | 88 | Confident | 85.3 | Confident | 72 Ų | 72 | 69.4 Ų | 69.4 | 33% | 0.333 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -58.4 | -48.1 | 173.7 | 179.2 | -92.3 | 0 | 0 | 0 | 110.1 | V249 Y251 I307 Q308 L313 F314 S315 | V249-H311 WeakPolarHBondContact CG2-NE2 3.36Å; Y251-H311 AromaticContact CE1-ND1 3.9Å; Y251-H311 AromaticContact CZ-ND1 3.72Å; Y251-H311 PolarHBondContact OH-ND1 2.91Å; I307-H311 WeakPolarHBondContact O-CB 3.25Å; I307-H311 PolarHBondContact O-N 3.35Å; Q308-H311 PolarHBondContact O-N 3.02Å; H311-L313 VanDerWaalsContact C-N 3.34Å; H311-L313 PolarHBondContact O-N 3.21Å; H311-F314 PolarHBondContact O-N 3.12Å; H311-S315 PolarHBondContact CE1-OG 2.79Å; H311-S315 WeakPolarHBondContact O-CB 3.21Å; H311-S315 PolarHBondContact O-N 3.1Å; H311-S315 PolarHBondContact O-OG 3.02Å |
| 312 | L | 88.4 | Confident | 85 | Confident | 3 Ų | 3 | 73 Ų | 73 | 2% | 0.016 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -61.5 | -41.2 | 176.1 | -168.7 | 73.1 | 0 | 0 | 0 | 112.5 | M255 I258 L261 I300 Q308 S309 L310 F314 S315 L316 | M255-L312 HydrophobicContact CG-CB 4.43Å; M255-L312 HydrophobicContact CG-CD1 4.1Å; M255-L312 HydrophobicContact CG-CD2 3.33Å; M255-L312 HydrophobicContact CG-CG 4.15Å; M255-L312 HydrophobicContact SD-CD2 3.77Å; I258-L312 HydrophobicContact CG1-CD1 4Å; L261-L312 HydrophobicContact CD1-CD2 3.48Å; L261-L312 VanDerWaalsContact CD1-CD2 3.48Å; L261-L312 HydrophobicContact CD1-CG 3.98Å; I300-L312 HydrophobicContact CD1-CD2 4.26Å; I300-L312 HydrophobicContact CG1-CD2 4.16Å; I300-L312 HydrophobicContact CG2-CD2 3.82Å; Q308-L312 PolarHBondContact O-N 3.09Å; S309-L312 PolarHBondContact O-N 2.99Å; L310-L312 VanDerWaalsContact C-N 3.32Å; L310-L312 PolarHBondContact O-N 3.47Å; L312-F314 PolarHBondContact O-N 2.74Å; L312-S315 PolarHBondContact O-N 3.27Å; L312-L316 VanDerWaalsContact O-CB 3.29Å; L312-L316 WeakPolarHBondContact O-CB 3.42Å; L312-L316 PolarHBondContact O-N 3.01Å |
| 313 | L | 89.3 | Confident | 84.5 | Confident | 33 Ų | 33 | 72.1 Ų | 72.1 | 17% | 0.173 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -58.7 | -47 | 176.1 | 178.5 | 64.6 | 0 | 0 | 0 | 112 | I294 L298 I300 S309 L310 H311 L316 Y317 | I294-L313 HydrophobicContact CG2-CD2 4.46Å; L298-L313 HydrophobicContact CD1-CD1 3.16Å; I300-L313 HydrophobicContact CD1-CB 4.1Å; I300-L313 HydrophobicContact CD1-CD1 4.21Å; S309-L313 PolarHBondContact O-N 3.46Å; L310-L313 HydrophobicContact CD2-CD2 4.07Å; L310-L313 WeakPolarHBondContact O-CB 3.38Å; L310-L313 PolarHBondContact O-N 3.23Å; H311-L313 VanDerWaalsContact C-N 3.34Å; H311-L313 PolarHBondContact O-N 3.21Å; L313-L316 PolarHBondContact O-N 2.93Å; L313-Y317 WeakPolarHBondContact O-CB 3.23Å; L313-Y317 PolarHBondContact O-N 2.84Å |
