| 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 | 31 | Very low | 30 | Very low | 238 Ų | 238 | 156.2 Ų | 156.2 | 100% | 1.172 | 86% | 0.862 | S | S | * | * | 0 | 140.2 | 0 | -78.5 | -165 | 171.9 | 0 | 0 | 108.3 | |||||
| 2 | P | 45.5 | Very low | 29.7 | Very low | 129 Ų | 129 | 158.4 Ų | 158.4 | 84% | 0.838 | 86% | 0.861 | S | S | * | * | -100.8 | 151.8 | -121.5 | 34.6 | -33.3 | 0 | 0 | 0 | 114.6 | |||||
| 3 | F | 26.6 | Very low | 29.6 | Very low | 205 Ų | 205 | 157.5 Ų | 157.5 | 90% | 0.899 | 86% | 0.855 | S | S | * | * | trans | -115.4 | 141.1 | 171.9 | -98.5 | -89.6 | 0 | 0 | 0 | 109.3 | ||||
| 4 | N | 35.8 | Very low | 29.4 | Very low | 173 Ų | 173 | 160.2 Ų | 160.2 | 93% | 0.925 | 86% | 0.859 | S | S | * | * | trans | -71.4 | 147.3 | 165.5 | -102.3 | -9.2 | 0 | 0 | 0 | 111.1 | ||||
| 5 | G | 28.9 | Very low | 29.6 | Very low | 66 Ų | 66 | 157.6 Ų | 157.6 | 68% | 0.68 | 85% | 0.854 | S | S | * | * | trans | 155.3 | 139.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 6 | E | 28 | Very low | 29.4 | Very low | 197 Ų | 197 | 153.8 Ų | 153.8 | 92% | 0.921 | 84% | 0.843 | S | S | * | * | cis | -168 | 158.9 | 4.7 | -115.9 | 174.7 | 160.1 | 0 | 0 | 106.7 | ||||
| 7 | K | 29.4 | Very low | 29.2 | Very low | 190 Ų | 190 | 152.7 Ų | 152.7 | 83% | 0.826 | 84% | 0.836 | S | S | * | * | trans | -57.2 | 152.3 | 171.2 | -75.7 | 166.9 | 164.4 | 174.6 | 0 | 112.3 | ||||
| 8 | Q | 26.5 | Very low | 29.2 | Very low | 199 Ų | 199 | 149.4 Ų | 149.4 | 93% | 0.93 | 83% | 0.826 | S | S | * | * | -155 | 124 | 119.9 | -121.2 | 156.8 | -2.6 | 0 | 0 | 113.1 | |||||
| 9 | C | 26.6 | Very low | 29 | Very low | 113 Ų | 113 | 149.8 Ų | 149.8 | 76% | 0.764 | 83% | 0.827 | S | S | * | * | trans | -71.8 | 158.6 | 165.8 | -69.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 10 | V | 27.1 | Very low | 29.3 | Very low | 146 Ų | 146 | 147.9 Ų | 147.9 | 89% | 0.885 | 82% | 0.824 | S | S | * | * | trans | 167.4 | 122.8 | 130.1 | 170.1 | 0 | 0 | 0 | 0 | 103.2 | ||||
| 11 | G | 24.8 | Very low | 29.2 | Very low | 62 Ų | 62 | 145.6 Ų | 145.6 | 64% | 0.639 | 82% | 0.818 | S | S | * | * | cis | 121.6 | 118 | 33.9 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 12 | E | 26.8 | Very low | 29 | Very low | 183 Ų | 183 | 145.1 Ų | 145.1 | 86% | 0.855 | 80% | 0.803 | S | S | * | * | trans | 148.5 | 113.2 | 144.5 | -79.4 | -179.8 | 167.5 | 0 | 0 | 113 | ||||
| 13 | D | 27.7 | Very low | 28.1 | Very low | 147 Ų | 147 | 149.1 Ų | 149.1 | 79% | 0.786 | 81% | 0.808 | S | S | * | * | trans | 66.1 | 95.5 | 140.5 | -59 | -12.5 | 0 | 0 | 0 | 121.8 | ||||
| 14 | Q | 27.6 | Very low | 28.2 | Very low | 195 Ų | 195 | 145 Ų | 145 | 91% | 0.911 | 80% | 0.804 | S | S | * | * | trans | -128.3 | 122 | 139.4 | -91 | -174.5 | -17.8 | 0 | 0 | 109.4 | ||||
| 15 | P | 31.4 | Very low | 27.8 | Very low | 121 Ų | 121 | 145.8 Ų | 145.8 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | trans | -89 | 141.4 | 162.5 | 33.4 | -27.3 | 0 | 0 | 0 | 111.1 | ||||
| 16 | S | 26.1 | Very low | 27.7 | Very low | 96 Ų | 96 | 148.8 Ų | 148.8 | 67% | 0.671 | 81% | 0.813 | S | S | * | * | trans | -29.6 | 128 | 147.9 | -174.9 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 17 | D | 26.6 | Very low | 27.7 | Very low | 136 Ų | 136 | 148.4 Ų | 148.4 | 73% | 0.727 | 81% | 0.814 | S | S | * | * | 176.8 | 152.6 | 93.4 | -109.5 | -55.7 | 0 | 0 | 0 | 113 | |||||
| 18 | S | 29 | Very low | 27.6 | Very low | 93 Ų | 93 | 144.2 Ų | 144.2 | 65% | 0.65 | 82% | 0.815 | S | S | * | * | trans | -13.8 | 128.5 | 154.5 | -48.4 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 19 | D | 25.7 | Very low | 27.6 | Very low | 158 Ų | 158 | 140.1 Ų | 140.1 | 85% | 0.845 | 81% | 0.808 | S | S | * | * | -168.9 | 136.4 | 121 | -104 | -25.8 | 0 | 0 | 0 | 114.9 | |||||
| 20 | S | 34.4 | Very low | 27.6 | Very low | 111 Ų | 111 | 143.2 Ų | 143.2 | 78% | 0.776 | 82% | 0.816 | S | S | * | * | trans | -62.5 | 128.2 | 166.4 | 176.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 21 | S | 26.9 | Very low | 27.6 | Very low | 100 Ų | 100 | 140.5 Ų | 140.5 | 70% | 0.699 | 80% | 0.803 | S | S | * | * | trans | -145.7 | 104.2 | 162.1 | 55.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 22 | R | 27.1 | Very low | 27.6 | Very low | 227 Ų | 227 | 144 Ų | 144 | 86% | 0.857 | 81% | 0.808 | S | S | * | * | 67.1 | 85.3 | 93.9 | -72.2 | -177.5 | -175.4 | 177.3 | 3.2 | 112.4 | |||||
| 23 | F | 27.4 | Very low | 27.6 | Very low | 214 Ų | 214 | 140.6 Ų | 140.6 | 94% | 0.939 | 80% | 0.803 | S | S | * | * | trans | -82.7 | 111.9 | 151.5 | -87.5 | -80.8 | 0 | 0 | 0 | 108 | E25 | F23-E25 PolarHBondContact O-N 2.87Š| ||
| 24 | S | 27.5 | Very low | 27.5 | Very low | 117 Ų | 117 | 142.3 Ų | 142.3 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | -74.4 | 110.2 | 173.3 | -78.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 25 | E | 28.1 | Very low | 27.4 | Very low | 190 Ų | 190 | 138.5 Ų | 138.5 | 89% | 0.888 | 80% | 0.8 | S | S | * | * | trans | -77.9 | 131.3 | 156.9 | -70.8 | 175.6 | 159.9 | 0 | 0 | 108.6 | F23 | F23-E25 PolarHBondContact O-N 2.87Š| ||
| 26 | S | 26.4 | Very low | 27.2 | Very low | 130 Ų | 130 | 138.7 Ų | 138.7 | 91% | 0.909 | 80% | 0.804 | S | S | * | * | trans | -117.9 | 92.8 | 166.8 | -122.2 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 27 | M | 28.7 | Very low | 27.7 | Very low | 188 Ų | 188 | 144.9 Ų | 144.9 | 93% | 0.926 | 81% | 0.813 | S | S | * | * | trans | -93.5 | 121.3 | 159.6 | -108.4 | -165.8 | 171.6 | 0 | 0 | 107.3 | ||||
| 28 | A | 28.2 | Very low | 27.8 | Very low | 103 Ų | 103 | 147.9 Ų | 147.9 | 85% | 0.851 | 82% | 0.822 | S | S | * | * | trans | -96.7 | 101.9 | 165.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 29 | S | 26.3 | Very low | 27.8 | Very low | 112 Ų | 112 | 148.4 Ų | 148.4 | 78% | 0.783 | 83% | 0.826 | S | S | * | * | trans | 14 | 130.8 | 142 | -43 | 0 | 0 | 0 | 0 | 120 | ||||
| 30 | L | 24.9 | Very low | 28.1 | Very low | 178 Ų | 178 | 150.7 Ų | 150.7 | 93% | 0.932 | 83% | 0.829 | S | S | * | * | -134.2 | 129.4 | 122.9 | -98.2 | 163.4 | 0 | 0 | 0 | 108.6 | |||||
| 31 | S | 28.4 | Very low | 27.9 | Very low | 89 Ų | 89 | 152.2 Ų | 152.2 | 62% | 0.622 | 83% | 0.833 | S | S | * | * | trans | -81.3 | 154.8 | -171.7 | 56.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 32 | D | 25.4 | Very low | 28.3 | Very low | 136 Ų | 136 | 152.8 Ų | 152.8 | 73% | 0.727 | 84% | 0.838 | S | S | * | * | 170.8 | 109.4 | 117.8 | -80 | -8.3 | 0 | 0 | 0 | 107.4 | |||||
| 33 | C | 25.8 | Very low | 28.3 | Very low | 111 Ų | 111 | 150 Ų | 150 | 75% | 0.75 | 84% | 0.839 | S | S | * | * | 73.6 | 129.1 | 103.8 | -69.8 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 34 | E | 25.9 | Very low | 28.5 | Very low | 184 Ų | 184 | 145.5 Ų | 145.5 | 86% | 0.86 | 84% | 0.835 | S | S | * | * | cis | -160.8 | 137.8 | 6.8 | -105.2 | 175.5 | 152.9 | 0 | 0 | 106.8 | ||||
| 35 | C | 24.9 | Very low | 28.8 | Very low | 115 Ų | 115 | 145.7 Ų | 145.7 | 78% | 0.777 | 84% | 0.836 | S | S | * | * | trans | -85.9 | 118.2 | 169.3 | 177.7 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 36 | S | 26.7 | Very low | 29.3 | Very low | 125 Ų | 125 | 141.9 Ų | 141.9 | 87% | 0.874 | 83% | 0.83 | S | S | * | * | trans | -103.4 | 103.8 | 162.5 | -107.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 37 | R | 36.8 | Very low | 29.6 | Very low | 226 Ų | 226 | 145.1 Ų | 145.1 | 85% | 0.853 | 83% | 0.828 | S | S | * | * | trans | -70.8 | 131.3 | 158.1 | -71.2 | 175.9 | 170.9 | 169.7 | -2.9 | 108.2 | ||||
| 38 | Q | 29.7 | Very low | 29.6 | Very low | 198 Ų | 198 | 141.1 Ų | 141.1 | 93% | 0.925 | 82% | 0.819 | S | S | * | * | trans | -164.2 | 146.6 | 137.4 | -108.7 | 162.9 | 31.5 | 0 | 0 | 113.4 | ||||
| 39 | S | 28.7 | Very low | 29.7 | Very low | 105 Ų | 105 | 142.1 Ų | 142.1 | 73% | 0.734 | 82% | 0.82 | S | S | * | * | trans | -87.3 | 163.5 | -166 | 44.7 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 40 | F | 32.8 | Very low | 30 | Very low | 205 Ų | 205 | 141.9 Ų | 141.9 | 90% | 0.899 | 82% | 0.818 | S | S | * | * | trans | -35.7 | 130.6 | 166.1 | -57.9 | -88.1 | 0 | 0 | 0 | 116.2 | ||||
| 41 | T | 29.3 | Very low | 30.6 | Very low | 143 Ų | 143 | 139.5 Ų | 139.5 | 88% | 0.877 | 81% | 0.813 | S | S | * | * | -166.2 | 137.6 | 129 | 43.3 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 42 | S | 34.7 | Very low | 30.8 | Very low | 113 Ų | 113 | 139.6 Ų | 139.6 | 79% | 0.79 | 82% | 0.819 | S | S | * | * | trans | -64.2 | 144.7 | 176 | -44.5 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 43 | D | 27.1 | Very low | 31 | Very low | 167 Ų | 167 | 138.2 Ų | 138.2 | 89% | 0.893 | 82% | 0.82 | S | S | * | * | -165.3 | 146.5 | 126.2 | -106.6 | -23.8 | 0 | 0 | 0 | 113.4 | |||||
| 44 | S | 32.1 | Very low | 31.3 | Very low | 120 Ų | 120 | 139.2 Ų | 139.2 | 84% | 0.839 | 82% | 0.823 | S | S | * | * | trans | -71.9 | 136.5 | -170.9 | -62.1 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 45 | S | 34.5 | Very low | 31.5 | Very low | 122 Ų | 122 | 135.3 Ų | 135.3 | 85% | 0.853 | 82% | 0.816 | S | S | * | * | trans | -144.9 | 119.3 | 145.8 | 80.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 46 | S | 37.7 | Very low | 32.1 | Very low | 109 Ų | 109 | 135 Ų | 135 | 76% | 0.762 | 81% | 0.813 | S | S | * | * | trans | -65.3 | 133.8 | 176.2 | 50.2 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 47 | K | 32.7 | Very low | 32.6 | Very low | 199 Ų | 199 | 134.7 Ų | 134.7 | 87% | 0.865 | 81% | 0.808 | S | S | * | * | trans | -160.2 | 110.5 | 146 | -107.5 | 158.6 | -171.2 | -178.1 | 0 | 112.9 | ||||
| 48 | S | 29 | Very low | 33 | Very low | 103 Ų | 103 | 132.5 Ų | 132.5 | 72% | 0.72 | 80% | 0.799 | S | S | * | * | trans | 43 | 102.1 | 149.9 | 60.8 | 0 | 0 | 0 | 0 | 119.4 | S50 | S48-S50 PolarHBondContact O-N 3.28Š| ||
| 49 | S | 30.6 | Very low | 34.1 | Very low | 125 Ų | 125 | 129 Ų | 129 | 87% | 0.874 | 79% | 0.792 | S | S | * | * | trans | -39.7 | 120.9 | 150.1 | 40.4 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 50 | S | 32.5 | Very low | 35.3 | Very low | 107 Ų | 107 | 128.3 Ų | 128.3 | 75% | 0.748 | 78% | 0.782 | S | S | * | * | trans | -110.1 | 144.5 | 152.8 | -65 | 0 | 0 | 0 | 0 | 108.7 | S48 | S48-S50 PolarHBondContact O-N 3.28Š| ||
| 51 | P | 37.8 | Very low | 37.1 | Very low | 127 Ų | 127 | 121.6 Ų | 121.6 | 83% | 0.825 | 76% | 0.759 | S | S | * | * | trans | -77.2 | 140.8 | -173.1 | 7.7 | 8.3 | 0 | 0 | 0 | 111.1 | S53 | P51-S53 PolarHBondContact O-N 2.99Š| ||
| 52 | A | 31.8 | Very low | 38.9 | Very low | 92 Ų | 92 | 122.1 Ų | 122.1 | 76% | 0.76 | 75% | 0.749 | S | S | * | * | trans | 7.3 | 94.9 | 162.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | T54 | A52-T54 VanDerWaalsContact C-N 3.32Å; A52-T54 PolarHBondContact O-N 3.19Å; A52-T54 VanDerWaalsContact O-N 3.11Å | ||
| 53 | S | 30.1 | Very low | 40.5 | Very low | 107 Ų | 107 | 122.7 Ų | 122.7 | 75% | 0.748 | 74% | 0.743 | S | S | * | * | trans | -72.4 | 95 | 152.4 | 53.3 | 0 | 0 | 0 | 0 | 107.5 | P51 S55 | P51-S53 PolarHBondContact O-N 2.99Å; S53-S55 VanDerWaalsContact C-N 3.35Å; S53-S55 PolarHBondContact O-N 3.18Å | ||
| 54 | T | 32.4 | Very low | 42.5 | Very low | 132 Ų | 132 | 117.5 Ų | 117.5 | 81% | 0.81 | 71% | 0.713 | S | S | * | * | trans | -55 | 103.1 | 159.5 | 38 | 0 | 0 | 0 | 0 | 107.4 | A52 | A52-T54 VanDerWaalsContact C-N 3.32Å; A52-T54 PolarHBondContact O-N 3.19Å; A52-T54 VanDerWaalsContact O-N 3.11Å | ||
| 55 | S | 30.2 | Very low | 44.2 | Very low | 101 Ų | 101 | 115 Ų | 115 | 71% | 0.706 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 135.1 | 172 | -60.4 | 0 | 0 | 0 | 0 | 107.3 | S53 | S53-S55 VanDerWaalsContact C-N 3.35Å; S53-S55 PolarHBondContact O-N 3.18Å |
| 56 | P | 35.9 | Very low | 45.9 | Very low | 109 Ų | 109 | 112.7 Ų | 112.7 | 71% | 0.708 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 153.3 | 173.8 | -14.4 | 27 | 0 | 0 | 0 | 109.4 | R58 | P56-R58 PolarHBondContact O-N 3.4Š|
| 57 | P | 39.2 | Very low | 47.6 | Very low | 119 Ų | 119 | 109.3 Ų | 109.3 | 77% | 0.773 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 120.8 | 172.7 | 23.2 | -31.1 | 0 | 0 | 0 | 108.4 | V59 | P57-V59 PolarHBondContact O-N 3.37Š|
| 58 | R | 44 | Very low | 49.3 | Very low | 179 Ų | 179 | 101.2 Ų | 101.2 | 68% | 0.675 | 62% | 0.618 | S | S | * | * | trans | -57.5 | 112.3 | 176.8 | -176.5 | 177 | 176.4 | 166.6 | -2.9 | 106.7 | P56 V60 E64 | P56-R58 PolarHBondContact O-N 3.4Å; R58-V60 PolarHBondContact O-N 3.37Å; R58-E64 IonicContact CZ-OE1 3.51Å; R58-E64 IonicContact NE-OE1 2.71Å; R58-E64 IonicContact NH2-OE1 2.84Å; R58-E64 PolarHBondContact NH2-OE1 3.36Å | ||
| 59 | V | 52.6 | Low | 51.4 | Low | 126 Ų | 126 | 100 Ų | 100 | 76% | 0.764 | 61% | 0.607 | S | S | * | * | trans | -66.9 | 104.1 | 172.4 | 178 | 0 | 0 | 0 | 0 | 105.7 | P57 T61 | P57-V59 PolarHBondContact O-N 3.37Å; V59-T61 PolarHBondContact O-N 2.89Å | ||
| 60 | V | 54.2 | Low | 53.6 | Low | 89 Ų | 89 | 101.6 Ų | 101.6 | 54% | 0.539 | 59% | 0.594 | S | S | . | * | trans | -62.1 | 118.8 | 174.3 | -172.3 | 0 | 0 | 0 | 0 | 107 | R58 E64 V65 | R58-V60 PolarHBondContact O-N 3.37Å; V60-E64 HydrophobicContact CG1-CB 4.12Å; V60-V65 HydrophobicContact CG1-CG2 3.58Å | ||
| 61 | T | 70.9 | Confident | 55.8 | Low | 65 Ų | 65 | 98.5 Ų | 98.5 | 40% | 0.399 | 57% | 0.569 | S | S | . | * | trans | -76.5 | 152 | -179.6 | 59.3 | 0 | 0 | 0 | 0 | 110.3 | V59 D63 E64 V65 | V59-T61 PolarHBondContact O-N 2.89Å; T61-D63 PolarHBondContact O-N 3.4Å; T61-E64 PolarHBondContact N-OE2 3.22Å; T61-E64 WeakPolarHBondContact O-CB 3.36Å; T61-E64 PolarHBondContact O-N 3.14Å; T61-E64 VanDerWaalsContact O-N 3.08Å; T61-E64 WeakPolarHBondContact OG1-CB 3.31Å; T61-E64 VanDerWaalsContact OG1-CD 3.23Å; T61-E64 WeakPolarHBondContact OG1-CG 3.38Å; T61-E64 PolarHBondContact OG1-N 3.44Å; T61-E64 PolarHBondContact OG1-OE2 3.25Å; T61-V65 PolarHBondContact O-N 2.92Å | ||
| 62 | F | 67.7 | Low | 57.8 | Low | 153 Ų | 153 | 97 Ų | 97 | 67% | 0.671 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -56.4 | -35 | 177.7 | 179.5 | -98.9 | 0 | 0 | 0 | 112.2 | V65 M66 | F62-V65 PolarHBondContact O-N 3.44Å; F62-M66 HydrophobicContact CD1-CG 4.07Å; F62-M66 HydrophobicContact CE1-CG 3.65Å; F62-M66 HydrophobicContact CE1-SD 4.38Å; F62-M66 HydrophobicContact CE2-CG 4.33Å; F62-M66 HydrophobicContact CZ-CG 3.79Å; F62-M66 HydrophobicContact CZ-SD 3.98Å; F62-M66 WeakPolarHBondContact O-CG 3.4Å; F62-M66 PolarHBondContact O-N 3.37Å |
| 63 | D | 68.6 | Low | 60.1 | Low | 126 Ų | 126 | 95.4 Ų | 95.4 | 67% | 0.674 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -67.9 | -39 | 177.4 | -65.5 | -26.6 | 0 | 0 | 0 | 112.2 | T61 M66 A67 | T61-D63 PolarHBondContact O-N 3.4Å; D63-M66 PolarHBondContact O-N 3.39Å; D63-A67 WeakPolarHBondContact O-CB 3.37Å; D63-A67 PolarHBondContact O-N 3.3Å |
| 64 | E | 68.9 | Low | 62.7 | Low | 57 Ų | 57 | 94.1 Ų | 94.1 | 27% | 0.266 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.5 | -42 | 172.4 | -74.2 | 166.7 | 152.1 | 0 | 0 | 111.1 | R58 V60 T61 M66 A67 A68 | R58-E64 IonicContact CZ-OE1 3.51Å; R58-E64 IonicContact NE-OE1 2.71Å; R58-E64 IonicContact NH2-OE1 2.84Å; R58-E64 PolarHBondContact NH2-OE1 3.36Å; V60-E64 HydrophobicContact CG1-CB 4.12Å; T61-E64 PolarHBondContact N-OE2 3.22Å; T61-E64 WeakPolarHBondContact O-CB 3.36Å; T61-E64 PolarHBondContact O-N 3.14Å; T61-E64 VanDerWaalsContact O-N 3.08Å; T61-E64 WeakPolarHBondContact OG1-CB 3.31Å; T61-E64 VanDerWaalsContact OG1-CD 3.23Å; T61-E64 WeakPolarHBondContact OG1-CG 3.38Å; T61-E64 PolarHBondContact OG1-N 3.44Å; T61-E64 PolarHBondContact OG1-OE2 3.25Å; E64-M66 PolarHBondContact O-N 3.07Å; E64-A67 PolarHBondContact O-N 2.93Å; E64-A68 WeakPolarHBondContact O-CB 3.43Å; E64-A68 PolarHBondContact O-N 3.07Å |
| 65 | V | 66.5 | Low | 65.3 | Low | 69 Ų | 69 | 88 Ų | 88 | 42% | 0.418 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.7 | -43.3 | 175.6 | 179.4 | 0 | 0 | 0 | 0 | 111.5 | V60 T61 F62 A68 T69 | V60-V65 HydrophobicContact CG1-CG2 3.58Å; T61-V65 PolarHBondContact O-N 2.92Å; F62-V65 PolarHBondContact O-N 3.44Å; V65-A68 PolarHBondContact O-N 2.9Å; V65-T69 WeakPolarHBondContact O-CB 3.41Å; V65-T69 PolarHBondContact O-N 3Å; V65-T69 PolarHBondContact O-OG1 3.08Å |