| 314 | F | 89.2 | Confident | 83.6 | Confident | 135 Ų | 135 | 77.1 Ų | 77.1 | 59% | 0.592 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -72.5 | -35 | 178.6 | -67.7 | -50 | 0 | 0 | 0 | 112.4 | L310 H311 L312 Y317 S318 | L310-F314 HydrophobicContact CB-CE2 4.3Å; L310-F314 HydrophobicContact CD2-CE2 4.46Å; L310-F314 WeakPolarHBondContact O-CD2 3.4Å; L310-F314 WeakPolarHBondContact O-CG 3.3Å; L310-F314 PolarHBondContact O-N 2.83Å; H311-F314 PolarHBondContact O-N 3.12Å; L312-F314 PolarHBondContact O-N 2.74Å; F314-Y317 PolarHBondContact O-N 2.83Å; F314-S318 WeakPolarHBondContact O-CB 3.46Å; F314-S318 PolarHBondContact O-N 3.42Å |
| 315 | S | 87.4 | Confident | 82.9 | Confident | 28 Ų | 28 | 74 Ų | 74 | 20% | 0.196 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.8 | -47.3 | 171.3 | -63.6 | 0 | 0 | 0 | 0 | 110.9 | H311 L312 Y317 S318 E319 | H311-S315 PolarHBondContact CE1-OG 2.79Å; H311-S315 WeakPolarHBondContact O-CB 3.21Å; H311-S315 PolarHBondContact O-N 3.1Å; H311-S315 PolarHBondContact O-OG 3.02Å; L312-S315 PolarHBondContact O-N 3.27Å; S315-Y317 VanDerWaalsContact C-N 3.34Å; S315-Y317 PolarHBondContact O-N 3.4Å; S315-S318 WeakPolarHBondContact O-CB 3.47Å; S315-S318 PolarHBondContact O-N 3.23Å; S315-S318 VanDerWaalsContact O-N 3.16Å; S315-E319 PolarHBondContact O-N 2.95Å |
| 316 | L | 87.7 | Confident | 82 | Confident | 20 Ų | 20 | 74 Ų | 74 | 11% | 0.105 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -57.6 | -47.2 | 174.8 | 178.6 | 64.6 | 0 | 0 | 0 | 111.1 | I258 L261 M262 L312 L313 S318 E319 F320 | I258-L316 HydrophobicContact CG2-CD1 4.07Å; L261-L316 HydrophobicContact CB-CD1 3.86Å; L261-L316 HydrophobicContact CB-CD2 3.98Å; L261-L316 HydrophobicContact CD1-CD2 4.41Å; M262-L316 HydrophobicContact CG-CD1 3.52Å; L312-L316 VanDerWaalsContact O-CB 3.29Å; L312-L316 WeakPolarHBondContact O-CB 3.42Å; L312-L316 PolarHBondContact O-N 3.01Å; L313-L316 PolarHBondContact O-N 2.93Å; L316-S318 VanDerWaalsContact C-N 3.32Å; L316-S318 PolarHBondContact O-N 2.81Å; L316-E319 PolarHBondContact O-N 3.22Å; L316-F320 WeakPolarHBondContact O-CB 3.37Å; L316-F320 PolarHBondContact O-N 3.17Å |
| 317 | Y | 87.1 | Confident | 81 | Confident | 137 Ų | 137 | 74.2 Ų | 74.2 | 54% | 0.537 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -61 | -40.9 | 176.4 | -178 | -98.2 | 0 | 0 | 0 | 112.5 | L313 F314 S315 F320 K321 | L313-Y317 WeakPolarHBondContact O-CB 3.23Å; L313-Y317 PolarHBondContact O-N 2.84Å; F314-Y317 PolarHBondContact O-N 2.83Å; S315-Y317 VanDerWaalsContact C-N 3.34Å; S315-Y317 PolarHBondContact O-N 3.4Å; Y317-F320 PolarHBondContact O-N 3.29Å; Y317-K321 HydrophobicContact CD1-CG 4.12Å; Y317-K321 HydrophobicContact CE1-CD 4.49Å; Y317-K321 HydrophobicContact CE1-CG 3.72Å; Y317-K321 HydrophobicContact CE2-CG 4.45Å; Y317-K321 WeakPolarHBondContact O-CB 3.31Å; Y317-K321 WeakPolarHBondContact O-CG 3.27Å; Y317-K321 PolarHBondContact O-N 3.09Å; Y317-K321 WeakPolarHBondContact OH-CE 3.22Å |
| 318 | S | 86.1 | Confident | 79.7 | Confident | 68 Ų | 68 | 70.1 Ų | 70.1 | 48% | 0.476 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -64.5 | -45.3 | 177.7 | -175.1 | 0 | 0 | 0 | 0 | 111.6 | F314 S315 L316 F320 K321 N322 | F314-S318 WeakPolarHBondContact O-CB 3.46Å; F314-S318 PolarHBondContact O-N 3.42Å; S315-S318 WeakPolarHBondContact O-CB 3.47Å; S315-S318 PolarHBondContact O-N 3.23Å; S315-S318 VanDerWaalsContact O-N 3.16Å; L316-S318 VanDerWaalsContact C-N 3.32Å; L316-S318 PolarHBondContact O-N 2.81Å; S318-F320 VanDerWaalsContact C-N 3.35Å; S318-K321 CarbonylContact O-C 3.52Å; S318-K321 PolarHBondContact O-N 3.3Å; S318-K321 VanDerWaalsContact O-N 3.17Å; S318-N322 WeakPolarHBondContact O-CB 3.5Å; S318-N322 PolarHBondContact O-N 3.45Å |
| 319 | E | 84.1 | Confident | 78.5 | Confident | 84 Ų | 84 | 73.7 Ų | 73.7 | 39% | 0.393 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -63.3 | -41.4 | 175.5 | -72 | -54.5 | 142.3 | 0 | 0 | 111.5 | I258 M262 S315 L316 K321 N322 S323 | I258-E319 HydrophobicContact CG2-CB 4.16Å; I258-E319 HydrophobicContact CG2-CG 3.95Å; M262-E319 HydrophobicContact SD-CB 4.05Å; S315-E319 PolarHBondContact O-N 2.95Å; L316-E319 PolarHBondContact O-N 3.22Å; E319-K321 VanDerWaalsContact C-N 3.28Å; E319-K321 PolarHBondContact O-N 3.38Å; E319-N322 PolarHBondContact O-N 3.27Å; E319-N322 VanDerWaalsContact O-N 3.11Å; E319-S323 WeakPolarHBondContact O-CB 3.2Å; E319-S323 PolarHBondContact O-N 3.39Å; E319-S323 PolarHBondContact O-OG 3.28Å; E319-S323 VanDerWaalsContact O-OG 3.07Å |
| 320 | F | 82.3 | Confident | 77 | Confident | 82 Ų | 82 | 77.7 Ų | 77.7 | 36% | 0.36 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -62.1 | -36.3 | 173.8 | -154.4 | -90.6 | 0 | 0 | 0 | 112.2 | L316 Y317 S318 S323 F326 | L316-F320 WeakPolarHBondContact O-CB 3.37Å; L316-F320 PolarHBondContact O-N 3.17Å; Y317-F320 PolarHBondContact O-N 3.29Å; S318-F320 VanDerWaalsContact C-N 3.35Å; F320-S323 PolarHBondContact O-OG 3.1Å; F320-F326 HydrophobicContact CD1-CB 3.85Å; F320-F326 HydrophobicContact CD1-CG 4.36Å; F320-F326 HydrophobicContact CD2-CB 4.25Å; F320-F326 AromaticContact CD2-CD1 4Å; F320-F326 HydrophobicContact CD2-CD1 4Å; F320-F326 HydrophobicContact CD2-CD2 4.19Å; F320-F326 HydrophobicContact CD2-CE1 4.31Å; F320-F326 HydrophobicContact CD2-CE2 4.5Å; F320-F326 AromaticContact CD2-CG 3.88Å; F320-F326 HydrophobicContact CD2-CG 3.88Å; F320-F326 HydrophobicContact CE1-CB 3.59Å; F320-F326 AromaticContact CE1-CD1 3.97Å; F320-F326 HydrophobicContact CE1-CD1 3.97Å; F320-F326 HydrophobicContact CE1-CG 4.01Å; F320-F326 HydrophobicContact CE2-CB 4.01Å; F320-F326 AromaticContact CE2-CD1 3.13Å; F320-F326 HydrophobicContact CE2-CD1 3.13Å; F320-F326 HydrophobicContact CE2-CD2 4.11Å; F320-F326 AromaticContact CE2-CE1 3.41Å; F320-F326 HydrophobicContact CE2-CE1 3.41Å; F320-F326 VanDerWaalsContact