| 66 | M | 71.4 | Confident | 68 | Low | 72 Ų | 72 | 85.5 Ų | 85.5 | 36% | 0.355 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -66.9 | -37.6 | 178.3 | -73.9 | -62.7 | -63.6 | 0 | 0 | 112.2 | F62 D63 E64 R70 | F62-M66 HydrophobicContact CD1-CG 4.07Å; F62-M66 HydrophobicContact CE1-CG 3.65Å; F62-M66 HydrophobicContact CE1-SD 4.38Å; F62-M66 HydrophobicContact CE2-CG 4.33Å; F62-M66 HydrophobicContact CZ-CG 3.79Å; F62-M66 HydrophobicContact CZ-SD 3.98Å; F62-M66 WeakPolarHBondContact O-CG 3.4Å; F62-M66 PolarHBondContact O-N 3.37Å; D63-M66 PolarHBondContact O-N 3.39Å; E64-M66 PolarHBondContact O-N 3.07Å; M66-R70 WeakPolarHBondContact O-CG 3.32Å; M66-R70 PolarHBondContact O-N 3.44Å; M66-R70 VanDerWaalsContact O-N 3.08Å |
| 67 | A | 73.3 | Confident | 70.4 | Confident | 39 Ų | 39 | 84.1 Ų | 84.1 | 32% | 0.322 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -65.6 | -47.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | D63 E64 T69 R70 N71 | D63-A67 WeakPolarHBondContact O-CB 3.37Å; D63-A67 PolarHBondContact O-N 3.3Å; E64-A67 PolarHBondContact O-N 2.93Å; A67-T69 VanDerWaalsContact C-N 3.31Å; A67-T69 PolarHBondContact O-N 3.48Å; A67-R70 WeakPolarHBondContact O-CB 3.42Å; A67-R70 PolarHBondContact O-N 2.94Å; A67-N71 PolarHBondContact O-N 2.96Å |
| 68 | A | 67.6 | Low | 72.7 | Confident | 28 Ų | 28 | 79 Ų | 79 | 23% | 0.231 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -59.5 | -41.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | E64 V65 R70 N71 L72 | E64-A68 WeakPolarHBondContact O-CB 3.43Å; E64-A68 PolarHBondContact O-N 3.07Å; V65-A68 PolarHBondContact O-N 2.9Å; A68-R70 VanDerWaalsContact C-N 3.35Å; A68-R70 PolarHBondContact O-N 2.98Å; A68-N71 PolarHBondContact O-N 2.93Å; A68-L72 WeakPolarHBondContact O-CB 3.42Å; A68-L72 PolarHBondContact O-N 3.5Å |
| 69 | T | 73.3 | Confident | 74.9 | Confident | 79 Ų | 79 | 70.6 Ų | 70.6 | 49% | 0.485 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -62.2 | -41.7 | 176.7 | -54.7 | 0 | 0 | 0 | 0 | 111.6 | V65 A67 L72 S73 | V65-T69 WeakPolarHBondContact O-CB 3.41Å; V65-T69 PolarHBondContact O-N 3Å; V65-T69 PolarHBondContact O-OG1 3.08Å; A67-T69 VanDerWaalsContact C-N 3.31Å; A67-T69 PolarHBondContact O-N 3.48Å; T69-L72 PolarHBondContact O-N 3.45Å; T69-S73 WeakPolarHBondContact O-CB 3.46Å; T69-S73 PolarHBondContact O-N 3.33Å; T69-S73 PolarHBondContact O-OG 2.92Å |
| 70 | R | 77.8 | Confident | 76.6 | Confident | 158 Ų | 158 | 66.6 Ų | 66.6 | 60% | 0.596 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -64.2 | -44.1 | 175.1 | -73.5 | 173 | -177.3 | 170.5 | 2.9 | 111.5 | M66 A67 A68 L72 S73 N74 | M66-R70 WeakPolarHBondContact O-CG 3.32Å; M66-R70 PolarHBondContact O-N 3.44Å; M66-R70 VanDerWaalsContact O-N 3.08Å; A67-R70 WeakPolarHBondContact O-CB 3.42Å; A67-R70 PolarHBondContact O-N 2.94Å; A68-R70 VanDerWaalsContact C-N 3.35Å; A68-R70 PolarHBondContact O-N 2.98Å; R70-L72 VanDerWaalsContact C-N 3.34Å; R70-L72 PolarHBondContact O-N 3.32Å; R70-S73 WeakPolarHBondContact CA-OG 3.2Å; R70-S73 PolarHBondContact O-N 3.21Å; R70-S73 PolarHBondContact O-OG 3.31Å; R70-N74 WeakPolarHBondContact O-CB 3.27Å; R70-N74 VanDerWaalsContact O-CG 3.28Å; R70-N74 PolarHBondContact O-N 3.32Å; R70-N74 PolarHBondContact O-ND2 3.14Å |
| 71 | N | 76.7 | Confident | 78.2 | Confident | 41 Ų | 41 | 63.7 Ų | 63.7 | 22% | 0.219 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.7 | -43.8 | 177.6 | -71.4 | -22.3 | 0 | 0 | 0 | 111.7 | A67 A68 N74 L75 | A67-N71 PolarHBondContact O-N 2.96Å; A68-N71 PolarHBondContact O-N 2.93Å; N71-N74 PolarHBondContact O-N 3.09Å; N71-L75 WeakPolarHBondContact O-CB 3.36Å; N71-L75 PolarHBondContact O-N 3.09Å |
| 72 | L | 79.7 | Confident | 78.9 | Confident | 96 Ų | 96 | 60.7 Ų | 60.7 | 50% | 0.503 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -64.3 | -39.7 | 175.9 | -165 | 113.6 | 0 | 0 | 0 | 112.1 | A68 T69 R70 L75 T76 | A68-L72 WeakPolarHBondContact O-CB 3.42Å; A68-L72 PolarHBondContact O-N 3.5Å; T69-L72 PolarHBondContact O-N 3.45Å; R70-L72 VanDerWaalsContact C-N 3.34Å; R70-L72 PolarHBondContact O-N 3.32Å; L72-L75 PolarHBondContact O-N 2.75Å; L72-T76 WeakPolarHBondContact O-CB 3.31Å; L72-T76 PolarHBondContact O-N 3.45Å; L72-T76 PolarHBondContact O-OG1 3.33Å |
| 73 | S | 81.9 | Confident | 79.8 | Confident | 59 Ų | 59 | 55.6 Ų | 55.6 | 41% | 0.413 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66.1 | -40.7 | 176.4 | 71.7 | 0 | 0 | 0 | 0 | 112.5 | T69 R70 T76 L77 | T69-S73 WeakPolarHBondContact O-CB 3.46Å; T69-S73 PolarHBondContact O-N 3.33Å; T69-S73 PolarHBondContact O-OG 2.92Å; R70-S73 WeakPolarHBondContact CA-OG 3.2Å; R70-S73 PolarHBondContact O-N 3.21Å; R70-S73 PolarHBondContact O-OG 3.31Å; S73-T76 PolarHBondContact O-N 3.12Å; S73-L77 VanDerWaalsContact O-CB 3.27Å; S73-L77 WeakPolarHBondContact O-CB 3.43Å; S73-L77 PolarHBondContact O-N 2.89Å |
| 74 | N | 84.9 | Confident | 80.6 | Confident | 80 Ų | 80 | 52.2 Ų | 52.2 | 43% | 0.428 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -67.5 | -40.7 | 176.9 | -71.5 | -20.3 | 0 | 0 | 0 | 111.4 | R70 N71 L77 A78 | R70-N74 WeakPolarHBondContact O-CB 3.27Å; R70-N74 VanDerWaalsContact O-CG 3.28Å; R70-N74 PolarHBondContact O-N 3.32Å; R70-N74 PolarHBondContact O-ND2 3.14Å; N71-N74 PolarHBondContact O-N 3.09Å; N74-L77 PolarHBondContact O-N 3.44Å; N74-A78 WeakPolarHBondContact O-CB 3.38Å; N74-A78 PolarHBondContact O-N 3.26Å |
| 75 | L | 86.4 | Confident | 81.3 | Confident | 4 Ų | 4 | 56.6 Ų | 56.6 | 2% | 0.021 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -59.1 | -51.2 | 173.8 | -179.8 | 71 | 0 | 0 | 0 | 110.9 | N71 L72 L77 A78 H79 Y244 E245 K248 I252 | N71-L75 WeakPolarHBondContact O-CB 3.36Å; N71-L75 PolarHBondContact O-N 3.09Å; L72-L75 PolarHBondContact O-N 2.75Å; L75-L77 VanDerWaalsContact C-N 3.33Å; L75-L77 PolarHBondContact O-N 3.03Å; L75-A78 PolarHBondContact O-N 3.27Å; L75-H79 WeakPolarHBondContact O-CB 3.34Å; L75-H79 PolarHBondContact O-N 3.2Å; L75-Y244 HydrophobicContact CD1-CE1 4.39Å; L75-E245 HydrophobicContact CD1-CB 3.89Å; L75-E245 HydrophobicContact CD1-CG 3.68Å; L75-K248 HydrophobicContact CD1-CB 4.05Å; L75-I252 HydrophobicContact CD2-CD1 4.44Å |
| 76 | T | 86.5 | Confident | 82.1 | Confident | 47 Ų | 47 | 59.8 Ų | 59.8 | 29% | 0.288 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -60.2 | -44 | 179.1 | -56.3 | 0 | 0 | 0 | 0 | 111 | L72 S73 H79 E80 T324 | L72-T76 WeakPolarHBondContact O-CB 3.31Å; L72-T76 PolarHBondContact O-N 3.45Å; L72-T76 PolarHBondContact O-OG1 3.33Å; S73-T76 PolarHBondContact O-N 3.12Å; T76-H79 PolarHBondContact O-N 3.3Å; T76-E80 HydrophobicContact CG2-CG 4.49Å; T76-E80 WeakPolarHBondContact O-CB 3.48Å; T76-E80 WeakPolarHBondContact O-CG 3.35Å; T76-E80 PolarHBondContact O-N 2.94Å; T76-T324 HydrophobicContact CG2-CG2 4.14Å |
| 77 | L | 86.3 | Confident | 82.7 | Confident | 80 Ų | 80 | 58.1 Ų | 58.1 | 42% | 0.419 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -64.2 | -45.6 | 178.4 | -179 | 63.4 | 0 | 0 | 0 | 112.2 | S73 N74 L75 H79 E80 I81 F87 | S73-L77 VanDerWaalsContact O-CB 3.27Å; S73-L77 WeakPolarHBondContact O-CB 3.43Å; S73-L77 PolarHBondContact O-N 2.89Å; N74-L77 PolarHBondContact O-N 3.44Å; L75-L77 VanDerWaalsContact C-N 3.33Å; L75-L77 PolarHBondContact O-N 3.03Å; L77-H79 VanDerWaalsContact C-N 3.33Å; L77-H79 PolarHBondContact O-N 3.05Å; L77-E80 PolarHBondContact O-N 3.03Å; L77-I81 HydrophobicContact CD1-CD1 4.02Å; L77-I81 HydrophobicContact CD1-CG1 4.3Å; L77-I81 HydrophobicContact CG-CD1 3.89Å; L77-I81 WeakPolarHBondContact O-CB 3.42Å; L77-I81 VanDerWaalsContact O-CG1 3.26Å; L77-I81 WeakPolarHBondContact O-CG1 3.3Å; L77-I81 PolarHBondContact O-N 3.21Å; L77-F87 HydrophobicContact CD1-CE2 4.22Å; L77-F87 HydrophobicContact CD1-CZ 3.67Å |
| 78 | A | 86.9 | Confident | 83.1 | Confident | 12 Ų | 12 | 62.3 Ų | 62.3 | 10% | 0.099 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.8 | -42.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | N74 L75 I81 A82 L237 Y244 | N74-A78 WeakPolarHBondContact O-CB 3.38Å; N74-A78 PolarHBondContact O-N 3.26Å; L75-A78 PolarHBondContact O-N 3.27Å; A78-I81 PolarHBondContact O-N 2.92Å; A78-A82 WeakPolarHBondContact O-CB 3.33Å; A78-A82 PolarHBondContact O-N 3.14Å; A78-A82 VanDerWaalsContact O-N 3.09Å; A78-L237 WeakPolarHBondContact O-CD2 3.38Å; A78-Y244 HydrophobicContact CB-CD1 4.2Å; A78-Y244 HydrophobicContact CB-CE1 3.67Å |
| 79 | H | 90 | Very high | 83.9 | Confident | 3 Ų | 3 | 64.4 Ų | 64.4 | 1% | 0.014 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -60.9 | -49.7 | 174.4 | -176.5 | 98.1 | 0 | 0 | 0 | 111.8 | L75 T76 L77 I81 A82 V83 E245 T324 D325 R328 | L75-H79 WeakPolarHBondContact O-CB 3.34Å; L75-H79 PolarHBondContact O-N 3.2Å; T76-H79 PolarHBondContact O-N 3.3Å; L77-H79 VanDerWaalsContact C-N 3.33Å; L77-H79 PolarHBondContact O-N 3.05Å; H79-I81 PolarHBondContact O-N 3.31Å; H79-A82 PolarHBondContact O-N 3.35Å; H79-A82 VanDerWaalsContact O-N 3.16Å; H79-V83 WeakPolarHBondContact O-CB 3.28Å; H79-V83 WeakPolarHBondContact O-CG2 3.3Å; H79-V83 PolarHBondContact O-N 2.92Å; H79-E245 WeakPolarHBondContact CB-OE1 3.42Å; H79-E245 IonicContact CE1-OE1 2.69Å; H79-E245 IonicContact CG-OE1 3.94Å; H79-E245 IonicContact ND1-OE1 2.74Å; H79-E245 PolarHBondContact ND1-OE1 3.37Å; H79-E245 IonicContact ND1-OE2 2.94Å; H79-T324 HydrophobicContact CB-CG2 3.64Å; H79-T324 VanDerWaalsContact CD2-CG2 3.43Å; H79-T324 WeakPolarHBondContact CD2-CG2 3.48Å; H79-T324 VanDerWaalsContact CG-CG2 3.46Å; H79-D325 IonicContact CE1-OD1 2.75Å; H79-D325 IonicContact CE1-OD2 3.6Å; H79-D325 IonicContact NE2-OD1 2.62Å; H79-D325 PolarHBondContact NE2-OD1 3.49Å; H79-D325 IonicContact NE2-OD2 2.69Å; H79-R328 PolarHBondContact CD2-NH2 3.43Å; H79-R328 PolarHBondContact NE2-NH2 2.97Å |
| 80 | E | 89.1 | Confident | 84.1 | Confident | 41 Ų | 41 | 68.9 Ų | 68.9 | 19% | 0.192 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -61.2 | -42.5 | 179 | -76.2 | -60.8 | 134.9 | 0 | 0 | 112.1 | T76 L77 A82 N84 F87 R328 | T76-E80 HydrophobicContact CG2-CG 4.49Å; T76-E80 WeakPolarHBondContact O-CB 3.48Å; T76-E80 WeakPolarHBondContact O-CG 3.35Å; T76-E80 PolarHBondContact O-N 2.94Å; L77-E80 PolarHBondContact O-N 3.03Å; E80-A82 VanDerWaalsContact C-N 3.28Å; E80-A82 PolarHBondContact O-N 3.39Å; E80-N84 WeakPolarHBondContact O-CB 3.24Å; E80-N84 PolarHBondContact O-N 3.11Å; E80-F87 HydrophobicContact CB-CD2 4.06Å; E80-F87 HydrophobicContact CB-CE2 4.16Å; E80-R328 IonicContact OE1-CZ 2.9Å; E80-R328 IonicContact OE1-NE 3.33Å; E80-R328 PolarHBondContact OE1-NE 3.46Å; E80-R328 IonicContact OE1-NH2 2.76Å; E80-R328 PolarHBondContact OE1-NH2 3.42Å |
| 81 | I | 86.9 | Confident | 83.7 | Confident | 28 Ų | 28 | 66.5 Ų | 66.5 | 14% | 0.144 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -61 | -39.9 | 176.3 | -70.5 | 166.4 | 0 | 0 | 0 | 111.5 | L77 A78 H79 F87 I230 R234 L237 | L77-I81 HydrophobicContact CD1-CD1 4.02Å; L77-I81 HydrophobicContact CD1-CG1 4.3Å; L77-I81 HydrophobicContact CG-CD1 3.89Å; L77-I81 WeakPolarHBondContact O-CB 3.42Å; L77-I81 VanDerWaalsContact O-CG1 3.26Å; L77-I81 WeakPolarHBondContact O-CG1 3.3Å; L77-I81 PolarHBondContact O-N 3.21Å; A78-I81 PolarHBondContact O-N 2.92Å; H79-I81 PolarHBondContact O-N 3.31Å; I81-F87 HydrophobicContact CD1-CE1 4.33Å; I81-F87 HydrophobicContact CG1-CD1 3.76Å; I81-F87 HydrophobicContact CG1-CE1 3.59Å; I81-F87 HydrophobicContact CG1-CG 4.31Å; I81-F87 HydrophobicContact CG1-CZ 4.02Å; I81-I230 HydrophobicContact CG1-CG2 4.36Å; I81-I230 HydrophobicContact CG2-CG2 3.69Å; I81-R234 PolarHBondContact O-NE 3.16Å; I81-L237 HydrophobicContact CB-CD2 3.88Å; I81-L237 HydrophobicContact CG2-CD2 3.6Å |
| 82 | A | 86.8 | Confident | 83.1 | Confident | 2 Ų | 2 | 73 Ų | 73 | 2% | 0.017 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -79.4 | -38.5 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | A78 H79 E80 L237 Q238 L241 | A78-A82 WeakPolarHBondContact O-CB 3.33Å; A78-A82 PolarHBondContact O-N 3.14Å; A78-A82 VanDerWaalsContact O-N 3.09Å; H79-A82 PolarHBondContact O-N 3.35Å; H79-A82 VanDerWaalsContact O-N 3.16Å; E80-A82 VanDerWaalsContact C-N 3.28Å; E80-A82 PolarHBondContact O-N 3.39Å; A82-L237 HydrophobicContact CB-CD2 3.95Å; A82-L237 HydrophobicContact CB-CG 4.1Å; A82-Q238 HydrophobicContact CB-CG 4.16Å; A82-Q238 WeakPolarHBondContact O-CG 3.45Å; A82-Q238 PolarHBondContact O-NE2 3.47Å; A82-L241 HydrophobicContact CB-CD1 3.79Å; A82-L241 HydrophobicContact CB-CD2 3.63Å; A82-L241 HydrophobicContact CB-CG 4.21Å |
| 83 | V | 86.1 | Confident | 82.2 | Confident | 47 Ų | 47 | 73 Ų | 73 | 29% | 0.285 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -94.6 | -37.3 | -172.4 | -175.9 | 0 | 0 | 0 | 0 | 112.3 | H79 E85 L241 L486 | H79-V83 WeakPolarHBondContact O-CB 3.28Å; H79-V83 WeakPolarHBondContact O-CG2 3.3Å; H79-V83 PolarHBondContact O-N 2.92Å; V83-E85 PolarHBondContact O-N 2.95Å; V83-L241 HydrophobicContact CG2-CD2 4.1Å; V83-L486 HydrophobicContact CG2-CD2 3.48Å; V83-L486 VanDerWaalsContact CG2-CD2 3.48Å |
| 84 | N | 86.1 | Confident | 81.6 | Confident | 54 Ų | 54 | 74 Ų | 74 | 29% | 0.289 | 38% | 0.383 | S | S | . | . | trans | -86.8 | 103.5 | 179.4 | -174.7 | -6.6 | 0 | 0 | 0 | 110.8 | E80 N86 F87 R234 | E80-N84 WeakPolarHBondContact O-CB 3.24Å; E80-N84 PolarHBondContact O-N 3.11Å; N84-N86 PolarHBondContact O-N 3.37Å; N84-N86 PolarHBondContact OD1-N 2.97Å; N84-F87 HydrophobicContact CB-CB 4.16Å; N84-F87 VanDerWaalsContact O-CB 3.26Å; N84-F87 WeakPolarHBondContact O-CB 3.48Å; N84-F87 PolarHBondContact O-N 3.4Å; N84-F87 PolarHBondContact OD1-N 3Å; N84-R234 PolarHBondContact O-NH2 3.28Å | ||
| 85 | E | 82.3 | Confident | 81 | Confident | 149 Ų | 149 | 74.6 Ų | 74.6 | 70% | 0.696 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.1 | -31.3 | 178.5 | -65 | -174.1 | 170.5 | 0 | 0 | 112.8 | V83 F87 R234 | V83-E85 PolarHBondContact O-N 2.95Å; E85-F87 VanDerWaalsContact C-N 3.32Å; E85-R234 PolarHBondContact O-NH1 3.09Å; E85-R234 PolarHBondContact O-NH2 3.3Å |
| 86 | N | 83.4 | Confident | 79.9 | Confident | 136 Ų | 136 | 83 Ų | 83 | 73% | 0.727 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.3 | 8.5 | -179.3 | -62.2 | -40.6 | 0 | 0 | 0 | 113 | N84 Q88 | N84-N86 PolarHBondContact O-N 3.37Å; N84-N86 PolarHBondContact OD1-N 2.97Å; N86-Q88 PolarHBondContact O-N 3.19Å |
| 87 | F | 85.4 | Confident | 79.1 | Confident | 38 Ų | 38 | 87 Ų | 87 | 17% | 0.167 | 45% | 0.45 | C | S | . | . | trans | -58.4 | 123.8 | 177.6 | -175.6 | -88.4 | 0 | 0 | 0 | 110.4 | L77 E80 I81 N84 E85 L89 I230 R234 | L77-F87 HydrophobicContact CD1-CE2 4.22Å; L77-F87 HydrophobicContact CD1-CZ 3.67Å; E80-F87 HydrophobicContact CB-CD2 4.06Å; E80-F87 HydrophobicContact CB-CE2 4.16Å; I81-F87 HydrophobicContact CD1-CE1 4.33Å; I81-F87 HydrophobicContact CG1-CD1 3.76Å; I81-F87 HydrophobicContact CG1-CE1 3.59Å; I81-F87 HydrophobicContact CG1-CG 4.31Å; I81-F87 HydrophobicContact CG1-CZ 4.02Å; N84-F87 HydrophobicContact CB-CB 4.16Å; N84-F87 VanDerWaalsContact O-CB 3.26Å; N84-F87 WeakPolarHBondContact O-CB 3.48Å; N84-F87 PolarHBondContact O-N 3.4Å; N84-F87 PolarHBondContact OD1-N 3Å; E85-F87 VanDerWaalsContact C-N 3.32Å; F87-L89 HydrophobicContact CE1-CD2 4.09Å; F87-L89 HydrophobicContact CE1-CG 4.44Å; F87-L89 HydrophobicContact CZ-CD2 4.13Å; F87-I230 HydrophobicContact CD1-CG2 4.18Å; F87-I230 HydrophobicContact CE1-CD1 4.17Å; F87-R234 PolarHBondContact O-NH2 3.21Å | ||
| 88 | Q | 81.6 | Confident | 79 | Confident | 127 Ų | 127 | 84.6 Ų | 84.6 | 59% | 0.593 | 44% | 0.44 | S | S | * | . | trans | -142.2 | 135.2 | 176 | -68.6 | -178.9 | -10.2 | 0 | 0 | 108.5 | N86 K90 N227 | N86-Q88 PolarHBondContact O-N 3.19Å; Q88-K90 PolarHBondContact O-N 3.22Å; Q88-N227 WeakPolarHBondContact CA-OD1 3.27Å | ||
| 89 | L | 83.2 | Confident | 78.9 | Confident | 72 Ų | 72 | 90 Ų | 90 | 38% | 0.377 | 47% | 0.466 | S | S | . | . | trans | -64.8 | 124.7 | 165.3 | -62.6 | 176.9 | 0 | 0 | 0 | 107.6 | F87 M223 A226 N227 I230 | F87-L89 HydrophobicContact CE1-CD2 4.09Å; F87-L89 HydrophobicContact CE1-CG 4.44Å; F87-L89 HydrophobicContact CZ-CD2 4.13Å; L89-M223 HydrophobicContact CB-CE 3.5Å; L89-M223 VanDerWaalsContact CB-CE 3.5Å; L89-M223 WeakPolarHBondContact O-CE 3.45Å; L89-A226 HydrophobicContact CD1-CB 4.02Å; L89-N227 PolarHBondContact N-OD1 3.04Å; L89-N227 PolarHBondContact O-ND2 2.88Å; L89-I230 HydrophobicContact CD1-CD1 3.66Å; L89-I230 HydrophobicContact CD2-CD1 4.49Å; L89-I230 HydrophobicContact CG-CD1 3.72Å | ||
| 90 | K | 78.5 | Confident | 78.6 | Confident | 172 Ų | 172 | 92.6 Ų | 92.6 | 75% | 0.748 | 49% | 0.488 | S | S | * | . | trans | -104.7 | 145.7 | 173.6 | -65.9 | -178.6 | -178.4 | 177.1 | 0 | 108.5 | Q88 E92 | Q88-K90 PolarHBondContact O-N 3.22Å; K90-E92 PolarHBondContact O-N 3.43Å | ||
| 91 | Q | 69.8 | Low | 78.3 | Confident | 108 Ų | 108 | 91.4 Ų | 91.4 | 51% | 0.505 | 49% | 0.488 | S | S | . | . | trans | -68.2 | 121 | 169 | -165.5 | 170.2 | 25 | 0 | 0 | 107.8 | A93 | Q91-A93 PolarHBondContact O-N 2.95Š| ||
| 92 | E | 62.7 | Low | 78.2 | Confident | 179 Ų | 179 | 95.9 Ų | 95.9 | 84% | 0.836 | 50% | 0.502 | S | S | * | . | trans | -67.6 | 105.1 | 174 | -70.8 | -175.6 | 177.9 | 0 | 0 | 108.8 | K90 L94 | K90-E92 PolarHBondContact O-N 3.43Å; E92-L94 PolarHBondContact O-N 3.43Å | ||
| 93 | A | 61.3 | Low | 78.3 | Confident | 94 Ų | 94 | 99.5 Ų | 99.5 | 78% | 0.777 | 52% | 0.524 | S | S | * | . | trans | -71.4 | 108.2 | 168.3 | 0 | 0 | 0 | 0 | 0 | 107.5 | Q91 | Q91-A93 PolarHBondContact O-N 2.95Š| ||
| 94 | L | 68.6 | Low | 78.3 | Confident | 80 Ų | 80 | 102.4 Ų | 102.4 | 42% | 0.419 | 53% | 0.533 | S | S | . | . | trans | -54.9 | 134.3 | 169 | -73.3 | 168.6 | 0 | 0 | 0 | 108.1 | E92 E96 K104 | E92-L94 PolarHBondContact O-N 3.43Å; L94-E96 PolarHBondContact O-N 2.8Å; L94-K104 HydrophobicContact CD1-CD 4.22Å | ||
| 95 | P | 73.2 | Confident | 78.3 | Confident | 93 Ų | 93 | 105.1 Ų | 105.1 | 60% | 0.604 | 54% | 0.544 | S | S | * | . | trans | -53.6 | 133.2 | 176.8 | -23.8 | 31.5 | 0 | 0 | 0 | 110 | N97 S98 | P95-N97 PolarHBondContact O-N 3Å; P95-S98 VanDerWaalsContact O-CB 3.27Å; P95-S98 WeakPolarHBondContact O-CB 3.17Å; P95-S98 PolarHBondContact O-N 3.33Å; P95-S98 PolarHBondContact O-OG 3.3Å | ||
| 96 | E | 63.7 | Low | 78.6 | Confident | 182 Ų | 182 | 103.2 Ų | 103.2 | 85% | 0.85 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.6 | -29.2 | -174.3 | -68 | -178.7 | 163 | 0 | 0 | 112.9 | L94 | L94-E96 PolarHBondContact O-N 2.8Š|
| 97 | N | 68.8 | Low | 78.9 | Confident | 131 Ų | 131 | 101 Ų | 101 | 70% | 0.701 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94 | 3.1 | -179.3 | -67.5 | -39.6 | 0 | 0 | 0 | 114.8 | P95 R102 | P95-N97 PolarHBondContact O-N 3Å; N97-R102 PolarHBondContact O-NH1 3.4Å; N97-R102 PolarHBondContact O-NH2 3.24Å |
| 98 | S | 84.6 | Confident | 79 | Confident | 28 Ų | 28 | 103.9 Ų | 103.9 | 20% | 0.196 | 54% | 0.542 | C | S | . | . | trans | -72.1 | 143.4 | 178.4 | 68.1 | 0 | 0 | 0 | 0 | 111.4 | P95 A100 G101 R102 | P95-S98 VanDerWaalsContact O-CB 3.27Å; P95-S98 WeakPolarHBondContact O-CB 3.17Å; P95-S98 PolarHBondContact O-N 3.33Å; P95-S98 PolarHBondContact O-OG 3.3Å; S98-A100 VanDerWaalsContact C-N 3.28Å; S98-A100 PolarHBondContact O-N 2.95Å; S98-G101 PolarHBondContact O-N 2.85Å; S98-G101 WeakPolarHBondContact OG-CA 3.34Å; S98-G101 PolarHBondContact OG-N 2.89Å; S98-R102 PolarHBondContact O-N 2.9Å | ||
| 99 | L | 84.9 | Confident | 79.4 | Confident | 125 Ų | 125 | 102.3 Ų | 102.3 | 65% | 0.654 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -58.5 | -43.8 | 173.7 | 178.5 | 64.6 | 0 | 0 | 0 | 110.8 | G101 R102 V103 | L99-G101 VanDerWaalsContact C-N 3.35Å; L99-G101 PolarHBondContact O-N 3.45Å; L99-R102 PolarHBondContact O-N 3.11Å; L99-V103 HydrophobicContact CD1-CG2 4.17Å; L99-V103 HydrophobicContact CG-CG2 4.32Å; L99-V103 VanDerWaalsContact O-CG2 3.28Å; L99-V103 WeakPolarHBondContact O-CG2 3.36Å; L99-V103 PolarHBondContact O-N 2.93Å |
| 100 | A | 83.4 | Confident | 79.8 | Confident | 58 Ų | 58 | 101.2 Ų | 101.2 | 48% | 0.479 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -60.3 | -42.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | S98 V103 K104 | S98-A100 VanDerWaalsContact C-N 3.28Å; S98-A100 PolarHBondContact O-N 2.95Å; A100-V103 PolarHBondContact O-N 3.43Å; A100-K104 WeakPolarHBondContact O-CB 3.49Å; A100-K104 PolarHBondContact O-N 2.92Å |
| 101 | G | 84.1 | Confident | 80.4 | Confident | 17 Ų | 17 | 96.6 Ų | 96.6 | 18% | 0.175 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -61.9 | -45.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | S98 L99 K104 H105 | S98-G101 PolarHBondContact O-N 2.85Å; S98-G101 WeakPolarHBondContact OG-CA 3.34Å; S98-G101 PolarHBondContact OG-N 2.89Å; L99-G101 VanDerWaalsContact C-N 3.35Å; L99-G101 PolarHBondContact O-N 3.45Å; G101-K104 PolarHBondContact O-N 3.37Å; G101-H105 WeakPolarHBondContact O-CB 3.42Å; G101-H105 PolarHBondContact O-N 2.89Å |
| 102 | R | 84.2 | Confident | 81.4 | Confident | 121 Ų | 121 | 92.8 Ų | 92.8 | 46% | 0.457 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.4 | -45.7 | 175.6 | -73.6 | -169 | -70.8 | -96.5 | -4.8 | 112.6 | N97 S98 L99 H105 I106 | N97-R102 PolarHBondContact O-NH1 3.4Å; N97-R102 PolarHBondContact O-NH2 3.24Å; S98-R102 PolarHBondContact O-N 2.9Å; L99-R102 PolarHBondContact O-N 3.11Å; R102-H105 PolarHBondContact O-N 3.03Å; R102-I106 VanDerWaalsContact O-CG1 3.29Å; R102-I106 WeakPolarHBondContact O-CG1 3.37Å; R102-I106 PolarHBondContact O-N 3.45Å |
| 103 | V | 87.4 | Confident | 82.7 | Confident | 78 Ų | 78 | 88.4 Ų | 88.4 | 47% | 0.473 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61 | -47.5 | 177.8 | 171 | 0 | 0 | 0 | 0 | 110.4 | L99 A100 H105 I106 V107 | L99-V103 HydrophobicContact CD1-CG2 4.17Å; L99-V103 HydrophobicContact CG-CG2 4.32Å; L99-V103 VanDerWaalsContact O-CG2 3.28Å; L99-V103 WeakPolarHBondContact O-CG2 3.36Å; L99-V103 PolarHBondContact O-N 2.93Å; A100-V103 PolarHBondContact O-N 3.43Å; V103-H105 VanDerWaalsContact C-N 3.33Å; V103-H105 PolarHBondContact O-N 3.31Å; V103-I106 PolarHBondContact O-N 3.01Å; V103-V107 HydrophobicContact CG1-CG2 4.37Å; V103-V107 VanDerWaalsContact O-CG2 3.3Å; V103-V107 WeakPolarHBondContact O-CG2 3.48Å; V103-V107 PolarHBondContact O-N 3.49Å |
| 104 | K | 86.2 | Confident | 84 | Confident | 108 Ų | 108 | 87.1 Ų | 87.1 | 47% | 0.47 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -57.5 | -46.6 | 176.5 | -175.7 | -179.7 | 179.4 | 179.9 | 0 | 111.4 | L94 A100 G101 V107 H108 | L94-K104 HydrophobicContact CD1-CD 4.22Å; A100-K104 WeakPolarHBondContact O-CB 3.49Å; A100-K104 PolarHBondContact O-N 2.92Å; G101-K104 PolarHBondContact O-N 3.37Å; K104-V107 PolarHBondContact O-N 3.4Å; K104-H108 WeakPolarHBondContact O-CB 3.42Å; K104-H108 PolarHBondContact O-CD2 3.24Å; K104-H108 PolarHBondContact O-N 2.87Å |
| 105 | H | 86.4 | Confident | 85 | Confident | 112 Ų | 112 | 83.3 Ų | 83.3 | 52% | 0.519 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -60.7 | -48.8 | 179.1 | -177.5 | 71.4 | 0 | 0 | 0 | 112.2 | G101 R102 V103 V107 H108 Q109 | G101-H105 WeakPolarHBondContact O-CB 3.42Å; G101-H105 PolarHBondContact O-N 2.89Å; R102-H105 PolarHBondContact O-N 3.03Å; V103-H105 VanDerWaalsContact C-N 3.33Å; V103-H105 PolarHBondContact O-N 3.31Å; H105-V107 PolarHBondContact O-N 3.13Å; H105-H108 PolarHBondContact O-N 3.32Å; H105-Q109 VanDerWaalsContact O-CB 3.3Å; H105-Q109 WeakPolarHBondContact O-CB 3.49Å; H105-Q109 PolarHBondContact O-N 3.24Å |
| 106 | I | 89 | Confident | 85.7 | Confident | 108 Ų | 108 | 81.9 Ų | 81.9 | 55% | 0.554 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -62.1 | -44.6 | -179.9 | -68 | 165.3 | 0 | 0 | 0 | 111.1 | R102 V103 Q109 A110 | R102-I106 VanDerWaalsContact O-CG1 3.29Å; R102-I106 WeakPolarHBondContact O-CG1 3.37Å; R102-I106 PolarHBondContact O-N 3.45Å; V103-I106 PolarHBondContact O-N 3.01Å; I106-Q109 PolarHBondContact O-N 3.48Å; I106-A110 WeakPolarHBondContact O-CB 3.48Å; I106-A110 PolarHBondContact O-N 3.24Å |
| 107 | V | 89.7 | Confident | 86.9 | Confident | 89 Ų | 89 | 77 Ų | 77 | 54% | 0.539 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -64.3 | -46 | 179.5 | 171.6 | 0 | 0 | 0 | 0 | 111.1 | V103 K104 H105 Q109 A110 F111 | V103-V107 HydrophobicContact CG1-CG2 4.37Å; V103-V107 VanDerWaalsContact O-CG2 3.3Å; V103-V107 WeakPolarHBondContact O-CG2 3.48Å; V103-V107 PolarHBondContact O-N 3.49Å; K104-V107 PolarHBondContact O-N 3.4Å; H105-V107 PolarHBondContact O-N 3.13Å; V107-Q109 VanDerWaalsContact C-N 3.34Å; V107-Q109 PolarHBondContact O-N 2.96Å; V107-A110 PolarHBondContact O-N 2.97Å; V107-F111 PolarHBondContact O-N 3.02Å; V107-F111 VanDerWaalsContact O-N 3.1Å |
| 108 | H | 87.9 | Confident | 87.8 | Confident | 100 Ų | 100 | 72 Ų | 72 | 46% | 0.463 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.9 | -41.2 | 177.6 | -77.8 | -135.4 | 0 | 0 | 0 | 111.3 | K104 H105 F111 W112 | K104-H108 WeakPolarHBondContact O-CB 3.42Å; K104-H108 PolarHBondContact O-CD2 3.24Å; K104-H108 PolarHBondContact O-N 2.87Å; H105-H108 PolarHBondContact O-N 3.32Å; H108-F111 PolarHBondContact O-N 2.79Å; H108-W112 PolarHBondContact O-N 3.03Å |
| 109 | Q | 90 | Very high | 87.8 | Confident | 93 Ų | 93 | 72 Ų | 72 | 44% | 0.435 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63.7 | -47.6 | 177.4 | -177 | 175.2 | -4.7 | 0 | 0 | 111.4 | H105 I106 V107 F111 W112 D113 | H105-Q109 VanDerWaalsContact O-CB 3.3Å; H105-Q109 WeakPolarHBondContact O-CB 3.49Å; H105-Q109 PolarHBondContact O-N 3.24Å; I106-Q109 PolarHBondContact O-N 3.48Å; V107-Q109 VanDerWaalsContact C-N 3.34Å; V107-Q109 PolarHBondContact O-N 2.96Å; Q109-F111 PolarHBondContact O-N 3.22Å; Q109-W112 PolarHBondContact O-N 3.47Å; Q109-W112 VanDerWaalsContact O-N 3.1Å; Q109-D113 VanDerWaalsContact O-CG 3.25Å; Q109-D113 PolarHBondContact O-N 3.17Å |
| 110 | A | 90.7 | Very high | 87.8 | Confident | 49 Ų | 49 | 71.6 Ų | 71.6 | 41% | 0.405 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -58.3 | -37.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | I106 V107 V114 | I106-A110 WeakPolarHBondContact O-CB 3.48Å; I106-A110 PolarHBondContact O-N 3.24Å; V107-A110 PolarHBondContact O-N 2.97Å; A110-V114 VanDerWaalsContact O-CG2 3.27Å; A110-V114 WeakPolarHBondContact O-CG2 3.33Å; A110-V114 PolarHBondContact O-N 3.1Å |
| 111 | F | 91.1 | Very high | 87.8 | Confident | 76 Ų | 76 | 70.8 Ų | 70.8 | 33% | 0.333 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.2 | -48.3 | 174.5 | 174.5 | -93.4 | 0 | 0 | 0 | 112.2 | V107 H108 Q109 V114 L115 L132 | V107-F111 PolarHBondContact O-N 3.02Å; V107-F111 VanDerWaalsContact O-N 3.1Å; H108-F111 PolarHBondContact O-N 2.79Å; Q109-F111 PolarHBondContact O-N 3.22Å; F111-V114 PolarHBondContact O-N 3.42Å; F111-L115 PolarHBondContact O-N 2.91Å; F111-L132 HydrophobicContact CE1-CD1 4.05Å; F111-L132 HydrophobicContact CE1-CD2 3.89Å; F111-L132 HydrophobicContact CE1-CG 4.37Å; F111-L132 HydrophobicContact CZ-CD1 4.02Å; F111-L132 HydrophobicContact CZ-CD2 3.73Å; F111-L132 HydrophobicContact CZ-CG 4.01Å |
| 112 | W | 91.1 | Very high | 87.5 | Confident | 28 Ų | 28 | 77.8 Ų | 77.8 | 11% | 0.106 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -68.8 | -34.8 | 179.7 | -65.3 | 116 | 0 | 0 | 0 | 112.5 | H108 Q109 V114 L115 D116 L132 V208 L211 R212 F215 | H108-W112 PolarHBondContact O-N 3.03Å; Q109-W112 PolarHBondContact O-N 3.47Å; Q109-W112 VanDerWaalsContact O-N 3.1Å; W112-V114 VanDerWaalsContact C-N 3.34Å; W112-L115 HydrophobicContact CE3-CD2 3.63Å; W112-L115 HydrophobicContact CZ3-CD2 3.55Å; W112-L115 PolarHBondContact O-N 2.87Å; W112-D116 WeakPolarHBondContact O-CB 3.37Å; W112-D116 PolarHBondContact O-N 3.38Å; W112-L132 HydrophobicContact CH2-CD1 4.14Å; W112-L132 HydrophobicContact CH2-CD2 4.38Å; W112-L132 HydrophobicContact CZ3-CD1 3.86Å; W112-V208 HydrophobicContact CB-CG1 4.46Å; W112-V208 HydrophobicContact CE3-CG1 3.92Å; W112-L211 HydrophobicContact CH2-CB 4.32Å; W112-L211 HydrophobicContact CZ3-CB 4.04Å; W112-R212 HydrophobicContact CD2-CB 4.12Å; W112-R212 HydrophobicContact CD2-CG 4.32Å; W112-R212 HydrophobicContact CE3-CB 4.3Å; W112-R212 HydrophobicContact CH2-CB 4.06Å; W112-R212 HydrophobicContact CZ2-CB 3.86Å; W112-R212 HydrophobicContact CZ2-CG 4.05Å; W112-R212 HydrophobicContact CZ3-CB 4.27Å; W112-F215 HydrophobicContact CH2-CD2 4.2Å |
| 113 | D | 90.1 | Very high | 87.1 | Confident | 86 Ų | 86 | 76.9 Ų | 76.9 | 46% | 0.46 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -64.9 | -38.1 | 175.5 | -66.5 | -16.9 | 0 | 0 | 0 | 111.5 | Q109 S117 | Q109-D113 VanDerWaalsContact O-CG 3.25Å; Q109-D113 PolarHBondContact O-N 3.17Å; D113-S117 WeakPolarHBondContact O-CB 3.46Å; D113-S117 PolarHBondContact O-N 3.01Å; D113-S117 PolarHBondContact O-OG 3.03Å |
| 114 | V | 89.3 | Confident | 86.8 | Confident | 67 Ų | 67 | 75.6 Ų | 75.6 | 41% | 0.406 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -66.4 | -46.9 | 173.4 | 169.5 | 0 | 0 | 0 | 0 | 110.7 | A110 F111 W112 D116 S117 E118 | A110-V114 VanDerWaalsContact O-CG2 3.27Å; A110-V114 WeakPolarHBondContact O-CG2 3.33Å; A110-V114 PolarHBondContact O-N 3.1Å; F111-V114 PolarHBondContact O-N 3.42Å; W112-V114 VanDerWaalsContact C-N 3.34Å; V114-D116 VanDerWaalsContact C-N 3.31Å; V114-D116 PolarHBondContact O-N 2.91Å; V114-S117 WeakPolarHBondContact O-CB 3.45Å; V114-S117 PolarHBondContact O-N 2.7Å; V114-S117 VanDerWaalsContact O-N 3.1Å; V114-E118 HydrophobicContact CG1-CG 4.36Å; V114-E118 WeakPolarHBondContact CG1-OE1 3.44Å; V114-E118 WeakPolarHBondContact O-CG 3.19Å; V114-E118 PolarHBondContact O-N 2.79Å |
| 115 | L | 88.8 | Confident | 86.7 | Confident | 1 Ų | 1 | 76 Ų | 76 | 1% | 0.005 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -59.6 | -41.9 | 177.9 | -174.8 | 71 | 0 | 0 | 0 | 111.9 | F111 W112 S117 E118 L119 H128 A129 L132 V208 L211 | F111-L115 PolarHBondContact O-N 2.91Å; W112-L115 HydrophobicContact CE3-CD2 3.63Å; W112-L115 HydrophobicContact CZ3-CD2 3.55Å; W112-L115 PolarHBondContact O-N 2.87Å; L115-S117 VanDerWaalsContact C-N 3.33Å; L115-E118 PolarHBondContact O-N 3.3Å; L115-L119 HydrophobicContact CD1-CD1 4.32Å; L115-L119 HydrophobicContact CD1-CG 4.46Å; L115-L119 HydrophobicContact CG-CD1 4.04Å; L115-L119 WeakPolarHBondContact O-CB 3.44Å; L115-L119 VanDerWaalsContact O-CG 3.3Å; L115-L119 WeakPolarHBondContact O-CG 3.43Å; L115-L119 PolarHBondContact O-N 3.38Å; L115-H128 HydrophobicContact CD1-CB 3.71Å; L115-A129 HydrophobicContact CD1-CB 4.27Å; L115-L132 HydrophobicContact CD1-CD1 4.35Å; L115-L132 HydrophobicContact CD2-CD1 3.56Å; L115-V208 HydrophobicContact CD2-CG1 4.39Å; L115-L211 HydrophobicContact CD2-CD1 4.29Å |
| 116 | D | 88.6 | Confident | 86.6 | Confident | 62 Ų | 62 | 72.5 Ų | 72.5 | 33% | 0.332 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -65 | -38.5 | 176.1 | -165.6 | 50 | 0 | 0 | 0 | 111.4 | W112 V114 N120 V208 | W112-D116 WeakPolarHBondContact O-CB 3.37Å; W112-D116 PolarHBondContact O-N 3.38Å; V114-D116 VanDerWaalsContact C-N 3.31Å; V114-D116 PolarHBondContact O-N 2.91Å; D116-N120 WeakPolarHBondContact O-CB 3.42Å; D116-N120 PolarHBondContact O-N 2.91Å; D116-N120 PolarHBondContact O-ND2 2.83Å; D116-N120 PolarHBondContact OD1-ND2 3.34Å; D116-N120 VanDerWaalsContact OD1-ND2 3.09Å; D116-V208 HydrophobicContact CB-CG1 4.45Å; D116-V208 HydrophobicContact CB-CG2 4.09Å |
| 117 | S | 88.4 | Confident | 86.4 | Confident | 80 Ų | 80 | 72 Ų | 72 | 56% | 0.559 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -65.8 | -40.8 | 176.3 | -58.9 | 0 | 0 | 0 | 0 | 112.6 | D113 V114 L115 A121 | D113-S117 WeakPolarHBondContact O-CB 3.46Å; D113-S117 PolarHBondContact O-N 3.01Å; D113-S117 PolarHBondContact O-OG 3.03Å; V114-S117 WeakPolarHBondContact O-CB 3.45Å; V114-S117 PolarHBondContact O-N 2.7Å; V114-S117 VanDerWaalsContact O-N 3.1Å; L115-S117 VanDerWaalsContact C-N 3.33Å; S117-A121 PolarHBondContact O-N 3.35Å; S117-A121 VanDerWaalsContact O-N 3.12Å |
| 118 | E | 87.3 | Confident | 86.3 | Confident | 27 Ų | 27 | 70.2 Ų | 70.2 | 13% | 0.126 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -69.8 | -42 | -179.6 | -75.2 | 177.4 | -176.1 | 0 | 0 | 112.9 | V114 L115 N120 A121 E125 H128 | V114-E118 HydrophobicContact CG1-CG 4.36Å; V114-E118 WeakPolarHBondContact CG1-OE1 3.44Å; V114-E118 WeakPolarHBondContact O-CG 3.19Å; V114-E118 PolarHBondContact O-N 2.79Å; L115-E118 PolarHBondContact O-N 3.3Å; E118-N120 VanDerWaalsContact C-N 3.28Å; E118-N120 PolarHBondContact O-N 3.35Å; E118-A121 WeakPolarHBondContact O-CB 3.16Å; E118-A121 PolarHBondContact O-N 3.48Å; E118-E125 HydrophobicContact CB-CB 4.12Å; E118-E125 HydrophobicContact CG-CB 4.31Å; E118-E125 PolarHBondContact O-N 3.06Å; E118-H128 IonicContact OE1-CE1 2.66Å; E118-H128 PolarHBondContact OE1-CE1 3.44Å; E118-H128 IonicContact OE1-ND1 2.98Å; E118-H128 PolarHBondContact OE1-ND1 2.9Å; E118-H128 IonicContact OE2-CE1 2.68Å; E118-H128 IonicContact OE2-CG 3.6Å; E118-H128 IonicContact OE2-ND1 3.34Å; E118-H128 PolarHBondContact OE2-ND1 3.47Å |