CE2-CE1 3.41Å; F320-F326 HydrophobicContact CE2-CE2 4.34Å; F320-F326 AromaticContact CE2-CG 3.48Å; F320-F326 HydrophobicContact CE2-CG 3.48Å; F320-F326 VanDerWaalsContact CE2-CG 3.48Å; F320-F326 HydrophobicContact CE2-CZ 4Å; F320-F326 HydrophobicContact CG-CB 4.2Å; F320-F326 HydrophobicContact CG-CG 4.32Å; F320-F326 HydrophobicContact CZ-CB 3.68Å; F320-F326 AromaticContact CZ-CD1 3.13Å; F320-F326 HydrophobicContact CZ-CD1 3.13Å; F320-F326 AromaticContact CZ-CE1 3.82Å; F320-F326 HydrophobicContact CZ-CE1 3.82Å; F320-F326 AromaticContact CZ-CG 3.56Å; F320-F326 HydrophobicContact CZ-CG 3.56Å |
| 321 | K | 81.1 | Confident | 75.4 | Confident | 112 Ų | 112 | 82.8 Ų | 82.8 | 49% | 0.487 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -75.4 | -24.2 | 173.9 | -77.1 | -66.7 | -173 | -175.6 | 0 | 113.8 | Y317 S318 E319 K327 | Y317-K321 HydrophobicContact CD1-CG 4.12Å; Y317-K321 HydrophobicContact CE1-CD 4.49Å; Y317-K321 HydrophobicContact CE1-CG 3.72Å; Y317-K321 HydrophobicContact CE2-CG 4.45Å; Y317-K321 WeakPolarHBondContact O-CB 3.31Å; Y317-K321 WeakPolarHBondContact O-CG 3.27Å; Y317-K321 PolarHBondContact O-N 3.09Å; Y317-K321 WeakPolarHBondContact OH-CE 3.22Å; S318-K321 CarbonylContact O-C 3.52Å; S318-K321 PolarHBondContact O-N 3.3Å; S318-K321 VanDerWaalsContact O-N 3.17Å; E319-K321 VanDerWaalsContact C-N 3.28Å; E319-K321 PolarHBondContact O-N 3.38Å; K321-K327 WeakPolarHBondContact O-CE 3.5Å; K321-K327 PolarHBondContact O-NZ 3.27Å |
| 322 | N | 80.4 | Confident | 73.6 | Confident | 112 Ų | 112 | 82.3 Ų | 82.3 | 60% | 0.599 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -86.8 | -33.5 | 179.6 | -163.7 | 24.4 | 0 | 0 | 0 | 111.8 | S318 E319 Q324 | S318-N322 WeakPolarHBondContact O-CB 3.5Å; S318-N322 PolarHBondContact O-N 3.45Å; E319-N322 PolarHBondContact O-N 3.27Å; E319-N322 VanDerWaalsContact O-N 3.11Å; N322-Q324 PolarHBondContact O-N 3.38Å |
| 323 | S | 76.7 | Confident | 71.6 | Confident | 28 Ų | 28 | 90 Ų | 90 | 20% | 0.196 | 47% | 0.466 | C | S | . | . | trans | -65.6 | 129.4 | 179.7 | 60.7 | 0 | 0 | 0 | 0 | 113.1 | E319 F320 F326 K327 | E319-S323 WeakPolarHBondContact O-CB 3.2Å; E319-S323 PolarHBondContact O-N 3.39Å; E319-S323 PolarHBondContact O-OG 3.28Å; E319-S323 VanDerWaalsContact O-OG 3.07Å; F320-S323 PolarHBondContact O-OG 3.1Å; S323-F326 WeakPolarHBondContact OG-CD2 3.18Å; S323-K327 PolarHBondContact O-N 3.48Å | ||
| 324 | Q | 62.4 | Low | 69.3 | Low | 170 Ų | 170 | 98.3 Ų | 98.3 | 79% | 0.794 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -72 | -32.1 | -177.2 | -62.9 | -178.2 | 16.5 | 0 | 0 | 112.7 | N322 F326 K327 A328 | N322-Q324 PolarHBondContact O-N 3.38Å; Q324-F326 VanDerWaalsContact C-N 3.33Å; Q324-F326 PolarHBondContact O-N 3.33Å; Q324-K327 PolarHBondContact O-N 3.21Å; Q324-A328 PolarHBondContact O-N 3.37Å; Q324-A328 VanDerWaalsContact O-N 3.15Å |