| 119 | L | 84.8 | Confident | 86.3 | Confident | 26 Ų | 26 | 65.6 Ų | 65.6 | 14% | 0.136 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -70.4 | -26.8 | 178.7 | -68.8 | 175.7 | 0 | 0 | 0 | 112.6 | L115 F126 A129 I175 I207 V208 | L115-L119 HydrophobicContact CD1-CD1 4.32Å; L115-L119 HydrophobicContact CD1-CG 4.46Å; L115-L119 HydrophobicContact CG-CD1 4.04Å; L115-L119 WeakPolarHBondContact O-CB 3.44Å; L115-L119 VanDerWaalsContact O-CG 3.3Å; L115-L119 WeakPolarHBondContact O-CG 3.43Å; L115-L119 PolarHBondContact O-N 3.38Å; L119-F126 HydrophobicContact CD2-CD1 3.8Å; L119-F126 HydrophobicContact CD2-CE1 3.98Å; L119-A129 HydrophobicContact CD2-CB 4.47Å; L119-I175 HydrophobicContact CD2-CD1 3.61Å; L119-I207 HydrophobicContact CD1-CG2 4.16Å; L119-V208 HydrophobicContact CD1-CG2 3.78Å |
| 120 | N | 84.8 | Confident | 86.2 | Confident | 118 Ų | 118 | 61.5 Ų | 61.5 | 63% | 0.631 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.8 | -0.1 | 176.5 | -66.7 | -53.8 | 0 | 0 | 0 | 113.4 | D116 E118 | D116-N120 WeakPolarHBondContact O-CB 3.42Å; D116-N120 PolarHBondContact O-N 2.91Å; D116-N120 PolarHBondContact O-ND2 2.83Å; D116-N120 PolarHBondContact OD1-ND2 3.34Å; D116-N120 VanDerWaalsContact OD1-ND2 3.09Å; E118-N120 VanDerWaalsContact C-N 3.28Å; E118-N120 PolarHBondContact O-N 3.35Å |
| 121 | A | 84.9 | Confident | 86.2 | Confident | 40 Ų | 40 | 64 Ų | 64 | 33% | 0.331 | 34% | 0.343 | S | S | . | . | S | Bend | trans | -71.9 | 161.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | S117 E118 P123 P124 | S117-A121 PolarHBondContact O-N 3.35Å; S117-A121 VanDerWaalsContact O-N 3.12Å; E118-A121 WeakPolarHBondContact O-CB 3.16Å; E118-A121 PolarHBondContact O-N 3.48Å; A121-P123 CarbonylContact C-O 3.59Å; A121-P123 CarbonylContact O-C 3.55Å; A121-P123 VanDerWaalsContact O-C 3.26Å; A121-P124 WeakPolarHBondContact O-CA 3.37Å; A121-P124 VanDerWaalsContact O-N 3.12Å |
| 122 | D | 76.1 | Confident | 86.2 | Confident | 165 Ų | 165 | 60.7 Ų | 60.7 | 88% | 0.882 | 33% | 0.329 | S | S | * | . | S | Bend | trans | -126.6 | 101.5 | 178.5 | -158.4 | 5.2 | 0 | 0 | 0 | 110.1 | ||
| 123 | P | 76.1 | Confident | 86.2 | Confident | 101 Ų | 101 | 59.5 Ų | 59.5 | 66% | 0.656 | 32% | 0.324 | S | S | * | . | S | Bend | cis | -76.3 | 155.6 | 3.6 | 32.4 | -34.8 | 0 | 0 | 0 | 113.3 | A121 | A121-P123 CarbonylContact C-O 3.59Å; A121-P123 CarbonylContact O-C 3.55Å; A121-P123 VanDerWaalsContact O-C 3.26Å |
| 124 | P | 80.7 | Confident | 86.3 | Confident | 52 Ų | 52 | 59.2 Ų | 59.2 | 34% | 0.338 | 32% | 0.321 | S | S | . | . | P | Polyproline II helix | trans | -66.5 | 140.8 | 179.2 | -18.4 | 30.3 | 0 | 0 | 0 | 112.4 | A121 F126 | A121-P124 WeakPolarHBondContact O-CA 3.37Å; A121-P124 VanDerWaalsContact O-N 3.12Å; P124-F126 HydrophobicContact CB-CE1 4.05Å; P124-F126 HydrophobicContact CB-CE2 4.03Å; P124-F126 HydrophobicContact CB-CZ 3.63Å; P124-F126 HydrophobicContact CG-CZ 4.27Å |
| 125 | E | 84.8 | Confident | 86.5 | Confident | 116 Ų | 116 | 61.1 Ų | 61.1 | 54% | 0.542 | 33% | 0.325 | S | S | . | . | P | Polyproline II helix | trans | -102.6 | 131.3 | 173 | -68.7 | -172.3 | -176.3 | 0 | 0 | 110.5 | E118 | E118-E125 HydrophobicContact CB-CB 4.12Å; E118-E125 HydrophobicContact CG-CB 4.31Å; E118-E125 PolarHBondContact O-N 3.06Å |
| 126 | F | 85.1 | Confident | 86.8 | Confident | 39 Ų | 39 | 61 Ų | 61 | 17% | 0.171 | 33% | 0.325 | C | S | . | . | trans | -113.4 | 0.6 | -172.5 | -60.9 | -66 | 0 | 0 | 0 | 114.3 | L119 P124 H128 A129 I130 A168 I175 | L119-F126 HydrophobicContact CD2-CD1 3.8Å; L119-F126 HydrophobicContact CD2-CE1 3.98Å; P124-F126 HydrophobicContact CB-CE1 4.05Å; P124-F126 HydrophobicContact CB-CE2 4.03Å; P124-F126 HydrophobicContact CB-CZ 3.63Å; P124-F126 HydrophobicContact CG-CZ 4.27Å; F126-H128 PolarHBondContact O-N 3.27Å; F126-A129 PolarHBondContact O-N 3.45Å; F126-A129 VanDerWaalsContact O-N 3.14Å; F126-I130 HydrophobicContact CB-CD1 4.31Å; F126-I130 VanDerWaalsContact O-CG1 3.3Å; F126-I130 WeakPolarHBondContact O-CG1 3.24Å; F126-I130 PolarHBondContact O-N 3.24Å; F126-A168 HydrophobicContact CB-CB 4.03Å; F126-A168 HydrophobicContact CD2-CB 3.77Å; F126-A168 HydrophobicContact CG-CB 4.21Å; F126-I175 HydrophobicContact CD1-CD1 3.62Å; F126-I175 HydrophobicContact CE1-CD1 3.55Å; F126-I175 HydrophobicContact CE1-CG1 4.41Å | ||
| 127 | E | 85.4 | Confident | 87 | Confident | 96 Ų | 96 | 60.2 Ų | 60.2 | 45% | 0.449 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -56.7 | -46.4 | -173.6 | -83.1 | -67.6 | 147.1 | 0 | 0 | 113.2 | I130 K131 | E127-I130 PolarHBondContact O-N 3.36Å; E127-K131 PolarHBondContact O-N 3.03Å |
| 128 | H | 87.3 | Confident | 87.2 | Confident | 53 Ų | 53 | 60.8 Ų | 60.8 | 25% | 0.245 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -70 | -36.2 | 177.6 | -69.7 | 96.9 | 0 | 0 | 0 | 112.5 | L115 E118 F126 I130 K131 L132 | L115-H128 HydrophobicContact CD1-CB 3.71Å; E118-H128 IonicContact OE1-CE1 2.66Å; E118-H128 PolarHBondContact OE1-CE1 3.44Å; E118-H128 IonicContact OE1-ND1 2.98Å; E118-H128 PolarHBondContact OE1-ND1 2.9Å; E118-H128 IonicContact OE2-CE1 2.68Å; E118-H128 IonicContact OE2-CG 3.6Å; E118-H128 IonicContact OE2-ND1 3.34Å; E118-H128 PolarHBondContact OE2-ND1 3.47Å; F126-H128 PolarHBondContact O-N 3.27Å; H128-I130 VanDerWaalsContact C-N 3.34Å; H128-I130 PolarHBondContact O-N 3.05Å; H128-K131 PolarHBondContact O-N 3.24Å; H128-L132 WeakPolarHBondContact O-CG 3.44Å; H128-L132 PolarHBondContact O-N 3.08Å |
| 129 | A | 87.4 | Confident | 87.4 | Confident | 3 Ų | 3 | 60.4 Ų | 60.4 | 3% | 0.025 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63.1 | -40.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L115 L119 F126 K131 L132 F133 | L115-A129 HydrophobicContact CD1-CB 4.27Å; L119-A129 HydrophobicContact CD2-CB 4.47Å; F126-A129 PolarHBondContact O-N 3.45Å; F126-A129 VanDerWaalsContact O-N 3.14Å; A129-K131 PolarHBondContact O-N 3.49Å; A129-L132 WeakPolarHBondContact O-CB 3.41Å; A129-L132 PolarHBondContact O-N 3.35Å; A129-F133 WeakPolarHBondContact O-CD2 3.39Å; A129-F133 PolarHBondContact O-N 3.26Å |
| 130 | I | 88.8 | Confident | 87.7 | Confident | 6 Ų | 6 | 59.1 Ų | 59.1 | 3% | 0.031 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.8 | -45.7 | 176.7 | -67.9 | 163.9 | 0 | 0 | 0 | 110.7 | F126 E127 H128 L132 F133 E134 I164 R165 A168 | F126-I130 HydrophobicContact CB-CD1 4.31Å; F126-I130 VanDerWaalsContact O-CG1 3.3Å; F126-I130 WeakPolarHBondContact O-CG1 3.24Å; F126-I130 PolarHBondContact O-N 3.24Å; E127-I130 PolarHBondContact O-N 3.36Å; H128-I130 VanDerWaalsContact C-N 3.34Å; H128-I130 PolarHBondContact O-N 3.05Å; I130-L132 VanDerWaalsContact C-N 3.32Å; I130-L132 PolarHBondContact O-N 3.23Å; I130-F133 PolarHBondContact O-N 3.49Å; I130-E134 PolarHBondContact O-N 3.03Å; I130-I164 HydrophobicContact CG1-CG2 3.9Å; I130-R165 HydrophobicContact CD1-CB 4.19Å; I130-R165 HydrophobicContact CD1-CG 4.36Å; I130-A168 HydrophobicContact CD1-CB 4.29Å |
| 131 | K | 90.1 | Very high | 88 | Confident | 102 Ų | 102 | 54 Ų | 54 | 44% | 0.443 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -61.2 | -39.8 | 176.1 | -68.8 | 173.1 | -173.3 | 165.8 | 0 | 112.1 | E127 H128 A129 F133 E134 E135 | E127-K131 PolarHBondContact O-N 3.03Å; H128-K131 PolarHBondContact O-N 3.24Å; A129-K131 PolarHBondContact O-N 3.49Å; K131-F133 PolarHBondContact O-N 2.95Å; K131-E134 WeakPolarHBondContact O-CB 3.37Å; K131-E134 PolarHBondContact O-N 3.23Å; K131-E135 PolarHBondContact O-N 2.87Å |
| 132 | L | 91.3 | Very high | 88.3 | Confident | 6 Ų | 6 | 56 Ų | 56 | 3% | 0.031 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.6 | -42.4 | 175.7 | -71.5 | 173.6 | 0 | 0 | 0 | 111.9 | F111 W112 L115 H128 A129 I130 E134 E135 I136 L211 F215 | F111-L132 HydrophobicContact CE1-CD1 4.05Å; F111-L132 HydrophobicContact CE1-CD2 3.89Å; F111-L132 HydrophobicContact CE1-CG 4.37Å; F111-L132 HydrophobicContact CZ-CD1 4.02Å; F111-L132 HydrophobicContact CZ-CD2 3.73Å; F111-L132 HydrophobicContact CZ-CG 4.01Å; W112-L132 HydrophobicContact CH2-CD1 4.14Å; W112-L132 HydrophobicContact CH2-CD2 4.38Å; W112-L132 HydrophobicContact CZ3-CD1 3.86Å; L115-L132 HydrophobicContact CD1-CD1 4.35Å; L115-L132 HydrophobicContact CD2-CD1 3.56Å; H128-L132 WeakPolarHBondContact O-CG 3.44Å; H128-L132 PolarHBondContact O-N 3.08Å; A129-L132 WeakPolarHBondContact O-CB 3.41Å; A129-L132 PolarHBondContact O-N 3.35Å; I130-L132 VanDerWaalsContact C-N 3.32Å; I130-L132 PolarHBondContact O-N 3.23Å; L132-E134 VanDerWaalsContact C-N 3.34Å; L132-E135 PolarHBondContact O-N 3.43Å; L132-I136 WeakPolarHBondContact O-CB 3.4Å; L132-I136 WeakPolarHBondContact O-CD1 3.49Å; L132-I136 WeakPolarHBondContact O-CG1 3.45Å; L132-I136 PolarHBondContact O-N 2.94Å; L132-L211 HydrophobicContact CD1-CD1 4.4Å; L132-F215 HydrophobicContact CB-CE2 4.01Å; L132-F215 HydrophobicContact CB-CZ 4.26Å; L132-F215 HydrophobicContact CD2-CD2 4.31Å; L132-F215 HydrophobicContact CD2-CE1 4.48Å; L132-F215 HydrophobicContact CD2-CE2 3.45Å; L132-F215 VanDerWaalsContact CD2-CE2 3.45Å; L132-F215 HydrophobicContact CD2-CZ 3.54Å; L132-F215 HydrophobicContact CG-CE2 4.23Å |
| 133 | F | 91.3 | Very high | 88.9 | Confident | 3 Ų | 3 | 49.1 Ų | 49.1 | 1% | 0.013 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -67.9 | -33.4 | 175.6 | -76.9 | -67.2 | 0 | 0 | 0 | 113 | A129 I130 K131 I136 R137 L159 I164 I175 L178 V182 L211 | A129-F133 WeakPolarHBondContact O-CD2 3.39Å; A129-F133 PolarHBondContact O-N 3.26Å; I130-F133 PolarHBondContact O-N 3.49Å; K131-F133 PolarHBondContact O-N 2.95Å; F133-I136 HydrophobicContact CD1-CD1 4.26Å; F133-I136 PolarHBondContact O-N 3.37Å; F133-R137 WeakPolarHBondContact O-CB 3.41Å; F133-R137 PolarHBondContact O-N 3.48Å; F133-L159 HydrophobicContact CD1-CD2 4.06Å; F133-I164 HydrophobicContact CB-CD1 4.43Å; F133-I175 HydrophobicContact CE2-CG2 3.88Å; F133-I175 HydrophobicContact CZ-CG2 4Å; F133-L178 HydrophobicContact CD1-CB 4.34Å; F133-L178 HydrophobicContact CD2-CD1 4.43Å; F133-L178 HydrophobicContact CE1-CB 3.62Å; F133-L178 HydrophobicContact CE2-CB 4.3Å; F133-L178 HydrophobicContact CE2-CD1 4.2Å; F133-L178 HydrophobicContact CZ-CB 3.6Å; F133-L178 HydrophobicContact CZ-CD1 4.33Å; F133-V182 HydrophobicContact CD1-CG2 4.35Å; F133-V182 HydrophobicContact CE1-CG2 4.24Å; F133-L211 HydrophobicContact CE1-CD2 4.23Å; F133-L211 HydrophobicContact CE2-CD2 4.48Å; F133-L211 HydrophobicContact CZ-CD2 3.93Å |
| 134 | E | 92.1 | Very high | 89.4 | Confident | 81 Ų | 81 | 45.6 Ų | 45.6 | 38% | 0.379 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -60.4 | -49.6 | 170.8 | -174 | 175.2 | -166.8 | 0 | 0 | 110.9 | I130 K131 L132 I136 R137 E138 T161 | I130-E134 PolarHBondContact O-N 3.03Å; K131-E134 WeakPolarHBondContact O-CB 3.37Å; K131-E134 PolarHBondContact O-N 3.23Å; L132-E134 VanDerWaalsContact C-N 3.34Å; E134-I136 PolarHBondContact O-N 3.21Å; E134-R137 WeakPolarHBondContact O-CB 3.48Å; E134-R137 PolarHBondContact O-N 3.49Å; E134-E138 PolarHBondContact O-N 3.16Å; E134-T161 HydrophobicContact CB-CG2 3.66Å; E134-T161 HydrophobicContact CG-CG2 3.8Å |
| 135 | E | 93.6 | Very high | 89.3 | Confident | 106 Ų | 106 | 48.2 Ų | 48.2 | 50% | 0.495 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -61.8 | -44.7 | 176.6 | -73 | -177.2 | -160.1 | 0 | 0 | 112.2 | K131 L132 R137 E138 I139 F215 | K131-E135 PolarHBondContact O-N 2.87Å; L132-E135 PolarHBondContact O-N 3.43Å; E135-R137 VanDerWaalsContact C-N 3.28Å; E135-R137 PolarHBondContact O-N 3.05Å; E135-E138 PolarHBondContact O-N 3.27Å; E135-I139 VanDerWaalsContact O-CG1 3.23Å; E135-I139 WeakPolarHBondContact O-CG1 3.25Å; E135-I139 PolarHBondContact O-N 2.89Å; E135-F215 HydrophobicContact CB-CE1 4.19Å; E135-F215 HydrophobicContact CB-CZ 4.03Å |
| 136 | I | 93.3 | Very high | 88.6 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58 | -43.8 | 175.7 | -71.8 | 164.9 | 0 | 0 | 0 | 110.3 | L132 F133 E134 I139 L140 L159 V182 L211 I214 F215 L218 | L132-I136 WeakPolarHBondContact O-CB 3.4Å; L132-I136 WeakPolarHBondContact O-CD1 3.49Å; L132-I136 WeakPolarHBondContact O-CG1 3.45Å; L132-I136 PolarHBondContact O-N 2.94Å; F133-I136 HydrophobicContact CD1-CD1 4.26Å; F133-I136 PolarHBondContact O-N 3.37Å; E134-I136 PolarHBondContact O-N 3.21Å; I136-I139 PolarHBondContact O-N 2.88Å; I136-L140 HydrophobicContact CG2-CD1 3.8Å; I136-L140 HydrophobicContact CG2-CG 4.2Å; I136-L140 WeakPolarHBondContact O-CB 3.19Å; I136-L140 VanDerWaalsContact O-CG 3.25Å; I136-L140 WeakPolarHBondContact O-CG 3.43Å; I136-L140 PolarHBondContact O-N 3.39Å; I136-L159 HydrophobicContact CG2-CD1 4.43Å; I136-V182 HydrophobicContact CG2-CB 4.38Å; I136-V182 HydrophobicContact CG2-CG1 3.64Å; I136-V182 HydrophobicContact CG2-CG2 3.76Å; I136-L211 HydrophobicContact CD1-CD2 4.28Å; I136-I214 HydrophobicContact CD1-CG2 3.92Å; I136-I214 HydrophobicContact CG1-CG2 4.25Å; I136-F215 HydrophobicContact CD1-CD2 4.39Å; I136-F215 HydrophobicContact CD1-CE2 3.7Å; I136-F215 HydrophobicContact CD1-CZ 4.25Å; I136-F215 HydrophobicContact CG1-CD2 4.39Å; I136-F215 HydrophobicContact CG1-CE1 4.49Å; I136-F215 HydrophobicContact CG1-CE2 3.64Å; I136-F215 HydrophobicContact CG1-CZ 3.72Å; I136-L218 HydrophobicContact CB-CD1 4.42Å; I136-L218 HydrophobicContact CG1-CD1 3.92Å; I136-L218 HydrophobicContact CG2-CD1 4.25Å |
| 137 | R | 93 | Very high | 87.7 | Confident | 44 Ų | 44 | 50.3 Ų | 50.3 | 17% | 0.166 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -57.5 | -52.4 | 177.2 | -175.2 | -171.4 | 84.4 | -169.9 | -2 | 110.6 | F133 E134 E135 I139 L140 L141 I155 L159 | F133-R137 WeakPolarHBondContact O-CB 3.41Å; F133-R137 PolarHBondContact O-N 3.48Å; E134-R137 WeakPolarHBondContact O-CB 3.48Å; E134-R137 PolarHBondContact O-N 3.49Å; E135-R137 VanDerWaalsContact C-N 3.28Å; E135-R137 PolarHBondContact O-N 3.05Å; R137-I139 VanDerWaalsContact C-N 3.32Å; R137-I139 PolarHBondContact O-N 2.99Å; R137-L140 PolarHBondContact O-N 3.31Å; R137-L141 HydrophobicContact CG-CD1 4.09Å; R137-L141 HydrophobicContact CG-CG 4.44Å; R137-L141 WeakPolarHBondContact O-CB 3.39Å; R137-L141 VanDerWaalsContact O-CG 3.27Å; R137-L141 WeakPolarHBondContact O-CG 3.46Å; R137-L141 PolarHBondContact O-N 3.25Å; R137-I155 HydrophobicContact CG-CG2 3.99Å; R137-L159 HydrophobicContact CB-CB 4.1Å; R137-L159 HydrophobicContact CB-CD1 4.09Å; R137-L159 WeakPolarHBondContact CD-O 3.07Å; R137-L159 HydrophobicContact CG-CB 4.1Å; R137-L159 HydrophobicContact CG-CD1 4.5Å |
| 138 | E | 93.3 | Very high | 87.1 | Confident | 92 Ų | 92 | 46.8 Ų | 46.8 | 43% | 0.43 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -61.8 | -40.5 | -178.8 | -65 | -50.9 | 134.9 | 0 | 0 | 112 | E134 E135 L141 S142 | E134-E138 PolarHBondContact O-N 3.16Å; E135-E138 PolarHBondContact O-N 3.27Å; E138-L141 PolarHBondContact O-N 3.4Å; E138-S142 PolarHBondContact O-N 2.83Å |
| 139 | I | 92.1 | Very high | 86.8 | Confident | 19 Ų | 19 | 49 Ų | 49 | 10% | 0.097 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63 | -47.9 | 175.7 | -64.8 | 165.3 | 0 | 0 | 0 | 110.8 | E135 I136 R137 L141 S142 F143 F215 L218 K222 | E135-I139 VanDerWaalsContact O-CG1 3.23Å; E135-I139 WeakPolarHBondContact O-CG1 3.25Å; E135-I139 PolarHBondContact O-N 2.89Å; I136-I139 PolarHBondContact O-N 2.88Å; R137-I139 VanDerWaalsContact C-N 3.32Å; R137-I139 PolarHBondContact O-N 2.99Å; I139-L141 VanDerWaalsContact C-N 3.29Å; I139-L141 PolarHBondContact O-N 3.34Å; I139-S142 WeakPolarHBondContact O-CB 3.45Å; I139-S142 PolarHBondContact O-N 2.95Å; I139-S142 VanDerWaalsContact O-N 3.11Å; I139-S142 PolarHBondContact O-OG 3.49Å; I139-F143 HydrophobicContact CG2-CE1 4.5Å; I139-F143 HydrophobicContact CG2-CE2 3.73Å; I139-F143 HydrophobicContact CG2-CZ 3.66Å; I139-F143 PolarHBondContact O-N 3.38Å; I139-F215 HydrophobicContact CD1-CE1 4.19Å; I139-L218 HydrophobicContact CD1-CD1 4.39Å; I139-L218 HydrophobicContact CG2-CB 4.23Å; I139-L218 HydrophobicContact CG2-CD1 4.41Å; I139-L218 HydrophobicContact CG2-CD2 4.02Å; I139-L218 HydrophobicContact CG2-CG 4.46Å; I139-K222 VanDerWaalsContact CG2-CE 3.5Å; I139-K222 HydrophobicContact CG2-CG 4.45Å |
| 140 | L | 91.3 | Very high | 86.7 | Confident | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.3 | -39.3 | 178.7 | -71.6 | 174.7 | 0 | 0 | 0 | 111.9 | I136 R137 S142 F143 I155 L159 V182 T185 M186 L189 L218 | I136-L140 HydrophobicContact CG2-CD1 3.8Å; I136-L140 HydrophobicContact CG2-CG 4.2Å; I136-L140 WeakPolarHBondContact O-CB 3.19Å; I136-L140 VanDerWaalsContact O-CG 3.25Å; I136-L140 WeakPolarHBondContact O-CG 3.43Å; I136-L140 PolarHBondContact O-N 3.39Å; R137-L140 PolarHBondContact O-N 3.31Å; L140-S142 VanDerWaalsContact C-N 3.31Å; L140-S142 PolarHBondContact O-N 3.37Å; L140-F143 PolarHBondContact O-N 2.92Å; L140-I155 HydrophobicContact CB-CD1 4.32Å; L140-L159 HydrophobicContact CD1-CD1 4.14Å; L140-V182 HydrophobicContact CD1-CG1 4.47Å; L140-T185 HydrophobicContact CD1-CG2 4.32Å; L140-T185 HydrophobicContact CD2-CG2 4.46Å; L140-M186 HydrophobicContact CD2-CG 3.96Å; L140-L189 HydrophobicContact CD2-CD1 4.19Å; L140-L218 HydrophobicContact CD2-CD2 3.93Å |
| 141 | L | 91 | Very high | 86.6 | Confident | 11 Ų | 11 | 59.9 Ų | 59.9 | 6% | 0.058 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -65.9 | -33.5 | 175.9 | -70.2 | 178.7 | 0 | 0 | 0 | 112.3 | R137 E138 I139 F143 L144 R152 I155 | R137-L141 HydrophobicContact CG-CD1 4.09Å; R137-L141 HydrophobicContact CG-CG 4.44Å; R137-L141 WeakPolarHBondContact O-CB 3.39Å; R137-L141 VanDerWaalsContact O-CG 3.27Å; R137-L141 WeakPolarHBondContact O-CG 3.46Å; R137-L141 PolarHBondContact O-N 3.25Å; E138-L141 PolarHBondContact O-N 3.4Å; I139-L141 VanDerWaalsContact C-N 3.29Å; I139-L141 PolarHBondContact O-N 3.34Å; L141-F143 PolarHBondContact O-N 2.96Å; L141-L144 HydrophobicContact CD2-CD1 3.89Å; L141-L144 PolarHBondContact O-N 2.84Å; L141-L144 VanDerWaalsContact O-N 3.15Å; L141-R152 HydrophobicContact CD2-CB 4.23Å; L141-R152 HydrophobicContact CD2-CG 3.89Å; L141-I155 HydrophobicContact CD2-CB 4.29Å; L141-I155 HydrophobicContact CD2-CG2 4.04Å; L141-I155 HydrophobicContact CG-CG2 4.25Å |
| 142 | S | 90 | Very high | 86.6 | Confident | 82 Ų | 82 | 60 Ų | 60 | 57% | 0.573 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -64.5 | -24 | 177.8 | 80.7 | 0 | 0 | 0 | 0 | 113.5 | E138 I139 L140 L144 | E138-S142 PolarHBondContact O-N 2.83Å; I139-S142 WeakPolarHBondContact O-CB 3.45Å; I139-S142 PolarHBondContact O-N 2.95Å; I139-S142 VanDerWaalsContact O-N 3.11Å; I139-S142 PolarHBondContact O-OG 3.49Å; L140-S142 VanDerWaalsContact C-N 3.31Å; L140-S142 PolarHBondContact O-N 3.37Å; S142-L144 VanDerWaalsContact C-N 3.33Å |
| 143 | F | 88.3 | Confident | 86.6 | Confident | 19 Ų | 19 | 64.1 Ų | 64.1 | 8% | 0.083 | 35% | 0.345 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.4 | -12.7 | 176.7 | -60.2 | -36.1 | 0 | 0 | 0 | 113.9 | I139 L140 L141 L218 M221 K222 M225 | I139-F143 HydrophobicContact CG2-CE1 4.5Å; I139-F143 HydrophobicContact CG2-CE2 3.73Å; I139-F143 HydrophobicContact CG2-CZ 3.66Å; I139-F143 PolarHBondContact O-N 3.38Å; L140-F143 PolarHBondContact O-N 2.92Å; L141-F143 PolarHBondContact O-N 2.96Å; F143-L218 HydrophobicContact CE2-CD2 3.98Å; F143-M221 HydrophobicContact CD2-CE 4Å; F143-M221 HydrophobicContact CE2-CB 3.98Å; F143-M221 HydrophobicContact CE2-CE 3.83Å; F143-M221 HydrophobicContact CZ-CB 3.77Å; F143-K222 HydrophobicContact CE1-CB 4.28Å; F143-K222 HydrophobicContact CE1-CG 3.71Å; F143-K222 HydrophobicContact CZ-CB 4.47Å; F143-K222 HydrophobicContact CZ-CG 3.69Å; F143-M225 HydrophobicContact CB-CE 3.8Å; F143-M225 HydrophobicContact CD1-CB 4.34Å; F143-M225 HydrophobicContact CD1-CE 3.95Å; F143-M225 HydrophobicContact CD1-CG 4.34Å; F143-M225 HydrophobicContact CE1-CB 4.47Å; F143-M225 HydrophobicContact CG-CE 4.13Å |
| 144 | L | 86.6 | Confident | 86.5 | Confident | 27 Ų | 27 | 67.5 Ų | 67.5 | 14% | 0.141 | 36% | 0.36 | C | S | . | . | S | Bend | trans | -83.8 | 127.8 | -175.7 | -58.8 | -179.5 | 0 | 0 | 0 | 111.3 | L141 S142 L151 R152 I155 L189 | L141-L144 HydrophobicContact CD2-CD1 3.89Å; L141-L144 PolarHBondContact O-N 2.84Å; L141-L144 VanDerWaalsContact O-N 3.15Å; S142-L144 VanDerWaalsContact C-N 3.33Å; L144-L151 HydrophobicContact CD2-CD2 3.78Å; L144-L151 HydrophobicContact CD2-CG 4.26Å; L144-R152 HydrophobicContact CD1-CB 3.76Å; L144-I155 HydrophobicContact CD1-CD1 4.15Å; L144-L189 HydrophobicContact CD2-CD1 4.29Å; L144-L189 HydrophobicContact CD2-CD2 3.83Å |
| 145 | T | 78.5 | Confident | 86.4 | Confident | 108 Ų | 108 | 63.6 Ų | 63.6 | 66% | 0.663 | 34% | 0.342 | S | S | * | . | trans | -64 | 154.7 | 168 | 46.2 | 0 | 0 | 0 | 0 | 112.1 | G147 G148 | T145-G147 PolarHBondContact O-N 3.1Å; T145-G148 PolarHBondContact O-N 3.26Å | ||
| 146 | P | 70.3 | Confident | 86.2 | Confident | 132 Ų | 132 | 60.7 Ų | 60.7 | 86% | 0.857 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.6 | -8.7 | -177 | -26 | 34 | 0 | 0 | 0 | 117.2 | ||
| 147 | G | 66.7 | Low | 86.1 | Confident | 66 Ų | 66 | 67.2 Ų | 67.2 | 68% | 0.68 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.9 | -4.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | T145 N149 | T145-G147 PolarHBondContact O-N 3.1Å; G147-N149 PolarHBondContact O-N 2.9Å |
| 148 | G | 73.7 | Confident | 85.9 | Confident | 23 Ų | 23 | 67.8 Ų | 67.8 | 24% | 0.237 | 37% | 0.372 | C | S | . | . | trans | -79.9 | 34 | -172.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | T145 R150 L151 R152 | T145-G148 PolarHBondContact O-N 3.26Å; G148-R150 VanDerWaalsContact C-N 3.29Å; G148-R150 PolarHBondContact O-N 3.25Å; G148-L151 PolarHBondContact O-N 3.41Å; G148-R152 PolarHBondContact O-N 3.37Å | ||
| 149 | N | 79.7 | Confident | 85.8 | Confident | 98 Ų | 98 | 63.4 Ų | 63.4 | 52% | 0.524 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -59.3 | -34.4 | -167.3 | -67.7 | -24.8 | 0 | 0 | 0 | 114 | G147 N153 | G147-N149 PolarHBondContact O-N 2.9Å; N149-N153 WeakPolarHBondContact O-CB 3.43Å; N149-N153 PolarHBondContact O-N 3.05Å; N149-N153 PolarHBondContact O-OD1 3.37Å |
| 150 | R | 86.4 | Confident | 85.7 | Confident | 200 Ų | 200 | 65.3 Ų | 65.3 | 76% | 0.755 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -65.4 | -47.5 | 178.9 | -176 | 179.8 | 175.8 | -177.3 | 0.7 | 112.5 | G148 N153 Q154 | G148-R150 VanDerWaalsContact C-N 3.29Å; G148-R150 PolarHBondContact O-N 3.25Å; R150-N153 PolarHBondContact O-N 3.1Å; R150-Q154 WeakPolarHBondContact O-CG 3.35Å; R150-Q154 PolarHBondContact O-N 3.21Å; R150-Q154 VanDerWaalsContact O-N 3.13Å |
| 151 | L | 86.8 | Confident | 85.6 | Confident | 38 Ų | 38 | 66.1 Ų | 66.1 | 20% | 0.199 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -72.2 | -36.9 | -179.8 | -176.6 | 59.2 | 0 | 0 | 0 | 110.9 | L144 G148 N153 Q154 I155 L189 | L144-L151 HydrophobicContact CD2-CD2 3.78Å; L144-L151 HydrophobicContact CD2-CG 4.26Å; G148-L151 PolarHBondContact O-N 3.41Å; L151-N153 PolarHBondContact O-N 3.12Å; L151-Q154 PolarHBondContact O-N 3.27Å; L151-I155 HydrophobicContact CD1-CD1 4.27Å; L151-I155 HydrophobicContact CD1-CG1 4.39Å; L151-I155 HydrophobicContact CG-CD1 3.94Å; L151-I155 WeakPolarHBondContact O-CG1 3.36Å; L151-I155 PolarHBondContact O-N 3.15Å; L151-L189 HydrophobicContact CD2-CD2 3.84Å; L151-L189 HydrophobicContact CD2-CG 4.44Å |
| 152 | R | 89.9 | Confident | 85.5 | Confident | 106 Ų | 106 | 69.9 Ų | 69.9 | 40% | 0.4 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -53.7 | -51.9 | 170.5 | 169.1 | 176.7 | -86.6 | -86 | 3.7 | 111.2 | L141 L144 G148 Q154 I155 C156 | L141-R152 HydrophobicContact CD2-CB 4.23Å; L141-R152 HydrophobicContact CD2-CG 3.89Å; L144-R152 HydrophobicContact CD1-CB 3.76Å; G148-R152 PolarHBondContact O-N 3.37Å; R152-Q154 PolarHBondContact O-N 2.93Å; R152-I155 PolarHBondContact O-N 3.32Å; R152-C156 PolarHBondContact O-N 3.24Å; R152-C156 PolarHBondContact O-SG 3.48Å |
| 153 | N | 90.1 | Very high | 85.4 | Confident | 91 Ų | 91 | 69.4 Ų | 69.4 | 49% | 0.487 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.7 | -43.8 | -179.9 | -67.8 | -3.3 | 0 | 0 | 0 | 111.6 | N149 R150 L151 I155 C156 E157 | N149-N153 WeakPolarHBondContact O-CB 3.43Å; N149-N153 PolarHBondContact O-N 3.05Å; N149-N153 PolarHBondContact O-OD1 3.37Å; R150-N153 PolarHBondContact O-N 3.1Å; L151-N153 PolarHBondContact O-N 3.12Å; N153-I155 VanDerWaalsContact C-N 3.33Å; N153-I155 PolarHBondContact O-N 3.5Å; N153-C156 PolarHBondContact O-N 2.96Å; N153-E157 WeakPolarHBondContact O-CB 3.36Å; N153-E157 VanDerWaalsContact O-CG 3.31Å; N153-E157 WeakPolarHBondContact O-CG 3.27Å; N153-E157 PolarHBondContact O-N 2.82Å |
| 154 | Q | 90 | Very high | 85.5 | Confident | 74 Ų | 74 | 68.7 Ų | 68.7 | 35% | 0.346 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -60.4 | -40.8 | 176.4 | -72.9 | 179.6 | -22.9 | 0 | 0 | 112.8 | R150 L151 R152 V158 Y181 | R150-Q154 WeakPolarHBondContact O-CG 3.35Å; R150-Q154 PolarHBondContact O-N 3.21Å; R150-Q154 VanDerWaalsContact O-N 3.13Å; L151-Q154 PolarHBondContact O-N 3.27Å; R152-Q154 PolarHBondContact O-N 2.93Å; Q154-V158 WeakPolarHBondContact O-CG2 3.48Å; Q154-V158 PolarHBondContact O-N 2.84Å; Q154-V158 VanDerWaalsContact O-N 3.14Å; Q154-Y181 PolarHBondContact O-OH 3.43Å; Q154-Y181 VanDerWaalsContact O-OH 3.09Å |
| 155 | I | 90 | Very high | 85.5 | Confident | 0 Ų | 0 | 71.5 Ų | 71.5 | 0% | 0 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -65.2 | -45.8 | 176.3 | -71.1 | 165.6 | 0 | 0 | 0 | 110.4 | R137 L140 L141 L144 L151 R152 N153 E157 L159 T185 | R137-I155 HydrophobicContact CG-CG2 3.99Å; L140-I155 HydrophobicContact CB-CD1 4.32Å; L141-I155 HydrophobicContact CD2-CB 4.29Å; L141-I155 HydrophobicContact CD2-CG2 4.04Å; L141-I155 HydrophobicContact CG-CG2 4.25Å; L144-I155 HydrophobicContact CD1-CD1 4.15Å; L151-I155 HydrophobicContact CD1-CD1 4.27Å; L151-I155 HydrophobicContact CD1-CG1 4.39Å; L151-I155 HydrophobicContact CG-CD1 3.94Å; L151-I155 WeakPolarHBondContact O-CG1 3.36Å; L151-I155 PolarHBondContact O-N 3.15Å; R152-I155 PolarHBondContact O-N 3.32Å; N153-I155 VanDerWaalsContact C-N 3.33Å; N153-I155 PolarHBondContact O-N 3.5Å; I155-E157 PolarHBondContact O-N 3.41Å; I155-L159 HydrophobicContact CG2-CD1 4.25Å; I155-L159 WeakPolarHBondContact O-CB 3.27Å; I155-L159 PolarHBondContact O-N 3.23Å; I155-T185 HydrophobicContact CD1-CG2 3.86Å; I155-T185 HydrophobicContact CG1-CG2 4.07Å |
| 156 | C | 89.8 | Confident | 85.9 | Confident | 45 Ų | 45 | 71.7 Ų | 71.7 | 30% | 0.304 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -65.2 | -36.4 | 178.9 | -65.7 | 0 | 0 | 0 | 0 | 113.2 | R152 N153 D160 | R152-C156 PolarHBondContact O-N 3.24Å; R152-C156 PolarHBondContact O-SG 3.48Å; N153-C156 PolarHBondContact O-N 2.96Å; C156-D160 PolarHBondContact O-N 3.33Å |
| 157 | E | 90.9 | Very high | 86.7 | Confident | 136 Ų | 136 | 68.5 Ų | 68.5 | 64% | 0.636 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -70.3 | -41.5 | 178.8 | -76 | 172.6 | -174.5 | 0 | 0 | 112.5 | N153 I155 | N153-E157 WeakPolarHBondContact O-CB 3.36Å; N153-E157 VanDerWaalsContact O-CG 3.31Å; N153-E157 WeakPolarHBondContact O-CG 3.27Å; N153-E157 PolarHBondContact O-N 2.82Å; I155-E157 PolarHBondContact O-N 3.41Å |
| 158 | V | 88.9 | Confident | 87.6 | Confident | 57 Ų | 57 | 66.1 Ų | 66.1 | 35% | 0.345 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -81.8 | -37.5 | -177.4 | 177.6 | 0 | 0 | 0 | 0 | 111.9 | Q154 D160 L178 Y181 | Q154-V158 WeakPolarHBondContact O-CG2 3.48Å; Q154-V158 PolarHBondContact O-N 2.84Å; Q154-V158 VanDerWaalsContact O-N 3.14Å; V158-D160 PolarHBondContact O-N 2.9Å; V158-L178 HydrophobicContact CG1-CD2 4.31Å; V158-Y181 HydrophobicContact CB-CD1 4.07Å; V158-Y181 HydrophobicContact CB-CE1 3.66Å; V158-Y181 HydrophobicContact CB-CE2 4.36Å; V158-Y181 HydrophobicContact CG1-CD1 3.48Å; V158-Y181 VanDerWaalsContact CG1-CD1 3.48Å; V158-Y181 HydrophobicContact CG1-CD2 4.13Å; V158-Y181 HydrophobicContact CG1-CE1 3.63Å; V158-Y181 HydrophobicContact CG1-CE2 4.27Å; V158-Y181 HydrophobicContact CG1-CG 3.73Å; V158-Y181 HydrophobicContact CG2-CE1 4.21Å; V158-Y181 HydrophobicContact CG2-CE2 4.05Å |
| 159 | L | 90.5 | Very high | 88.2 | Confident | 0 Ų | 0 | 71.6 Ų | 71.6 | 0% | 0 | 34% | 0.344 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -99.8 | 47.2 | 177.1 | -57.3 | 178.8 | 0 | 0 | 0 | 111 | F133 I136 R137 L140 I155 T161 L178 Y181 V182 | F133-L159 HydrophobicContact CD1-CD2 4.06Å; I136-L159 HydrophobicContact CG2-CD1 4.43Å; R137-L159 HydrophobicContact CB-CB 4.1Å; R137-L159 HydrophobicContact CB-CD1 4.09Å; R137-L159 WeakPolarHBondContact CD-O 3.07Å; R137-L159 HydrophobicContact CG-CB 4.1Å; R137-L159 HydrophobicContact CG-CD1 4.5Å; L140-L159 HydrophobicContact CD1-CD1 4.14Å; I155-L159 HydrophobicContact CG2-CD1 4.25Å; I155-L159 WeakPolarHBondContact O-CB 3.27Å; I155-L159 PolarHBondContact O-N 3.23Å; L159-T161 PolarHBondContact O-N 3.24Å; L159-L178 HydrophobicContact CD2-CD2 4.1Å; L159-Y181 HydrophobicContact CD2-CD1 4.5Å; L159-Y181 HydrophobicContact CG-CD1 4.5Å; L159-Y181 HydrophobicContact CG-CE1 4.44Å; L159-V182 HydrophobicContact CD1-CG2 4.09Å; L159-V182 HydrophobicContact CD2-CG2 4.14Å |
| 160 | D | 91.4 | Very high | 88.4 | Confident | 59 Ų | 59 | 73.9 Ų | 73.9 | 32% | 0.316 | 35% | 0.351 | S | S | . | . | trans | -80.1 | 114 | 174 | -174 | -28.9 | 0 | 0 | 0 | 109.8 | C156 V158 D162 L163 I164 | C156-D160 PolarHBondContact O-N 3.33Å; V158-D160 PolarHBondContact O-N 2.9Å; D160-D162 VanDerWaalsContact C-N 3.3Å; D160-D162 PolarHBondContact O-N 2.84Å; D160-D162 PolarHBondContact OD1-N 3.27Å; D160-L163 HydrophobicContact CB-CB 3.87Å; D160-L163 PolarHBondContact O-N 3.48Å; D160-L163 PolarHBondContact OD1-N 2.92Å; D160-I164 WeakPolarHBondContact O-CG1 3.41Å; D160-I164 PolarHBondContact O-N 3.26Å | ||
| 161 | T | 88.5 | Confident | 88.1 | Confident | 17 Ų | 17 | 69.3 Ų | 69.3 | 10% | 0.104 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60.6 | -37.2 | -177.8 | 44.7 | 0 | 0 | 0 | 0 | 113.1 | E134 L159 R165 | E134-T161 HydrophobicContact CB-CG2 3.66Å; E134-T161 HydrophobicContact CG-CG2 3.8Å; L159-T161 PolarHBondContact O-N 3.24Å; T161-R165 WeakPolarHBondContact O-CB 3.39Å; T161-R165 PolarHBondContact O-N 2.64Å |
| 162 | D | 88.5 | Confident | 87.9 | Confident | 89 Ų | 89 | 70.7 Ų | 70.7 | 48% | 0.476 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -75.4 | -37.5 | -178.4 | -67.8 | -33.3 | 0 | 0 | 0 | 110.5 | D160 R165 Q166 | D160-D162 VanDerWaalsContact C-N 3.3Å; D160-D162 PolarHBondContact O-N 2.84Å; D160-D162 PolarHBondContact OD1-N 3.27Å; D162-R165 PolarHBondContact O-N 3.48Å; D162-R165 IonicContact OD1-NH1 2.89Å; D162-R165 PolarHBondContact OD1-NH1 2.98Å; D162-Q166 VanDerWaalsContact O-CG 3.27Å; D162-Q166 WeakPolarHBondContact O-CG 3.46Å; D162-Q166 PolarHBondContact O-N 3.15Å |
| 163 | L | 89 | Confident | 87.7 | Confident | 72 Ų | 72 | 66.9 Ų | 66.9 | 38% | 0.377 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -66 | -44.1 | 174 | -176.2 | 69.2 | 0 | 0 | 0 | 111.7 | D160 R165 Q166 Q167 | D160-L163 HydrophobicContact CB-CB 3.87Å; D160-L163 PolarHBondContact O-N 3.48Å; D160-L163 PolarHBondContact OD1-N 2.92Å; L163-R165 VanDerWaalsContact C-N 3.32Å; L163-R165 PolarHBondContact O-N 3.11Å; L163-Q166 PolarHBondContact O-N 3.3Å; L163-Q167 VanDerWaalsContact O-CG 3.31Å; L163-Q167 WeakPolarHBondContact O-CG 3.25Å; L163-Q167 PolarHBondContact O-N 3.44Å |
| 164 | I | 88.8 | Confident | 87.5 | Confident | 5 Ų | 5 | 67.2 Ų | 67.2 | 3% | 0.026 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -63.3 | -41.4 | 177.6 | -64 | 164.6 | 0 | 0 | 0 | 110 | I130 F133 D160 Q167 A168 V173 L178 | I130-I164 HydrophobicContact CG1-CG2 3.9Å; F133-I164 HydrophobicContact CB-CD1 4.43Å; D160-I164 WeakPolarHBondContact O-CG1 3.41Å; D160-I164 PolarHBondContact O-N 3.26Å; I164-Q167 PolarHBondContact O-N 2.94Å; I164-A168 WeakPolarHBondContact O-CB 3.39Å; I164-A168 PolarHBondContact O-N 2.86Å; I164-V173 HydrophobicContact CG2-CG1 4.31Å; I164-V173 HydrophobicContact CG2-CG2 4.42Å; I164-V173 WeakPolarHBondContact O-CG2 3.45Å; I164-L178 HydrophobicContact CD1-CD1 3.99Å; I164-L178 HydrophobicContact CD1-CD2 4.39Å; I164-L178 HydrophobicContact CG1-CD1 4.07Å; I164-L178 HydrophobicContact CG2-CD1 4.3Å |