| 325 | H | 60.1 | Low | 66.9 | Low | 134 Ų | 134 | 95.4 Ų | 95.4 | 62% | 0.62 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61 | -41.1 | -179.6 | -171.5 | -98 | 0 | 0 | 0 | 112 | L329 | H325-L329 PolarHBondContact O-N 3.2Å |
| 326 | F | 61.3 | Low | 64.5 | Low | 41 Ų | 41 | 103.6 Ų | 103.6 | 18% | 0.18 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -84.9 | -26.3 | -177.1 | -67.5 | -76.8 | 0 | 0 | 0 | 113.4 | M262 F320 S323 Q324 L329 A330 | M262-F326 HydrophobicContact CE-CD2 3.97Å; M262-F326 HydrophobicContact CE-CE2 3.44Å; M262-F326 VanDerWaalsContact CE-CE2 3.44Å; M262-F326 HydrophobicContact CE-CZ 4.29Å; F320-F326 HydrophobicContact CD1-CB 3.85Å; F320-F326 HydrophobicContact CD1-CG 4.36Å; F320-F326 HydrophobicContact CD2-CB 4.25Å; F320-F326 AromaticContact CD2-CD1 4Å; F320-F326 HydrophobicContact CD2-CD1 4Å; F320-F326 HydrophobicContact CD2-CD2 4.19Å; F320-F326 HydrophobicContact CD2-CE1 4.31Å; F320-F326 HydrophobicContact CD2-CE2 4.5Å; F320-F326 AromaticContact CD2-CG 3.88Å; F320-F326 HydrophobicContact CD2-CG 3.88Å; F320-F326 HydrophobicContact CE1-CB 3.59Å; F320-F326 AromaticContact CE1-CD1 3.97Å; F320-F326 HydrophobicContact CE1-CD1 3.97Å; F320-F326 HydrophobicContact CE1-CG 4.01Å; F320-F326 HydrophobicContact CE2-CB 4.01Å; F320-F326 AromaticContact CE2-CD1 3.13Å; F320-F326 HydrophobicContact CE2-CD1 3.13Å; F320-F326 HydrophobicContact CE2-CD2 4.11Å; F320-F326 AromaticContact CE2-CE1 3.41Å; F320-F326 HydrophobicContact CE2-CE1 3.41Å; F320-F326 VanDerWaalsContact CE2-CE1 3.41Å; F320-F326 HydrophobicContact CE2-CE2 4.34Å; F320-F326 AromaticContact CE2-CG 3.48Å; F320-F326 HydrophobicContact CE2-CG 3.48Å; F320-F326 VanDerWaalsContact CE2-CG 3.48Å; F320-F326 HydrophobicContact CE2-CZ 4Å; F320-F326 HydrophobicContact CG-CB 4.2Å; F320-F326 HydrophobicContact CG-CG 4.32Å; F320-F326 HydrophobicContact CZ-CB 3.68Å; F320-F326 AromaticContact CZ-CD1 3.13Å; F320-F326 HydrophobicContact CZ-CD1 3.13Å; F320-F326 AromaticContact CZ-CE1 3.82Å; F320-F326 HydrophobicContact CZ-CE1 3.82Å; F320-F326 AromaticContact CZ-CG 3.56Å; F320-F326 HydrophobicContact CZ-CG 3.56Å; S323-F326 WeakPolarHBondContact OG-CD2 3.18Å; Q324-F326 VanDerWaalsContact C-N 3.33Å; Q324-F326 PolarHBondContact O-N 3.33Å; F326-L329 PolarHBondContact O-N 3.08Å; F326-A330 WeakPolarHBondContact O-CB 3.38Å; F326-A330 PolarHBondContact O-N 3.32Å |
| 327 | K | 60.5 | Low | 62 | Low | 99 Ų | 99 | 108.1 Ų | 108.1 | 43% | 0.43 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60.4 | -46.9 | 165 | -73.1 | -171.2 | -171.7 | 175.2 | 0 | 111.5 | K321 S323 Q324 L329 A330 E331 | K321-K327 WeakPolarHBondContact O-CE 3.5Å; K321-K327 PolarHBondContact O-NZ 3.27Å; S323-K327 PolarHBondContact O-N 3.48Å; Q324-K327 PolarHBondContact O-N 3.21Å; K327-L329 VanDerWaalsContact C-N 3.31Å; K327-L329 PolarHBondContact O-N 3.37Å; K327-A330 PolarHBondContact O-N 3.5Å; K327-E331 VanDerWaalsContact O-CB 3.26Å; K327-E331 WeakPolarHBondContact O-CB 3.39Å; K327-E331 VanDerWaalsContact O-CG 3.25Å; K327-E331 WeakPolarHBondContact O-CG 3.29Å; K327-E331 PolarHBondContact O-N 2.85Å |