| 165 | R | 87.4 | Confident | 87.3 | Confident | 86 Ų | 86 | 64.7 Ų | 64.7 | 33% | 0.325 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -60.8 | -46.1 | 175.4 | -170.8 | -177.1 | -63 | 117.5 | 3.7 | 111.8 | I130 T161 D162 L163 Q167 A168 E169 | I130-R165 HydrophobicContact CD1-CB 4.19Å; I130-R165 HydrophobicContact CD1-CG 4.36Å; T161-R165 WeakPolarHBondContact O-CB 3.39Å; T161-R165 PolarHBondContact O-N 2.64Å; D162-R165 PolarHBondContact O-N 3.48Å; D162-R165 IonicContact OD1-NH1 2.89Å; D162-R165 PolarHBondContact OD1-NH1 2.98Å; L163-R165 VanDerWaalsContact C-N 3.32Å; L163-R165 PolarHBondContact O-N 3.11Å; R165-Q167 VanDerWaalsContact C-N 3.34Å; R165-Q167 PolarHBondContact O-N 3.39Å; R165-A168 WeakPolarHBondContact O-CB 3.44Å; R165-A168 PolarHBondContact O-N 3.5Å; R165-A168 VanDerWaalsContact O-N 3.07Å; R165-E169 PolarHBondContact O-N 3.39Å; R165-E169 VanDerWaalsContact O-N 3.08Å |
| 166 | Q | 86.9 | Confident | 87.1 | Confident | 111 Ų | 111 | 68 Ų | 68 | 52% | 0.519 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -61.5 | -42 | 176.8 | -74.1 | 173.1 | 9.3 | 0 | 0 | 112.3 | D162 L163 A168 H170 | D162-Q166 VanDerWaalsContact O-CG 3.27Å; D162-Q166 WeakPolarHBondContact O-CG 3.46Å; D162-Q166 PolarHBondContact O-N 3.15Å; L163-Q166 PolarHBondContact O-N 3.3Å; Q166-A168 PolarHBondContact O-N 2.89Å; Q166-H170 PolarHBondContact O-CD2 2.9Å; Q166-H170 PolarHBondContact O-N 2.98Å |
| 167 | Q | 86.5 | Confident | 87.1 | Confident | 66 Ų | 66 | 67.1 Ų | 67.1 | 31% | 0.308 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.6 | -33.5 | 175 | -72.2 | 172.6 | -0.8 | 0 | 0 | 111.4 | L163 I164 R165 H170 S171 A172 V173 | L163-Q167 VanDerWaalsContact O-CG 3.31Å; L163-Q167 WeakPolarHBondContact O-CG 3.25Å; L163-Q167 PolarHBondContact O-N 3.44Å; I164-Q167 PolarHBondContact O-N 2.94Å; R165-Q167 VanDerWaalsContact C-N 3.34Å; R165-Q167 PolarHBondContact O-N 3.39Å; Q167-H170 CarbonylContact O-C 3.51Å; Q167-H170 PolarHBondContact O-N 3.48Å; Q167-S171 PolarHBondContact O-N 3.17Å; Q167-A172 PolarHBondContact O-N 2.9Å; Q167-V173 HydrophobicContact CB-CB 4.45Å; Q167-V173 HydrophobicContact CB-CG2 3.44Å; Q167-V173 VanDerWaalsContact CB-CG2 3.44Å |
| 168 | A | 85.6 | Confident | 87 | Confident | 15 Ų | 15 | 61.4 Ų | 61.4 | 12% | 0.124 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -68.7 | -45.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111 | F126 I130 I164 R165 Q166 H170 S171 V173 | F126-A168 HydrophobicContact CB-CB 4.03Å; F126-A168 HydrophobicContact CD2-CB 3.77Å; F126-A168 HydrophobicContact CG-CB 4.21Å; I130-A168 HydrophobicContact CD1-CB 4.29Å; I164-A168 WeakPolarHBondContact O-CB 3.39Å; I164-A168 PolarHBondContact O-N 2.86Å; R165-A168 WeakPolarHBondContact O-CB 3.44Å; R165-A168 PolarHBondContact O-N 3.5Å; R165-A168 VanDerWaalsContact O-N 3.07Å; Q166-A168 PolarHBondContact O-N 2.89Å; A168-H170 PolarHBondContact O-N 3.16Å; A168-S171 PolarHBondContact O-N 3.44Å; A168-V173 HydrophobicContact CB-CG2 3.73Å |
| 169 | E | 86.1 | Confident | 87.1 | Confident | 138 Ų | 138 | 58.7 Ų | 58.7 | 65% | 0.645 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -58 | -29.8 | 175.7 | -69.7 | 174.6 | -171 | 0 | 0 | 112.6 | R165 | R165-E169 PolarHBondContact O-N 3.39Å; R165-E169 VanDerWaalsContact O-N 3.08Å |
| 170 | H | 84.8 | Confident | 87.1 | Confident | 147 Ų | 147 | 62.4 Ų | 62.4 | 68% | 0.681 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.5 | 9.2 | 177.8 | -66.3 | -54 | 0 | 0 | 0 | 114.4 | Q166 Q167 A168 A172 | Q166-H170 PolarHBondContact O-CD2 2.9Å; Q166-H170 PolarHBondContact O-N 2.98Å; Q167-H170 CarbonylContact O-C 3.51Å; Q167-H170 PolarHBondContact O-N 3.48Å; A168-H170 PolarHBondContact O-N 3.16Å; H170-A172 PolarHBondContact O-N 3.32Å |
| 171 | S | 79 | Confident | 87.2 | Confident | 103 Ų | 103 | 62 Ų | 62 | 72% | 0.72 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.7 | 36.6 | -179.1 | -55.7 | 0 | 0 | 0 | 0 | 113.9 | Q167 A168 | Q167-S171 PolarHBondContact O-N 3.17Å; A168-S171 PolarHBondContact O-N 3.44Å |
| 172 | A | 83.7 | Confident | 87.4 | Confident | 68 Ų | 68 | 61.2 Ų | 61.2 | 56% | 0.562 | 33% | 0.326 | S | S | * | . | trans | -117.2 | 4 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114 | Q167 H170 | Q167-A172 PolarHBondContact O-N 2.9Å; H170-A172 PolarHBondContact O-N 3.32Å | ||
| 173 | V | 85.1 | Confident | 87.6 | Confident | 26 Ų | 26 | 57 Ų | 57 | 16% | 0.158 | 30% | 0.303 | C | S | . | . | trans | -71 | 129.4 | -179.5 | -179.8 | 0 | 0 | 0 | 0 | 111 | I164 Q167 A168 I175 L178 | I164-V173 HydrophobicContact CG2-CG1 4.31Å; I164-V173 HydrophobicContact CG2-CG2 4.42Å; I164-V173 WeakPolarHBondContact O-CG2 3.45Å; Q167-V173 HydrophobicContact CB-CB 4.45Å; Q167-V173 HydrophobicContact CB-CG2 3.44Å; Q167-V173 VanDerWaalsContact CB-CG2 3.44Å; A168-V173 HydrophobicContact CB-CG2 3.73Å; V173-I175 HydrophobicContact CG1-CG1 3.81Å; V173-L178 HydrophobicContact CG1-CD1 4.16Å | ||
| 174 | D | 85.9 | Confident | 87.7 | Confident | 98 Ų | 98 | 56 Ų | 56 | 52% | 0.524 | 30% | 0.302 | S | S | . | . | trans | -100.2 | 87.8 | 168 | -178.6 | 10.8 | 0 | 0 | 0 | 110.7 | Q176 G177 L178 | D174-Q176 VanDerWaalsContact C-N 3.26Å; D174-Q176 PolarHBondContact O-N 2.95Å; D174-Q176 PolarHBondContact OD1-N 2.9Å; D174-G177 VanDerWaalsContact CG-N 3.27Å; D174-G177 PolarHBondContact O-N 3.44Å; D174-G177 PolarHBondContact OD1-N 3.18Å; D174-G177 WeakPolarHBondContact OD2-CA 3.26Å; D174-G177 PolarHBondContact OD2-N 3.31Å; D174-L178 WeakPolarHBondContact O-CG 3.44Å; D174-L178 PolarHBondContact O-N 3.4Å | ||
| 175 | I | 85.6 | Confident | 87.9 | Confident | 20 Ų | 20 | 55.8 Ų | 55.8 | 10% | 0.103 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.3 | -36.9 | 178.7 | -53.3 | -178 | 0 | 0 | 0 | 110.8 | L119 F126 F133 V173 L178 A179 I207 | L119-I175 HydrophobicContact CD2-CD1 3.61Å; F126-I175 HydrophobicContact CD1-CD1 3.62Å; F126-I175 HydrophobicContact CE1-CD1 3.55Å; F126-I175 HydrophobicContact CE1-CG1 4.41Å; F133-I175 HydrophobicContact CE2-CG2 3.88Å; F133-I175 HydrophobicContact CZ-CG2 4Å; V173-I175 HydrophobicContact CG1-CG1 3.81Å; I175-L178 PolarHBondContact O-N 3.43Å; I175-A179 WeakPolarHBondContact O-CB 3.44Å; I175-A179 PolarHBondContact O-N 2.85Å; I175-I207 HydrophobicContact CB-CD1 4.45Å; I175-I207 HydrophobicContact CB-CG1 4.33Å; I175-I207 HydrophobicContact CG2-CD1 3.7Å; I175-I207 HydrophobicContact CG2-CG1 3.57Å |
| 176 | Q | 86.9 | Confident | 88.1 | Confident | 71 Ų | 71 | 51.7 Ų | 51.7 | 33% | 0.332 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -67.2 | -41.1 | 179.8 | -169.4 | 67.5 | 38.4 | 0 | 0 | 110.9 | D174 A179 N180 | D174-Q176 VanDerWaalsContact C-N 3.26Å; D174-Q176 PolarHBondContact O-N 2.95Å; D174-Q176 PolarHBondContact OD1-N 2.9Å; Q176-A179 PolarHBondContact O-N 3.31Å; Q176-N180 WeakPolarHBondContact O-CB 3.23Å; Q176-N180 PolarHBondContact O-N 3.48Å; Q176-N180 PolarHBondContact O-ND2 3.39Å; Q176-N180 VanDerWaalsContact O-ND2 3.14Å |
| 177 | G | 88.3 | Confident | 88.3 | Confident | 25 Ų | 25 | 48 Ų | 48 | 26% | 0.258 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.1 | -45.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | D174 N180 Y181 | D174-G177 VanDerWaalsContact CG-N 3.27Å; D174-G177 PolarHBondContact O-N 3.44Å; D174-G177 PolarHBondContact OD1-N 3.18Å; D174-G177 WeakPolarHBondContact OD2-CA 3.26Å; D174-G177 PolarHBondContact OD2-N 3.31Å; G177-N180 PolarHBondContact O-N 2.89Å; G177-Y181 PolarHBondContact O-N 2.96Å |
| 178 | L | 90.2 | Very high | 88.5 | Confident | 17 Ų | 17 | 51.5 Ų | 51.5 | 9% | 0.089 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -62.6 | -45.9 | 175.9 | -68.5 | 171.1 | 0 | 0 | 0 | 111.8 | F133 V158 L159 I164 V173 D174 I175 N180 Y181 V182 | F133-L178 HydrophobicContact CD1-CB 4.34Å; F133-L178 HydrophobicContact CD2-CD1 4.43Å; F133-L178 HydrophobicContact CE1-CB 3.62Å; F133-L178 HydrophobicContact CE2-CB 4.3Å; F133-L178 HydrophobicContact CE2-CD1 4.2Å; F133-L178 HydrophobicContact CZ-CB 3.6Å; F133-L178 HydrophobicContact CZ-CD1 4.33Å; V158-L178 HydrophobicContact CG1-CD2 4.31Å; L159-L178 HydrophobicContact CD2-CD2 4.1Å; I164-L178 HydrophobicContact CD1-CD1 3.99Å; I164-L178 HydrophobicContact CD1-CD2 4.39Å; I164-L178 HydrophobicContact CG1-CD1 4.07Å; I164-L178 HydrophobicContact CG2-CD1 4.3Å; V173-L178 HydrophobicContact CG1-CD1 4.16Å; D174-L178 WeakPolarHBondContact O-CG 3.44Å; D174-L178 PolarHBondContact O-N 3.4Å; I175-L178 PolarHBondContact O-N 3.43Å; L178-N180 VanDerWaalsContact C-N 3.35Å; L178-N180 PolarHBondContact O-N 2.85Å; L178-Y181 WeakPolarHBondContact O-CB 3.42Å; L178-Y181 PolarHBondContact O-N 3.35Å; L178-V182 WeakPolarHBondContact O-CG2 3.49Å; L178-V182 PolarHBondContact O-N 3.41Å |
| 179 | A | 90.5 | Very high | 88.6 | Confident | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | I175 Q176 Y181 V182 I183 I207 V210 I214 | I175-A179 WeakPolarHBondContact O-CB 3.44Å; I175-A179 PolarHBondContact O-N 2.85Å; Q176-A179 PolarHBondContact O-N 3.31Å; A179-Y181 VanDerWaalsContact C-N 3.33Å; A179-Y181 PolarHBondContact O-N 3.48Å; A179-V182 WeakPolarHBondContact O-CB 3.46Å; A179-V182 PolarHBondContact O-N 2.78Å; A179-I183 VanDerWaalsContact O-CG1 3.24Å; A179-I183 WeakPolarHBondContact O-CG1 3.31Å; A179-I183 PolarHBondContact O-N 3.42Å; A179-I207 HydrophobicContact CB-CD1 3.94Å; A179-V210 HydrophobicContact CB-CG1 4.07Å; A179-I214 HydrophobicContact CB-CD1 4.3Å |
| 180 | N | 91.1 | Very high | 88.7 | Confident | 77 Ų | 77 | 47.3 Ų | 47.3 | 41% | 0.412 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.7 | -38.5 | 176.1 | -75.7 | -31.4 | 0 | 0 | 0 | 112.6 | Q176 G177 L178 S184 | Q176-N180 WeakPolarHBondContact O-CB 3.23Å; Q176-N180 PolarHBondContact O-N 3.48Å; Q176-N180 PolarHBondContact O-ND2 3.39Å; Q176-N180 VanDerWaalsContact O-ND2 3.14Å; G177-N180 PolarHBondContact O-N 2.89Å; L178-N180 VanDerWaalsContact C-N 3.35Å; L178-N180 PolarHBondContact O-N 2.85Å; N180-S184 WeakPolarHBondContact O-CB 3.43Å; N180-S184 PolarHBondContact O-N 2.91Å |
| 181 | Y | 92.4 | Very high | 88.9 | Confident | 51 Ų | 51 | 42.1 Ų | 42.1 | 20% | 0.2 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.6 | -44.6 | 173.8 | 176.5 | -100.2 | 0 | 0 | 0 | 111.7 | Q154 V158 L159 G177 L178 A179 S184 T185 | Q154-Y181 PolarHBondContact O-OH 3.43Å; Q154-Y181 VanDerWaalsContact O-OH 3.09Å; V158-Y181 HydrophobicContact CB-CD1 4.07Å; V158-Y181 HydrophobicContact CB-CE1 3.66Å; V158-Y181 HydrophobicContact CB-CE2 4.36Å; V158-Y181 HydrophobicContact CG1-CD1 3.48Å; V158-Y181 VanDerWaalsContact CG1-CD1 3.48Å; V158-Y181 HydrophobicContact CG1-CD2 4.13Å; V158-Y181 HydrophobicContact CG1-CE1 3.63Å; V158-Y181 HydrophobicContact CG1-CE2 4.27Å; V158-Y181 HydrophobicContact CG1-CG 3.73Å; V158-Y181 HydrophobicContact CG2-CE1 4.21Å; V158-Y181 HydrophobicContact CG2-CE2 4.05Å; L159-Y181 HydrophobicContact CD2-CD1 4.5Å; L159-Y181 HydrophobicContact CG-CD1 4.5Å; L159-Y181 HydrophobicContact CG-CE1 4.44Å; G177-Y181 PolarHBondContact O-N 2.96Å; L178-Y181 WeakPolarHBondContact O-CB 3.42Å; L178-Y181 PolarHBondContact O-N 3.35Å; A179-Y181 VanDerWaalsContact C-N 3.33Å; A179-Y181 PolarHBondContact O-N 3.48Å; Y181-S184 PolarHBondContact O-N 3.17Å; Y181-T185 WeakPolarHBondContact O-CB 3.3Å; Y181-T185 PolarHBondContact O-N 3.31Å; Y181-T185 PolarHBondContact O-OG1 2.93Å |
| 182 | V | 93.1 | Very high | 89.4 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -58.6 | -51 | 175.2 | 169.2 | 0 | 0 | 0 | 0 | 110.4 | F133 I136 L140 L159 L178 A179 S184 T185 M186 I214 | F133-V182 HydrophobicContact CD1-CG2 4.35Å; F133-V182 HydrophobicContact CE1-CG2 4.24Å; I136-V182 HydrophobicContact CG2-CB 4.38Å; I136-V182 HydrophobicContact CG2-CG1 3.64Å; I136-V182 HydrophobicContact CG2-CG2 3.76Å; L140-V182 HydrophobicContact CD1-CG1 4.47Å; L159-V182 HydrophobicContact CD1-CG2 4.09Å; L159-V182 HydrophobicContact CD2-CG2 4.14Å; L178-V182 WeakPolarHBondContact O-CG2 3.49Å; L178-V182 PolarHBondContact O-N 3.41Å; A179-V182 WeakPolarHBondContact O-CB 3.46Å; A179-V182 PolarHBondContact O-N 2.78Å; V182-S184 VanDerWaalsContact C-N 3.3Å; V182-S184 PolarHBondContact O-N 3.25Å; V182-T185 CarbonylContact O-C 3.26Å; V182-T185 WeakPolarHBondContact O-CA 3.34Å; V182-T185 WeakPolarHBondContact O-CB 3.39Å; V182-T185 PolarHBondContact O-N 3.08Å; V182-M186 HydrophobicContact CG1-CG 4.26Å; V182-M186 HydrophobicContact CG1-SD 3.7Å; V182-M186 WeakPolarHBondContact O-CG 3.42Å; V182-M186 PolarHBondContact O-N 3.48Å; V182-I214 HydrophobicContact CG1-CD1 4.15Å; V182-I214 HydrophobicContact CG1-CG2 3.84Å |
| 183 | I | 92.6 | Very high | 89.7 | Confident | 2 Ų | 2 | 44.1 Ų | 44.1 | 1% | 0.01 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59.3 | -41.9 | 178.6 | -64.3 | 162.5 | 0 | 0 | 0 | 111 | A179 T185 G187 I198 L201 K202 V210 I214 | A179-I183 VanDerWaalsContact O-CG1 3.24Å; A179-I183 WeakPolarHBondContact O-CG1 3.31Å; A179-I183 PolarHBondContact O-N 3.42Å; I183-T185 VanDerWaalsContact C-N 3.29Å; I183-T185 PolarHBondContact O-N 2.91Å; I183-G187 PolarHBondContact O-N 2.99Å; I183-I198 HydrophobicContact CG2-CG2 3.98Å; I183-L201 HydrophobicContact CD1-CB 4.07Å; I183-L201 HydrophobicContact CG1-CB 4.15Å; I183-L201 HydrophobicContact CG1-CD1 4.35Å; I183-L201 HydrophobicContact CG2-CB 4.14Å; I183-K202 HydrophobicContact CG2-CD 4.43Å; I183-K202 HydrophobicContact CG2-CG 3.68Å; I183-V210 HydrophobicContact CD1-CG1 3.94Å; I183-I214 HydrophobicContact CD1-CD1 4.32Å; I183-I214 HydrophobicContact CG1-CD1 3.94Å; I183-I214 HydrophobicContact CG1-CG1 4.04Å |
| 184 | S | 92.2 | Very high | 90 | Very high | 50 Ų | 50 | 45 Ų | 45 | 35% | 0.35 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.9 | -32.1 | 175.9 | -177.2 | 0 | 0 | 0 | 0 | 112.8 | N180 Y181 V182 K188 | N180-S184 WeakPolarHBondContact O-CB 3.43Å; N180-S184 PolarHBondContact O-N 2.91Å; Y181-S184 PolarHBondContact O-N 3.17Å; V182-S184 VanDerWaalsContact C-N 3.3Å; V182-S184 PolarHBondContact O-N 3.25Å; S184-K188 WeakPolarHBondContact O-CG 3.42Å |
| 185 | T | 91.9 | Very high | 90.3 | Very high | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -76.2 | -43.4 | 178.6 | -59 | 0 | 0 | 0 | 0 | 110.4 | L140 I155 Y181 V182 I183 G187 K188 L189 | L140-T185 HydrophobicContact CD1-CG2 4.32Å; L140-T185 HydrophobicContact CD2-CG2 4.46Å; I155-T185 HydrophobicContact CD1-CG2 3.86Å; I155-T185 HydrophobicContact CG1-CG2 4.07Å; Y181-T185 WeakPolarHBondContact O-CB 3.3Å; Y181-T185 PolarHBondContact O-N 3.31Å; Y181-T185 PolarHBondContact O-OG1 2.93Å; V182-T185 CarbonylContact O-C 3.26Å; V182-T185 WeakPolarHBondContact O-CA 3.34Å; V182-T185 WeakPolarHBondContact O-CB 3.39Å; V182-T185 PolarHBondContact O-N 3.08Å; I183-T185 VanDerWaalsContact C-N 3.29Å; I183-T185 PolarHBondContact O-N 2.91Å; T185-G187 VanDerWaalsContact C-N 3.31Å; T185-G187 PolarHBondContact O-N 2.91Å; T185-K188 WeakPolarHBondContact O-CB 3.45Å; T185-K188 PolarHBondContact O-N 2.95Å; T185-L189 HydrophobicContact CG2-CD1 4.07Å; T185-L189 WeakPolarHBondContact O-CG 3.39Å; T185-L189 PolarHBondContact O-N 2.77Å |
| 186 | M | 92.6 | Very high | 90.5 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -55.7 | -46.2 | 171.5 | -69.3 | 168.5 | 68 | 0 | 0 | 111 | L140 V182 K188 L189 C190 I198 L201 I214 V217 L218 M221 | L140-M186 HydrophobicContact CD2-CG 3.96Å; V182-M186 HydrophobicContact CG1-CG 4.26Å; V182-M186 HydrophobicContact CG1-SD 3.7Å; V182-M186 WeakPolarHBondContact O-CG 3.42Å; V182-M186 PolarHBondContact O-N 3.48Å; M186-K188 PolarHBondContact O-N 3.44Å; M186-K188 VanDerWaalsContact O-N 3.11Å; M186-L189 PolarHBondContact O-N 3.34Å; M186-C190 WeakPolarHBondContact O-CB 3.29Å; M186-C190 PolarHBondContact O-N 3.42Å; M186-C190 PolarHBondContact O-SG 2.91Å; M186-I198 HydrophobicContact CB-CD1 3.69Å; M186-I198 HydrophobicContact CE-CD1 4.11Å; M186-L201 HydrophobicContact CE-CD1 4.07Å; M186-I214 HydrophobicContact SD-CG1 4.34Å; M186-I214 HydrophobicContact SD-CG2 3.9Å; M186-V217 HydrophobicContact CE-CB 3.64Å; M186-V217 HydrophobicContact CE-CG1 3.47Å; M186-V217 VanDerWaalsContact CE-CG1 3.47Å; M186-L218 HydrophobicContact CE-CD2 3.99Å; M186-L218 HydrophobicContact CE-CG 3.89Å; M186-L218 HydrophobicContact CG-CD2 3.95Å; M186-L218 HydrophobicContact SD-CD2 4.02Å; M186-L218 HydrophobicContact SD-CG 4.14Å; M186-M221 HydrophobicContact CB-CE 4.41Å; M186-M221 HydrophobicContact CB-SD 4.12Å; M186-M221 HydrophobicContact CE-SD 3.89Å; M186-M221 HydrophobicContact CG-SD 4.17Å |