| 328 | A | 58.8 | Low | 59.6 | Low | 41 Ų | 41 | 107.3 Ų | 107.3 | 34% | 0.339 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.9 | -37.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q324 K333 | Q324-A328 PolarHBondContact O-N 3.37Å; Q324-A328 VanDerWaalsContact O-N 3.15Å; A328-K333 PolarHBondContact O-N 3.18Å |
| 329 | L | 59.7 | Low | 56.8 | Low | 107 Ų | 107 | 108.6 Ų | 108.6 | 56% | 0.56 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -71.9 | -44.3 | 177.3 | -164.7 | 71 | 0 | 0 | 0 | 112.3 | H325 F326 K327 E331 G332 | H325-L329 PolarHBondContact O-N 3.2Å; F326-L329 PolarHBondContact O-N 3.08Å; K327-L329 VanDerWaalsContact C-N 3.31Å; K327-L329 PolarHBondContact O-N 3.37Å; L329-E331 VanDerWaalsContact C-N 3.32Å; L329-E331 PolarHBondContact O-N 3.43Å; L329-G332 PolarHBondContact O-N 3.32Å |
| 330 | A | 57.3 | Low | 54.8 | Low | 83 Ų | 83 | 109.9 Ų | 109.9 | 69% | 0.686 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -68.3 | -29.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113 | F326 K327 G332 | F326-A330 WeakPolarHBondContact O-CB 3.38Å; F326-A330 PolarHBondContact O-N 3.32Å; K327-A330 PolarHBondContact O-N 3.5Å; A330-G332 VanDerWaalsContact C-N 3.25Å; A330-G332 PolarHBondContact O-N 3.47Å |
| 331 | E | 55.7 | Low | 52.4 | Low | 149 Ų | 149 | 112.1 Ų | 112.1 | 70% | 0.696 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | 5.8 | 174.8 | -68.9 | 173.8 | -175.6 | 0 | 0 | 113.2 | K327 L329 K333 | K327-E331 VanDerWaalsContact O-CB 3.26Å; K327-E331 WeakPolarHBondContact O-CB 3.39Å; K327-E331 VanDerWaalsContact O-CG 3.25Å; K327-E331 WeakPolarHBondContact O-CG 3.29Å; K327-E331 PolarHBondContact O-N 2.85Å; L329-E331 VanDerWaalsContact C-N 3.32Å; L329-E331 PolarHBondContact O-N 3.43Å; E331-K333 VanDerWaalsContact C-N 3.35Å; E331-K333 PolarHBondContact O-N 3.34Å |
| 332 | G | 50.9 | Low | 50.1 | Low | 63 Ų | 63 | 112.7 Ų | 112.7 | 65% | 0.649 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 72.7 | 20.4 | 170.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | L329 A330 K334 | L329-G332 PolarHBondContact O-N 3.32Å; A330-G332 VanDerWaalsContact C-N 3.25Å; A330-G332 PolarHBondContact O-N 3.47Å; G332-K334 PolarHBondContact O-N 3.17Å |
| 333 | K | 46.1 | Very low | 47.8 | Very low | 164 Ų | 164 | 112.8 Ų | 112.8 | 71% | 0.713 | 64% | 0.64 | S | S | * | * | trans | -84.4 | 95.5 | 166.4 | -87 | 175.1 | 178.2 | 167.4 | 0 | 108.3 | A328 E331 A335 | A328-K333 PolarHBondContact O-N 3.18Å; E331-K333 VanDerWaalsContact C-N 3.35Å; E331-K333 PolarHBondContact O-N 3.34Å; K333-A335 PolarHBondContact O-N 3.16Å | ||