| 187 | G | 91.3 | Very high | 90.7 | Very high | 33 Ų | 33 | 45.7 Ų | 45.7 | 34% | 0.34 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -61.3 | -18.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | I183 T185 | I183-G187 PolarHBondContact O-N 2.99Å; T185-G187 VanDerWaalsContact C-N 3.31Å; T185-G187 PolarHBondContact O-N 2.91Å |
| 188 | K | 89.4 | Confident | 90.9 | Very high | 141 Ų | 141 | 44.9 Ų | 44.9 | 61% | 0.613 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -89.7 | -21.7 | 173.2 | -67.7 | 168.7 | -174 | 167.9 | 0 | 112.8 | S184 T185 M186 | S184-K188 WeakPolarHBondContact O-CG 3.42Å; T185-K188 WeakPolarHBondContact O-CB 3.45Å; T185-K188 PolarHBondContact O-N 2.95Å; M186-K188 PolarHBondContact O-N 3.44Å; M186-K188 VanDerWaalsContact O-N 3.11Å |
| 189 | L | 88.3 | Confident | 90.9 | Very high | 44 Ų | 44 | 51.5 Ų | 51.5 | 23% | 0.23 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -104.8 | -21.7 | -173.5 | -67 | 176.6 | 0 | 0 | 0 | 113.2 | L140 L144 L151 T185 M186 M221 | L140-L189 HydrophobicContact CD2-CD1 4.19Å; L144-L189 HydrophobicContact CD2-CD1 4.29Å; L144-L189 HydrophobicContact CD2-CD2 3.83Å; L151-L189 HydrophobicContact CD2-CD2 3.84Å; L151-L189 HydrophobicContact CD2-CG 4.44Å; T185-L189 HydrophobicContact CG2-CD1 4.07Å; T185-L189 WeakPolarHBondContact O-CG 3.39Å; T185-L189 PolarHBondContact O-N 2.77Å; M186-L189 PolarHBondContact O-N 3.34Å; L189-M221 HydrophobicContact CB-CE 4.03Å |
| 190 | C | 88.9 | Confident | 90.8 | Very high | 20 Ų | 20 | 57.8 Ų | 57.8 | 14% | 0.135 | 31% | 0.307 | C | S | . | . | S | Bend | trans | -76 | 157.9 | -176 | 65.9 | 0 | 0 | 0 | 0 | 112.8 | M186 R194 M221 | M186-C190 WeakPolarHBondContact O-CB 3.29Å; M186-C190 PolarHBondContact O-N 3.42Å; M186-C190 PolarHBondContact O-SG 2.91Å; C190-R194 HydrophobicContact CB-CB 3.99Å; C190-R194 HydrophobicContact CB-CG 4.49Å; C190-M221 HydrophobicContact CB-CE 4.01Å; C190-M221 HydrophobicContact CB-CG 4.23Å; C190-M221 HydrophobicContact CB-SD 4.09Å |
| 191 | A | 88.2 | Confident | 90.7 | Very high | 39 Ų | 39 | 54.3 Ų | 54.3 | 32% | 0.322 | 29% | 0.289 | S | S | . | . | trans | -71.1 | 151.7 | 170.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | V193 R194 | A191-V193 HydrophobicContact CB-CG1 4.11Å; A191-V193 PolarHBondContact O-N 3.24Å; A191-R194 WeakPolarHBondContact O-CB 3.4Å; A191-R194 PolarHBondContact O-N 3.39Å | ||
| 192 | P | 89.4 | Confident | 90.3 | Very high | 107 Ų | 107 | 58.3 Ų | 58.3 | 70% | 0.695 | 31% | 0.307 | S | S | * | . | G | 310 helix | trans | -55.9 | -25.3 | -177.4 | -27.2 | 34.5 | 0 | 0 | 0 | 115.1 | R194 D195 | P192-R194 PolarHBondContact O-N 3.19Å; P192-D195 WeakPolarHBondContact O-CB 3.04Å; P192-D195 VanDerWaalsContact O-CG 3.32Å; P192-D195 PolarHBondContact O-N 2.91Å |
| 193 | V | 89.4 | Confident | 89.9 | Confident | 106 Ų | 106 | 62.4 Ų | 62.4 | 64% | 0.642 | 34% | 0.341 | S | S | * | . | G | 310 helix | trans | -62.1 | -23.6 | 176.2 | 67.8 | 0 | 0 | 0 | 0 | 112.8 | A191 | A191-V193 HydrophobicContact CB-CG1 4.11Å; A191-V193 PolarHBondContact O-N 3.24Å |
| 194 | R | 92.6 | Very high | 89.3 | Confident | 43 Ų | 43 | 64.4 Ų | 64.4 | 16% | 0.162 | 35% | 0.353 | C | S | . | . | G | 310 helix | trans | -93.2 | -0.5 | -178.2 | -57.2 | -60.1 | 178.2 | 175.5 | -2.3 | 114 | C190 A191 P192 N196 D197 I198 D224 | C190-R194 HydrophobicContact CB-CB 3.99Å; C190-R194 HydrophobicContact CB-CG 4.49Å; A191-R194 WeakPolarHBondContact O-CB 3.4Å; A191-R194 PolarHBondContact O-N 3.39Å; P192-R194 PolarHBondContact O-N 3.19Å; R194-N196 PolarHBondContact O-N 2.98Å; R194-N196 VanDerWaalsContact O-N 3.16Å; R194-D197 WeakPolarHBondContact CD-OD2 3.43Å; R194-D197 IonicContact NH1-OD2 3.61Å; R194-D197 PolarHBondContact NH1-OD2 2.86Å; R194-D197 WeakPolarHBondContact O-CB 3.39Å; R194-D197 PolarHBondContact O-N 3.29Å; R194-I198 WeakPolarHBondContact O-CG1 3.33Å; R194-I198 PolarHBondContact O-N 2.77Å; R194-D224 WeakPolarHBondContact CG-OD2 3.3Å; R194-D224 IonicContact CZ-OD1 2.7Å; R194-D224 IonicContact CZ-OD2 3.45Å; R194-D224 IonicContact NE-OD1 3.68Å; R194-D224 IonicContact NE-OD2 3.75Å; R194-D224 PolarHBondContact NE-OD2 2.91Å; R194-D224 IonicContact NH2-OD1 3.03Å; R194-D224 PolarHBondContact NH2-OD1 3.29Å; R194-D224 VanDerWaalsContact NH2-OD1 3.16Å; R194-D224 IonicContact NH2-OD2 2.79Å |
| 195 | D | 90.9 | Very high | 88.4 | Confident | 77 Ų | 77 | 65.4 Ų | 65.4 | 41% | 0.412 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -60.9 | -28.4 | -177.5 | -72.1 | -8 | 0 | 0 | 0 | 112.8 | P192 R199 | P192-D195 WeakPolarHBondContact O-CB 3.04Å; P192-D195 VanDerWaalsContact O-CG 3.32Å; P192-D195 PolarHBondContact O-N 2.91Å; D195-R199 PolarHBondContact O-N 3.29Å |
| 196 | N | 91.3 | Very high | 88.1 | Confident | 86 Ų | 86 | 69.4 Ų | 69.4 | 46% | 0.46 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -71.7 | -45.6 | 173.9 | -69.8 | -31.1 | 0 | 0 | 0 | 111.3 | R194 I198 R199 E200 | R194-N196 PolarHBondContact O-N 2.98Å; R194-N196 VanDerWaalsContact O-N 3.16Å; N196-I198 VanDerWaalsContact C-N 3.29Å; N196-I198 PolarHBondContact O-N 3.07Å; N196-R199 WeakPolarHBondContact O-CA 3.3Å; N196-R199 WeakPolarHBondContact O-CB 3.45Å; N196-R199 PolarHBondContact O-N 3.01Å; N196-R199 PolarHBondContact OD1-NH1 3.43Å; N196-R199 VanDerWaalsContact OD1-NH1 3.11Å; N196-R199 PolarHBondContact OD1-NH2 2.92Å; N196-E200 PolarHBondContact O-N 3.44Å |
| 197 | D | 91.1 | Very high | 87.7 | Confident | 41 Ų | 41 | 71 Ų | 71 | 22% | 0.219 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -57.3 | -44.1 | 176.7 | -53.7 | -19.1 | 0 | 0 | 0 | 110.5 | R194 R199 E200 L201 V217 | R194-D197 WeakPolarHBondContact CD-OD2 3.43Å; R194-D197 IonicContact NH1-OD2 3.61Å; R194-D197 PolarHBondContact NH1-OD2 2.86Å; R194-D197 WeakPolarHBondContact O-CB 3.39Å; R194-D197 PolarHBondContact O-N 3.29Å; D197-R199 VanDerWaalsContact C-N 3.29Å; D197-R199 PolarHBondContact O-N 3.29Å; D197-E200 PolarHBondContact O-N 2.89Å; D197-L201 WeakPolarHBondContact O-CG 3.43Å; D197-L201 PolarHBondContact O-N 3.16Å; D197-V217 HydrophobicContact CB-CG1 4.42Å; D197-V217 HydrophobicContact CB-CG2 3.93Å |
| 198 | I | 92 | Very high | 87.5 | Confident | 9 Ų | 9 | 70 Ų | 70 | 5% | 0.046 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -63.9 | -33.1 | 175.5 | -60.7 | -60.9 | 0 | 0 | 0 | 112.4 | I183 M186 R194 N196 L201 K202 V217 | I183-I198 HydrophobicContact CG2-CG2 3.98Å; M186-I198 HydrophobicContact CB-CD1 3.69Å; M186-I198 HydrophobicContact CE-CD1 4.11Å; R194-I198 WeakPolarHBondContact O-CG1 3.33Å; R194-I198 PolarHBondContact O-N 2.77Å; N196-I198 VanDerWaalsContact C-N 3.29Å; N196-I198 PolarHBondContact O-N 3.07Å; I198-L201 HydrophobicContact CD1-CD1 4.11Å; I198-K202 PolarHBondContact O-N 3.01Å; I198-V217 HydrophobicContact CD1-CG1 4.08Å |
| 199 | R | 89.3 | Confident | 87.5 | Confident | 156 Ų | 156 | 66.2 Ų | 66.2 | 59% | 0.589 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -71.3 | -39.7 | 177 | -166.4 | -174.5 | -54.7 | 134.9 | 13.7 | 111.3 | D195 N196 D197 K202 A203 | D195-R199 PolarHBondContact O-N 3.29Å; N196-R199 WeakPolarHBondContact O-CA 3.3Å; N196-R199 WeakPolarHBondContact O-CB 3.45Å; N196-R199 PolarHBondContact O-N 3.01Å; N196-R199 PolarHBondContact OD1-NH1 3.43Å; N196-R199 VanDerWaalsContact OD1-NH1 3.11Å; N196-R199 PolarHBondContact OD1-NH2 2.92Å; D197-R199 VanDerWaalsContact C-N 3.29Å; D197-R199 PolarHBondContact O-N 3.29Å; R199-K202 PolarHBondContact O-N 3.45Å; R199-A203 PolarHBondContact O-N 3.17Å |
| 200 | E | 89.4 | Confident | 87.6 | Confident | 131 Ų | 131 | 64.2 Ų | 64.2 | 61% | 0.612 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -64.1 | -42 | 175.2 | -70 | -179.9 | -176 | 0 | 0 | 111.2 | N196 D197 K202 A203 T204 | N196-E200 PolarHBondContact O-N 3.44Å; D197-E200 PolarHBondContact O-N 2.89Å; E200-K202 PolarHBondContact O-N 3.05Å; E200-A203 WeakPolarHBondContact O-CB 3.37Å; E200-A203 PolarHBondContact O-N 3.41Å; E200-T204 PolarHBondContact O-N 2.76Å; E200-T204 PolarHBondContact O-OG1 3.13Å |
| 201 | L | 88.8 | Confident | 87.6 | Confident | 5 Ų | 5 | 63.2 Ų | 63.2 | 3% | 0.026 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -54.8 | -37.8 | 173.7 | -73 | 177.8 | 0 | 0 | 0 | 113.3 | I183 M186 D197 I198 A203 Q213 I214 V217 | I183-L201 HydrophobicContact CD1-CB 4.07Å; I183-L201 HydrophobicContact CG1-CB 4.15Å; I183-L201 HydrophobicContact CG1-CD1 4.35Å; I183-L201 HydrophobicContact CG2-CB 4.14Å; M186-L201 HydrophobicContact CE-CD1 4.07Å; D197-L201 WeakPolarHBondContact O-CG 3.43Å; D197-L201 PolarHBondContact O-N 3.16Å; I198-L201 HydrophobicContact CD1-CD1 4.11Å; L201-A203 VanDerWaalsContact C-N 3.3Å; L201-A203 PolarHBondContact O-N 3.13Å; L201-Q213 HydrophobicContact CD2-CB 3.22Å; L201-Q213 HydrophobicContact CD2-CG 4.46Å; L201-I214 HydrophobicContact CD1-CG1 4.29Å; L201-I214 HydrophobicContact CD2-CG1 4.27Å; L201-V217 HydrophobicContact CD1-CB 4.26Å; L201-V217 HydrophobicContact CD1-CG2 4.02Å; L201-V217 HydrophobicContact CG-CG2 4.42Å |
| 202 | K | 84.4 | Confident | 87.7 | Confident | 135 Ų | 135 | 66.8 Ų | 66.8 | 59% | 0.587 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -73.3 | -20.6 | 177.6 | -68.7 | -178.4 | -177.2 | 177.8 | 0 | 113.6 | I183 I198 R199 E200 | I183-K202 HydrophobicContact CG2-CD 4.43Å; I183-K202 HydrophobicContact CG2-CG 3.68Å; I198-K202 PolarHBondContact O-N 3.01Å; R199-K202 PolarHBondContact O-N 3.45Å; E200-K202 PolarHBondContact O-N 3.05Å |
| 203 | A | 83.3 | Confident | 87.8 | Confident | 86 Ų | 86 | 64.8 Ų | 64.8 | 71% | 0.711 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -88.7 | -19.5 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | R199 E200 L201 | R199-A203 PolarHBondContact O-N 3.17Å; E200-A203 WeakPolarHBondContact O-CB 3.37Å; E200-A203 PolarHBondContact O-N 3.41Å; L201-A203 VanDerWaalsContact C-N 3.3Å; L201-A203 PolarHBondContact O-N 3.13Å |
| 204 | T | 80.4 | Confident | 87.9 | Confident | 44 Ų | 44 | 59.7 Ų | 59.7 | 27% | 0.27 | 31% | 0.312 | S | S | . | . | trans | -73.5 | 127.4 | 179.4 | -54.4 | 0 | 0 | 0 | 0 | 111.3 | E200 E209 V210 | E200-T204 PolarHBondContact O-N 2.76Å; E200-T204 PolarHBondContact O-OG1 3.13Å; T204-E209 HydrophobicContact CG2-CB 4.06Å; T204-E209 HydrophobicContact CG2-CG 3.96Å; T204-V210 HydrophobicContact CG2-CG2 3.75Å; T204-V210 WeakPolarHBondContact O-CG2 3.45Å | ||
| 205 | G | 74.1 | Confident | 87.9 | Confident | 71 Ų | 71 | 59 Ų | 59 | 73% | 0.732 | 31% | 0.309 | S | S | * | . | trans | -95.5 | -19.3 | -176.3 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 206 | N | 84.9 | Confident | 87.9 | Confident | 84 Ų | 84 | 59.7 Ų | 59.7 | 45% | 0.449 | 31% | 0.31 | S | S | . | . | trans | -87.9 | 125.2 | 177.8 | -176.8 | -24.3 | 0 | 0 | 0 | 110 | V208 E209 V210 | N206-V208 PolarHBondContact O-N 3.01Å; N206-V208 PolarHBondContact OD1-N 3.18Å; N206-E209 HydrophobicContact CB-CB 4.19Å; N206-E209 PolarHBondContact O-N 3.27Å; N206-V210 VanDerWaalsContact O-CG2 3.28Å; N206-V210 WeakPolarHBondContact O-CG2 3.44Å; N206-V210 PolarHBondContact O-N 3.33Å | ||
| 207 | I | 84.9 | Confident | 88 | Confident | 33 Ų | 33 | 55.9 Ų | 55.9 | 17% | 0.169 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62 | -39.9 | -176.3 | -170.6 | 57.2 | 0 | 0 | 0 | 114 | L119 I175 A179 V210 L211 | L119-I207 HydrophobicContact CD1-CG2 4.16Å; I175-I207 HydrophobicContact CB-CD1 4.45Å; I175-I207 HydrophobicContact CB-CG1 4.33Å; I175-I207 HydrophobicContact CG2-CD1 3.7Å; I175-I207 HydrophobicContact CG2-CG1 3.57Å; A179-I207 HydrophobicContact CB-CD1 3.94Å; I207-V210 PolarHBondContact O-N 3.4Å; I207-L211 HydrophobicContact CG1-CD1 4.46Å; I207-L211 WeakPolarHBondContact O-CG 3.27Å; I207-L211 PolarHBondContact O-N 3.06Å |
| 208 | V | 87.1 | Confident | 88 | Confident | 12 Ų | 12 | 53.9 Ų | 53.9 | 7% | 0.073 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66.9 | -42.8 | 179.9 | 176.2 | 0 | 0 | 0 | 0 | 110 | W112 L115 D116 L119 N206 L211 R212 | W112-V208 HydrophobicContact CB-CG1 4.46Å; W112-V208 HydrophobicContact CE3-CG1 3.92Å; L115-V208 HydrophobicContact CD2-CG1 4.39Å; D116-V208 HydrophobicContact CB-CG1 4.45Å; D116-V208 HydrophobicContact CB-CG2 4.09Å; L119-V208 HydrophobicContact CD1-CG2 3.78Å; N206-V208 PolarHBondContact O-N 3.01Å; N206-V208 PolarHBondContact OD1-N 3.18Å; V208-L211 PolarHBondContact O-N 3.03Å; V208-R212 WeakPolarHBondContact O-CB 3.49Å; V208-R212 PolarHBondContact O-N 3.34Å |
| 209 | E | 87.7 | Confident | 88 | Confident | 62 Ų | 62 | 56.4 Ų | 56.4 | 29% | 0.29 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -67.7 | -37.5 | 176.5 | -170.9 | 58.6 | -155.5 | 0 | 0 | 111.3 | T204 N206 R212 Q213 | T204-E209 HydrophobicContact CG2-CB 4.06Å; T204-E209 HydrophobicContact CG2-CG 3.96Å; N206-E209 HydrophobicContact CB-CB 4.19Å; N206-E209 PolarHBondContact O-N 3.27Å; E209-R212 PolarHBondContact O-N 3.24Å; E209-R212 IonicContact OE2-NH1 3.84Å; E209-Q213 HydrophobicContact CG-CG 4.35Å; E209-Q213 WeakPolarHBondContact O-CB 3.43Å; E209-Q213 WeakPolarHBondContact O-CG 3.37Å; E209-Q213 PolarHBondContact O-N 2.95Å; E209-Q213 PolarHBondContact OE1-NE2 2.77Å |
| 210 | V | 90.9 | Very high | 88 | Confident | 1 Ų | 1 | 50.2 Ų | 50.2 | 1% | 0.006 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -59.3 | -49.5 | 172.4 | 168.6 | 0 | 0 | 0 | 0 | 110.9 | A179 I183 T204 N206 I207 R212 Q213 I214 | A179-V210 HydrophobicContact CB-CG1 4.07Å; I183-V210 HydrophobicContact CD1-CG1 3.94Å; T204-V210 HydrophobicContact CG2-CG2 3.75Å; T204-V210 WeakPolarHBondContact O-CG2 3.45Å; N206-V210 VanDerWaalsContact O-CG2 3.28Å; N206-V210 WeakPolarHBondContact O-CG2 3.44Å; N206-V210 PolarHBondContact O-N 3.33Å; I207-V210 PolarHBondContact O-N 3.4Å; V210-R212 VanDerWaalsContact C-N 3.35Å; V210-R212 PolarHBondContact O-N 3.42Å; V210-Q213 PolarHBondContact O-N 2.9Å; V210-I214 HydrophobicContact CG1-CD1 3.73Å; V210-I214 HydrophobicContact CG1-CG1 4.33Å; V210-I214 WeakPolarHBondContact O-CB 3.28Å; V210-I214 VanDerWaalsContact O-CG1 3.24Å; V210-I214 WeakPolarHBondContact O-CG1 3.39Å; V210-I214 PolarHBondContact O-N 3.21Å |
| 211 | L | 89.3 | Confident | 88.1 | Confident | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -61.4 | -43.9 | 178.3 | -72.4 | 172.4 | 0 | 0 | 0 | 111.4 | W112 L115 L132 F133 I136 I207 V208 Q213 I214 F215 | W112-L211 HydrophobicContact CH2-CB 4.32Å; W112-L211 HydrophobicContact CZ3-CB 4.04Å; L115-L211 HydrophobicContact CD2-CD1 4.29Å; L132-L211 HydrophobicContact CD1-CD1 4.4Å; F133-L211 HydrophobicContact CE1-CD2 4.23Å; F133-L211 HydrophobicContact CE2-CD2 4.48Å; F133-L211 HydrophobicContact CZ-CD2 3.93Å; I136-L211 HydrophobicContact CD1-CD2 4.28Å; I207-L211 HydrophobicContact CG1-CD1 4.46Å; I207-L211 WeakPolarHBondContact O-CG 3.27Å; I207-L211 PolarHBondContact O-N 3.06Å; V208-L211 PolarHBondContact O-N 3.03Å; L211-Q213 PolarHBondContact O-N 3.19Å; L211-I214 HydrophobicContact CD2-CD1 4.45Å; L211-I214 WeakPolarHBondContact O-CB 3.26Å; L211-I214 PolarHBondContact O-N 3.04Å; L211-F215 WeakPolarHBondContact O-CD2 3.41Å; L211-F215 PolarHBondContact O-N 3.29Å; L211-F215 VanDerWaalsContact O-N 3.08Å |
| 212 | R | 90.3 | Very high | 88.2 | Confident | 114 Ų | 114 | 47.9 Ų | 47.9 | 43% | 0.43 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -58.1 | -47 | 175.8 | -179.1 | -178.4 | 177.5 | -177.3 | 3.3 | 112.2 | W112 V208 E209 V210 F215 H216 | W112-R212 HydrophobicContact CD2-CB 4.12Å; W112-R212 HydrophobicContact CD2-CG 4.32Å; W112-R212 HydrophobicContact CE3-CB 4.3Å; W112-R212 HydrophobicContact CH2-CB 4.06Å; W112-R212 HydrophobicContact CZ2-CB 3.86Å; W112-R212 HydrophobicContact CZ2-CG 4.05Å; W112-R212 HydrophobicContact CZ3-CB 4.27Å; V208-R212 WeakPolarHBondContact O-CB 3.49Å; V208-R212 PolarHBondContact O-N 3.34Å; E209-R212 PolarHBondContact O-N 3.24Å; E209-R212 IonicContact OE2-NH1 3.84Å; V210-R212 VanDerWaalsContact C-N 3.35Å; V210-R212 PolarHBondContact O-N 3.42Å; R212-F215 PolarHBondContact O-N 2.87Å; R212-H216 PolarHBondContact O-N 3.29Å; R212-H216 VanDerWaalsContact O-N 3.12Å |