| 334 | K | 40.8 | Very low | 45.9 | Very low | 207 Ų | 207 | 117 Ų | 117 | 90% | 0.9 | 67% | 0.67 | S | S | * | * | trans | -44.1 | 107.4 | 167.9 | -82.5 | -173.3 | 174.9 | -176.9 | 0 | 109.3 | G332 F336 | G332-K334 PolarHBondContact O-N 3.17Å; K334-F336 PolarHBondContact O-N 3.15Å | ||
| 335 | A | 38.5 | Very low | 44.5 | Very low | 75 Ų | 75 | 118.2 Ų | 118.2 | 62% | 0.62 | 68% | 0.675 | S | S | * | * | trans | -62.1 | 131.1 | 167.6 | 0 | 0 | 0 | 0 | 0 | 107.7 | K333 T337 | K333-A335 PolarHBondContact O-N 3.16Å; A335-T337 PolarHBondContact O-N 3.31Å; A335-T337 VanDerWaalsContact O-N 3.14Å | ||
| 336 | F | 36 | Very low | 43.2 | Very low | 199 Ų | 199 | 116.9 Ų | 116.9 | 87% | 0.873 | 69% | 0.688 | S | S | * | * | trans | -56.1 | 113.9 | 177.3 | -149.4 | -96.7 | 0 | 0 | 0 | 108.6 | K334 P338 | K334-F336 PolarHBondContact O-N 3.15Å; F336-P338 WeakPolarHBondContact O-CD 3.41Å | ||
| 337 | T | 36.2 | Very low | 41.8 | Very low | 116 Ų | 116 | 118.3 Ų | 118.3 | 71% | 0.712 | 71% | 0.714 | S | S | * | * | trans | -59.7 | 122 | 165 | 48.8 | 0 | 0 | 0 | 0 | 107.8 | A335 S339 | A335-T337 PolarHBondContact O-N 3.31Å; A335-T337 VanDerWaalsContact O-N 3.14Å; T337-S339 PolarHBondContact O-N 3.5Å | ||
| 338 | P | 36.4 | Very low | 40.5 | Very low | 120 Ų | 120 | 121.4 Ų | 121.4 | 78% | 0.779 | 74% | 0.735 | S | S | * | * | trans | -68.4 | 109.2 | 162.8 | 27.6 | -27.4 | 0 | 0 | 0 | 106.5 | F336 S340 | F336-P338 WeakPolarHBondContact O-CD 3.41Å; P338-S340 PolarHBondContact O-N 3.05Å; P338-S340 VanDerWaalsContact O-N 3.08Å | ||
| 339 | S | 28.5 | Very low | 39.2 | Very low | 94 Ų | 94 | 128.6 Ų | 128.6 | 66% | 0.657 | 76% | 0.764 | S | S | * | * | trans | -57.4 | 111.6 | 173.8 | -176.8 | 0 | 0 | 0 | 0 | 109.1 | T337 N341 | T337-S339 PolarHBondContact O-N 3.5Å; S339-N341 VanDerWaalsContact C-N 3.28Å; S339-N341 PolarHBondContact O-N 3.44Å | ||
| 340 | S | 41.4 | Very low | 38.1 | Very low | 112 Ų | 112 | 132 Ų | 132 | 78% | 0.783 | 78% | 0.777 | S | S | * | * | trans | -68.3 | 89 | 161.6 | 54.5 | 0 | 0 | 0 | 0 | 108.3 | P338 | P338-S340 PolarHBondContact O-N 3.05Å; P338-S340 VanDerWaalsContact O-N 3.08Å | ||
| 341 | N | 31.2 | Very low | 37 | Very low | 129 Ų | 129 | 133.8 Ų | 133.8 | 69% | 0.69 | 78% | 0.779 | S | S | * | * | trans | -140.3 | 80.1 | 166 | -99.7 | -7.7 | 0 | 0 | 0 | 109.2 | S339 T343 | S339-N341 VanDerWaalsContact C-N 3.28Å; S339-N341 PolarHBondContact O-N 3.44Å; N341-T343 VanDerWaalsContact C-N 3.29Å; N341-T343 PolarHBondContact O-N 3.45Å | ||
| 342 | S | 32.3 | Very low | 36.1 | Very low | 123 Ų | 123 | 135.2 Ų | 135.2 | 86% | 0.86 | 79% | 0.791 | S | S | * | * | trans | -86 | 80.5 | 154 | 57.3 | 0 | 0 | 0 | 0 | 107.6 | S344 | S342-S344 PolarHBondContact O-N 3.09Š| ||
| 343 | T | 32.5 | Very low | 35.3 | Very low | 115 Ų | 115 | 137.9 Ų | 137.9 | 71% | 0.706 | 80% | 0.795 | S | S | * | * | trans | -70.8 | 118.6 | 167.1 | -54.5 | 0 | 0 | 0 | 0 | 108.3 | N341 Q345 | N341-T343 VanDerWaalsContact C-N 3.29Å; N341-T343 PolarHBondContact O-N 3.45Å; T343-Q345 PolarHBondContact O-N 3.47Å | ||
| 344 | S | 36.3 | Very low | 34.5 | Very low | 117 Ų | 117 | 139.9 Ų | 139.9 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -44.1 | 114.2 | 170.4 | -43.8 | 0 | 0 | 0 | 0 | 111.7 | S342 | S342-S344 PolarHBondContact O-N 3.09Š| ||
| 345 | Q | 33.7 | Very low | 34.7 | Very low | 195 Ų | 195 | 138.5 Ų | 138.5 | 91% | 0.911 | 82% | 0.821 | S | S | * | * | trans | -96.4 | 98.6 | 165.4 | -138.4 | 175.8 | 24.8 | 0 | 0 | 107.6 | T343 | T343-Q345 PolarHBondContact O-N 3.47Š| ||
| 346 | A | 33 | Very low | 34.5 | Very low | 106 Ų | 106 | 141.7 Ų | 141.7 | 88% | 0.876 | 83% | 0.831 | S | S | * | * | trans | -66.7 | 121.6 | 162.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 347 | G | 32.6 | Very low | 34.4 | Very low | 71 Ų | 71 | 138.7 Ų | 138.7 | 73% | 0.732 | 83% | 0.828 | S | S | * | * | trans | -130.8 | 126.6 | 169.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 348 | D | 32.3 | Very low | 34.3 | Very low | 164 Ų | 164 | 139.9 Ų | 139.9 | 88% | 0.877 | 84% | 0.835 | S | S | * | * | trans | -46 | 135.7 | -167.9 | -71 | -61.2 | 0 | 0 | 0 | 116.5 | ||||
| 349 | M | 32.7 | Very low | 34.2 | Very low | 191 Ų | 191 | 141.1 Ų | 141.1 | 94% | 0.941 | 84% | 0.838 | S | S | * | * | trans | -103.6 | 99.4 | 162.8 | -169.7 | 148.2 | 92.6 | 0 | 0 | 108.1 | T351 | M349-T351 PolarHBondContact O-N 3.24Š| ||
| 350 | E | 36.5 | Very low | 34.6 | Very low | 178 Ų | 178 | 144.1 Ų | 144.1 | 83% | 0.832 | 85% | 0.85 | S | S | * | * | trans | -75.4 | 120.1 | 169.7 | -71.2 | -168.2 | 124.6 | 0 | 0 | 110.6 | ||||
| 351 | T | 32.8 | Very low | 34.1 | Very low | 121 Ų | 121 | 146.2 Ų | 146.2 | 74% | 0.742 | 85% | 0.854 | S | S | * | * | trans | -13 | 119.8 | 152.8 | 3.2 | 0 | 0 | 0 | 0 | 116.9 | M349 | M349-T351 PolarHBondContact O-N 3.24Š| ||
| 352 | L | 37.3 | Very low | 34.3 | Very low | 179 Ų | 179 | 147.4 Ų | 147.4 | 94% | 0.937 | 87% | 0.866 | S | S | * | * | trans | -136.7 | 119.2 | 139.6 | -82.6 | 179 | 0 | 0 | 0 | 111 | ||||
| 353 | T | 33.3 | Very low | 34.5 | Very low | 120 Ų | 120 | 149.3 Ų | 149.3 | 74% | 0.736 | 87% | 0.866 | S | S | * | * | trans | -68.4 | 145.3 | -179 | 38.9 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 354 | F | 31.1 | Very low | 34.6 | Very low | 205 Ų | 205 | 152.2 Ų | 152.2 | 90% | 0.899 | 88% | 0.879 | S | S | * | * | trans | -75.7 | 131.6 | 163.9 | -143.8 | -90.8 | 0 | 0 | 0 | 109.6 | ||||
| 355 | S | 44.2 | Very low | 34.5 | Very low | 179 Ų | 179 | 155.4 Ų | 155.4 | 100% | 1.252 | 89% | 0.885 | S | S | * | * | trans | -125.3 | 0 | 152.4 | -70.2 | 0 | 0 | 0 | 0 | 107.9 |
Retrieved 355 of 355 residues in 73.8 ms
(Link to these results)