| 213 | Q | 90.7 | Very high | 88.4 | Confident | 64 Ų | 64 | 43.6 Ų | 43.6 | 30% | 0.299 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -70 | -33.6 | 179.1 | -65.8 | -70 | -4.1 | 0 | 0 | 111.8 | L201 E209 V210 L211 F215 H216 V217 | L201-Q213 HydrophobicContact CD2-CB 3.22Å; L201-Q213 HydrophobicContact CD2-CG 4.46Å; E209-Q213 HydrophobicContact CG-CG 4.35Å; E209-Q213 WeakPolarHBondContact O-CB 3.43Å; E209-Q213 WeakPolarHBondContact O-CG 3.37Å; E209-Q213 PolarHBondContact O-N 2.95Å; E209-Q213 PolarHBondContact OE1-NE2 2.77Å; V210-Q213 PolarHBondContact O-N 2.9Å; L211-Q213 PolarHBondContact O-N 3.19Å; Q213-F215 PolarHBondContact O-N 3.24Å; Q213-H216 WeakPolarHBondContact O-CB 3.38Å; Q213-H216 PolarHBondContact O-N 3.46Å; Q213-V217 WeakPolarHBondContact O-CG2 3.41Å; Q213-V217 PolarHBondContact O-N 3.49Å |
| 214 | I | 93.1 | Very high | 88.8 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -56.3 | -50.3 | 171.5 | -77.6 | 166.6 | 0 | 0 | 0 | 109.9 | I136 A179 V182 I183 M186 L201 V210 L211 H216 V217 L218 | I136-I214 HydrophobicContact CD1-CG2 3.92Å; I136-I214 HydrophobicContact CG1-CG2 4.25Å; A179-I214 HydrophobicContact CB-CD1 4.3Å; V182-I214 HydrophobicContact CG1-CD1 4.15Å; V182-I214 HydrophobicContact CG1-CG2 3.84Å; I183-I214 HydrophobicContact CD1-CD1 4.32Å; I183-I214 HydrophobicContact CG1-CD1 3.94Å; I183-I214 HydrophobicContact CG1-CG1 4.04Å; M186-I214 HydrophobicContact SD-CG1 4.34Å; M186-I214 HydrophobicContact SD-CG2 3.9Å; L201-I214 HydrophobicContact CD1-CG1 4.29Å; L201-I214 HydrophobicContact CD2-CG1 4.27Å; V210-I214 HydrophobicContact CG1-CD1 3.73Å; V210-I214 HydrophobicContact CG1-CG1 4.33Å; V210-I214 WeakPolarHBondContact O-CB 3.28Å; V210-I214 VanDerWaalsContact O-CG1 3.24Å; V210-I214 WeakPolarHBondContact O-CG1 3.39Å; V210-I214 PolarHBondContact O-N 3.21Å; L211-I214 HydrophobicContact CD2-CD1 4.45Å; L211-I214 WeakPolarHBondContact O-CB 3.26Å; L211-I214 PolarHBondContact O-N 3.04Å; I214-H216 VanDerWaalsContact C-N 3.31Å; I214-H216 PolarHBondContact O-N 3.29Å; I214-V217 PolarHBondContact O-N 3.14Å; I214-L218 HydrophobicContact CG2-CD1 3.71Å; I214-L218 HydrophobicContact CG2-CG 4.2Å; I214-L218 WeakPolarHBondContact O-CB 3.43Å; I214-L218 VanDerWaalsContact O-CG 3.25Å; I214-L218 WeakPolarHBondContact O-CG 3.36Å; I214-L218 PolarHBondContact O-N 3.48Å |
| 215 | F | 91.5 | Very high | 89.1 | Confident | 27 Ų | 27 | 42.3 Ų | 42.3 | 12% | 0.118 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.5 | -40 | 177.9 | -88.5 | -89.2 | 0 | 0 | 0 | 112.5 | W112 L132 E135 I136 I139 L211 R212 Q213 L218 D219 | W112-F215 HydrophobicContact CH2-CD2 4.2Å; L132-F215 HydrophobicContact CB-CE2 4.01Å; L132-F215 HydrophobicContact CB-CZ 4.26Å; L132-F215 HydrophobicContact CD2-CD2 4.31Å; L132-F215 HydrophobicContact CD2-CE1 4.48Å; L132-F215 HydrophobicContact CD2-CE2 3.45Å; L132-F215 VanDerWaalsContact CD2-CE2 3.45Å; L132-F215 HydrophobicContact CD2-CZ 3.54Å; L132-F215 HydrophobicContact CG-CE2 4.23Å; E135-F215 HydrophobicContact CB-CE1 4.19Å; E135-F215 HydrophobicContact CB-CZ 4.03Å; I136-F215 HydrophobicContact CD1-CD2 4.39Å; I136-F215 HydrophobicContact CD1-CE2 3.7Å; I136-F215 HydrophobicContact CD1-CZ 4.25Å; I136-F215 HydrophobicContact CG1-CD2 4.39Å; I136-F215 HydrophobicContact CG1-CE1 4.49Å; I136-F215 HydrophobicContact CG1-CE2 3.64Å; I136-F215 HydrophobicContact CG1-CZ 3.72Å; I139-F215 HydrophobicContact CD1-CE1 4.19Å; L211-F215 WeakPolarHBondContact O-CD2 3.41Å; L211-F215 PolarHBondContact O-N 3.29Å; L211-F215 VanDerWaalsContact O-N 3.08Å; R212-F215 PolarHBondContact O-N 2.87Å; Q213-F215 PolarHBondContact O-N 3.24Å; F215-L218 PolarHBondContact O-N 3.48Å; F215-D219 PolarHBondContact O-N 3.28Å |
| 216 | H | 90.9 | Very high | 89.8 | Confident | 93 Ų | 93 | 40.6 Ų | 40.6 | 43% | 0.431 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -58.8 | -49.6 | 175.3 | -177.9 | 55.7 | 0 | 0 | 0 | 111.8 | R212 Q213 I214 L218 D219 L220 | R212-H216 PolarHBondContact O-N 3.29Å; R212-H216 VanDerWaalsContact O-N 3.12Å; Q213-H216 WeakPolarHBondContact O-CB 3.38Å; Q213-H216 PolarHBondContact O-N 3.46Å; I214-H216 VanDerWaalsContact C-N 3.31Å; I214-H216 PolarHBondContact O-N 3.29Å; H216-L218 PolarHBondContact O-N 2.92Å; H216-D219 PolarHBondContact O-N 3.41Å; H216-L220 WeakPolarHBondContact O-CG 3.49Å; H216-L220 PolarHBondContact O-N 3.28Å; H216-L220 VanDerWaalsContact O-N 3.15Å |
| 217 | V | 92.9 | Very high | 90 | Very high | 5 Ų | 5 | 38 Ų | 38 | 3% | 0.03 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -68.1 | -35.5 | 179 | 177.7 | 0 | 0 | 0 | 0 | 111.4 | M186 D197 I198 L201 Q213 I214 D219 L220 M221 | M186-V217 HydrophobicContact CE-CB 3.64Å; M186-V217 HydrophobicContact CE-CG1 3.47Å; M186-V217 VanDerWaalsContact CE-CG1 3.47Å; D197-V217 HydrophobicContact CB-CG1 4.42Å; D197-V217 HydrophobicContact CB-CG2 3.93Å; I198-V217 HydrophobicContact CD1-CG1 4.08Å; L201-V217 HydrophobicContact CD1-CB 4.26Å; L201-V217 HydrophobicContact CD1-CG2 4.02Å; L201-V217 HydrophobicContact CG-CG2 4.42Å; Q213-V217 WeakPolarHBondContact O-CG2 3.41Å; Q213-V217 PolarHBondContact O-N 3.49Å; I214-V217 PolarHBondContact O-N 3.14Å; V217-D219 PolarHBondContact O-N 3.02Å; V217-L220 WeakPolarHBondContact O-CB 3.35Å; V217-L220 PolarHBondContact O-N 2.92Å; V217-M221 HydrophobicContact CG1-CG 4.4Å; V217-M221 HydrophobicContact CG1-SD 4.23Å; V217-M221 VanDerWaalsContact O-CG 3.26Å; V217-M221 WeakPolarHBondContact O-CG 3.36Å; V217-M221 PolarHBondContact O-N 2.78Å |
| 218 | L | 92.5 | Very high | 90.2 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.2 | -40.5 | 174.1 | -75.7 | 174 | 0 | 0 | 0 | 112.2 | I136 I139 L140 F143 M186 I214 F215 H216 L220 M221 K222 | I136-L218 HydrophobicContact CB-CD1 4.42Å; I136-L218 HydrophobicContact CG1-CD1 3.92Å; I136-L218 HydrophobicContact CG2-CD1 4.25Å; I139-L218 HydrophobicContact CD1-CD1 4.39Å; I139-L218 HydrophobicContact CG2-CB 4.23Å; I139-L218 HydrophobicContact CG2-CD1 4.41Å; I139-L218 HydrophobicContact CG2-CD2 4.02Å; I139-L218 HydrophobicContact CG2-CG 4.46Å; L140-L218 HydrophobicContact CD2-CD2 3.93Å; F143-L218 HydrophobicContact CE2-CD2 3.98Å; M186-L218 HydrophobicContact CE-CD2 3.99Å; M186-L218 HydrophobicContact CE-CG 3.89Å; M186-L218 HydrophobicContact CG-CD2 3.95Å; M186-L218 HydrophobicContact SD-CD2 4.02Å; M186-L218 HydrophobicContact SD-CG 4.14Å; I214-L218 HydrophobicContact CG2-CD1 3.71Å; I214-L218 HydrophobicContact CG2-CG 4.2Å; I214-L218 WeakPolarHBondContact O-CB 3.43Å; I214-L218 VanDerWaalsContact O-CG 3.25Å; I214-L218 WeakPolarHBondContact O-CG 3.36Å; I214-L218 PolarHBondContact O-N 3.48Å; F215-L218 PolarHBondContact O-N 3.48Å; H216-L218 PolarHBondContact O-N 2.92Å; L218-L220 VanDerWaalsContact C-N 3.34Å; L218-M221 HydrophobicContact CD2-SD 4.23Å; L218-M221 WeakPolarHBondContact O-CB 3.49Å; L218-M221 PolarHBondContact O-N 2.94Å; L218-K222 WeakPolarHBondContact O-CG 3.28Å; L218-K222 PolarHBondContact O-N 3.38Å |
| 219 | D | 90.8 | Very high | 90.2 | Very high | 62 Ų | 62 | 44.3 Ų | 44.3 | 33% | 0.332 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -65.9 | -38.4 | 175.7 | -77.2 | -18.3 | 0 | 0 | 0 | 111.9 | F215 H216 V217 K222 M223 | F215-D219 PolarHBondContact O-N 3.28Å; H216-D219 PolarHBondContact O-N 3.41Å; V217-D219 PolarHBondContact O-N 3.02Å; D219-K222 WeakPolarHBondContact O-CB 3.39Å; D219-K222 PolarHBondContact O-N 3.49Å; D219-K222 IonicContact OD1-NZ 3.89Å; D219-K222 PolarHBondContact OD1-NZ 3.41Å; D219-M223 PolarHBondContact O-N 3.39Å |
| 220 | L | 90.6 | Very high | 90.2 | Very high | 26 Ų | 26 | 42.7 Ų | 42.7 | 14% | 0.136 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63 | -42.1 | 171.5 | -66.3 | 172.5 | 0 | 0 | 0 | 111.6 | H216 V217 L218 K222 M223 D224 | H216-L220 WeakPolarHBondContact O-CG 3.49Å; H216-L220 PolarHBondContact O-N 3.28Å; H216-L220 VanDerWaalsContact O-N 3.15Å; V217-L220 WeakPolarHBondContact O-CB 3.35Å; V217-L220 PolarHBondContact O-N 2.92Å; L218-L220 VanDerWaalsContact C-N 3.34Å; L220-K222 VanDerWaalsContact C-N 3.34Å; L220-K222 PolarHBondContact O-N 2.94Å; L220-M223 WeakPolarHBondContact O-CB 3.32Å; L220-M223 PolarHBondContact O-N 3.12Å; L220-D224 PolarHBondContact O-N 2.89Å |
| 221 | M | 91.8 | Very high | 90.1 | Very high | 8 Ų | 8 | 47.8 Ų | 47.8 | 4% | 0.039 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.5 | -37.3 | 175 | -71.5 | 171.6 | 65.7 | 0 | 0 | 112.4 | F143 M186 L189 C190 V217 L218 M223 D224 M225 | F143-M221 HydrophobicContact CD2-CE 4Å; F143-M221 HydrophobicContact CE2-CB 3.98Å; F143-M221 HydrophobicContact CE2-CE 3.83Å; F143-M221 HydrophobicContact CZ-CB 3.77Å; M186-M221 HydrophobicContact CB-CE 4.41Å; M186-M221 HydrophobicContact CB-SD 4.12Å; M186-M221 HydrophobicContact CE-SD 3.89Å; M186-M221 HydrophobicContact CG-SD 4.17Å; L189-M221 HydrophobicContact CB-CE 4.03Å; C190-M221 HydrophobicContact CB-CE 4.01Å; C190-M221 HydrophobicContact CB-CG 4.23Å; C190-M221 HydrophobicContact CB-SD 4.09Å; V217-M221 HydrophobicContact CG1-CG 4.4Å; V217-M221 HydrophobicContact CG1-SD 4.23Å; V217-M221 VanDerWaalsContact O-CG 3.26Å; V217-M221 WeakPolarHBondContact O-CG 3.36Å; V217-M221 PolarHBondContact O-N 2.78Å; L218-M221 HydrophobicContact CD2-SD 4.23Å; L218-M221 WeakPolarHBondContact O-CB 3.49Å; L218-M221 PolarHBondContact O-N 2.94Å; M221-M223 VanDerWaalsContact C-N 3.32Å; M221-M223 PolarHBondContact O-N 3.46Å; M221-D224 PolarHBondContact O-N 2.92Å; M221-M225 WeakPolarHBondContact O-CB 3.36Å; M221-M225 PolarHBondContact O-N 3.03Å |
| 222 | K | 90 | Very high | 90 | Very high | 78 Ų | 78 | 50.4 Ų | 50.4 | 34% | 0.339 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -59.8 | -43.8 | 172.8 | -69.4 | 173.2 | -167.6 | 155.5 | 0 | 111.4 | I139 F143 L218 D219 L220 M225 A226 | I139-K222 VanDerWaalsContact CG2-CE 3.5Å; I139-K222 HydrophobicContact CG2-CG 4.45Å; F143-K222 HydrophobicContact CE1-CB 4.28Å; F143-K222 HydrophobicContact CE1-CG 3.71Å; F143-K222 HydrophobicContact CZ-CB 4.47Å; F143-K222 HydrophobicContact CZ-CG 3.69Å; L218-K222 WeakPolarHBondContact O-CG 3.28Å; L218-K222 PolarHBondContact O-N 3.38Å; D219-K222 WeakPolarHBondContact O-CB 3.39Å; D219-K222 PolarHBondContact O-N 3.49Å; D219-K222 IonicContact OD1-NZ 3.89Å; D219-K222 PolarHBondContact OD1-NZ 3.41Å; L220-K222 VanDerWaalsContact C-N 3.34Å; L220-K222 PolarHBondContact O-N 2.94Å; K222-M225 PolarHBondContact O-N 3.32Å; K222-A226 WeakPolarHBondContact O-CB 3.31Å; K222-A226 PolarHBondContact O-N 3.34Å |
| 223 | M | 89.3 | Confident | 89.9 | Confident | 46 Ų | 46 | 49.8 Ų | 49.8 | 23% | 0.227 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -64.9 | -43.4 | 176.7 | -69.3 | -64.1 | -63.2 | 0 | 0 | 111.7 | L89 D219 L220 M221 M225 A226 N227 | L89-M223 HydrophobicContact CB-CE 3.5Å; L89-M223 VanDerWaalsContact CB-CE 3.5Å; L89-M223 WeakPolarHBondContact O-CE 3.45Å; D219-M223 PolarHBondContact O-N 3.39Å; L220-M223 WeakPolarHBondContact O-CB 3.32Å; L220-M223 PolarHBondContact O-N 3.12Å; M221-M223 VanDerWaalsContact C-N 3.32Å; M221-M223 PolarHBondContact O-N 3.46Å; M223-M225 VanDerWaalsContact C-N 3.32Å; M223-M225 PolarHBondContact O-N 3.23Å; M223-A226 PolarHBondContact O-N 3.32Å; M223-N227 WeakPolarHBondContact O-CB 3.49Å; M223-N227 PolarHBondContact O-N 3.07Å; M223-N227 PolarHBondContact O-ND2 2.94Å |
| 224 | D | 90.3 | Very high | 89.8 | Confident | 38 Ų | 38 | 48.2 Ų | 48.2 | 20% | 0.203 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -60.2 | -43.6 | 176.8 | -63.9 | -17.6 | 0 | 0 | 0 | 110.6 | R194 L220 M221 N227 F228 | R194-D224 WeakPolarHBondContact CG-OD2 3.3Å; R194-D224 IonicContact CZ-OD1 2.7Å; R194-D224 IonicContact CZ-OD2 3.45Å; R194-D224 IonicContact NE-OD1 3.68Å; R194-D224 IonicContact NE-OD2 3.75Å; R194-D224 PolarHBondContact NE-OD2 2.91Å; R194-D224 IonicContact NH2-OD1 3.03Å; R194-D224 PolarHBondContact NH2-OD1 3.29Å; R194-D224 VanDerWaalsContact NH2-OD1 3.16Å; R194-D224 IonicContact NH2-OD2 2.79Å; L220-D224 PolarHBondContact O-N 2.89Å; M221-D224 PolarHBondContact O-N 2.92Å; D224-N227 PolarHBondContact O-N 3.42Å; D224-F228 VanDerWaalsContact O-CB 3.31Å; D224-F228 WeakPolarHBondContact O-CB 3.21Å; D224-F228 PolarHBondContact O-N 3.15Å |
| 225 | M | 87.7 | Confident | 89.7 | Confident | 64 Ų | 64 | 51 Ų | 51 | 32% | 0.315 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -65.1 | -42.3 | 177.2 | -168.5 | 66.9 | 70.8 | 0 | 0 | 112.4 | F143 M221 K222 M223 F228 T229 | F143-M225 HydrophobicContact CB-CE 3.8Å; F143-M225 HydrophobicContact CD1-CB 4.34Å; F143-M225 HydrophobicContact CD1-CE 3.95Å; F143-M225 HydrophobicContact CD1-CG 4.34Å; F143-M225 HydrophobicContact CE1-CB 4.47Å; F143-M225 HydrophobicContact CG-CE 4.13Å; M221-M225 WeakPolarHBondContact O-CB 3.36Å; M221-M225 PolarHBondContact O-N 3.03Å; K222-M225 PolarHBondContact O-N 3.32Å; M223-M225 VanDerWaalsContact C-N 3.32Å; M223-M225 PolarHBondContact O-N 3.23Å; M225-F228 PolarHBondContact O-N 3.49Å; M225-T229 WeakPolarHBondContact O-CB 3.42Å; M225-T229 PolarHBondContact O-N 3.31Å; M225-T229 PolarHBondContact O-OG1 3.33Å |
| 226 | A | 88.2 | Confident | 89.5 | Confident | 35 Ų | 35 | 55 Ų | 55 | 29% | 0.289 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -62.9 | -46.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111 | L89 K222 M223 F228 T229 I230 | L89-A226 HydrophobicContact CD1-CB 4.02Å; K222-A226 WeakPolarHBondContact O-CB 3.31Å; K222-A226 PolarHBondContact O-N 3.34Å; M223-A226 PolarHBondContact O-N 3.32Å; A226-F228 PolarHBondContact O-N 2.99Å; A226-T229 PolarHBondContact O-N 2.95Å; A226-I230 VanDerWaalsContact O-CG1 3.3Å; A226-I230 WeakPolarHBondContact O-CG1 3.26Å; A226-I230 PolarHBondContact O-N 2.69Å |
| 227 | N | 89.5 | Confident | 89.3 | Confident | 30 Ų | 30 | 52.8 Ų | 52.8 | 16% | 0.16 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.6 | -40 | 176.7 | -76.7 | -35.2 | 0 | 0 | 0 | 112.3 | Q88 L89 M223 D224 I230 M231 | Q88-N227 WeakPolarHBondContact CA-OD1 3.27Å; L89-N227 PolarHBondContact N-OD1 3.04Å; L89-N227 PolarHBondContact O-ND2 2.88Å; M223-N227 WeakPolarHBondContact O-CB 3.49Å; M223-N227 PolarHBondContact O-N 3.07Å; M223-N227 PolarHBondContact O-ND2 2.94Å; D224-N227 PolarHBondContact O-N 3.42Å; N227-I230 PolarHBondContact O-N 3.16Å; N227-M231 WeakPolarHBondContact O-CB 3.37Å; N227-M231 PolarHBondContact O-N 3.49Å |
| 228 | F | 88.3 | Confident | 89.1 | Confident | 115 Ų | 115 | 57 Ų | 57 | 50% | 0.504 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -63.1 | -41.4 | 173.8 | 176.1 | -99.6 | 0 | 0 | 0 | 112.2 | D224 M225 A226 M231 S232 | D224-F228 VanDerWaalsContact O-CB 3.31Å; D224-F228 WeakPolarHBondContact O-CB 3.21Å; D224-F228 PolarHBondContact O-N 3.15Å; M225-F228 PolarHBondContact O-N 3.49Å; A226-F228 PolarHBondContact O-N 2.99Å; F228-M231 HydrophobicContact CD2-CE 3.93Å; F228-M231 HydrophobicContact CE2-CE 4.19Å; F228-M231 PolarHBondContact O-N 2.92Å; F228-S232 WeakPolarHBondContact O-CB 3.49Å; F228-S232 PolarHBondContact O-N 3.24Å; F228-S232 PolarHBondContact O-OG 3.48Å |
| 229 | T | 88.2 | Confident | 88.9 | Confident | 63 Ų | 63 | 66.5 Ų | 66.5 | 39% | 0.387 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -64.3 | -45.2 | 177.2 | -58.2 | 0 | 0 | 0 | 0 | 110.8 | M225 A226 M231 S232 L233 | M225-T229 WeakPolarHBondContact O-CB 3.42Å; M225-T229 PolarHBondContact O-N 3.31Å; M225-T229 PolarHBondContact O-OG1 3.33Å; A226-T229 PolarHBondContact O-N 2.95Å; T229-M231 VanDerWaalsContact C-N 3.33Å; T229-M231 PolarHBondContact O-N 3.36Å; T229-S232 PolarHBondContact O-N 3.33Å; T229-L233 HydrophobicContact CG2-CD1 3.86Å; T229-L233 HydrophobicContact CG2-CG 4.36Å; T229-L233 WeakPolarHBondContact O-CB 3.43Å; T229-L233 WeakPolarHBondContact O-CG 3.36Å; T229-L233 PolarHBondContact O-N 3.34Å |
| 230 | I | 87.7 | Confident | 88.9 | Confident | 27 Ų | 27 | 70.2 Ų | 70.2 | 14% | 0.138 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -56.9 | -48.4 | 174.3 | -71.8 | 165.7 | 0 | 0 | 0 | 110.5 | I81 F87 L89 A226 N227 S232 L233 R234 | I81-I230 HydrophobicContact CG1-CG2 4.36Å; I81-I230 HydrophobicContact CG2-CG2 3.69Å; F87-I230 HydrophobicContact CD1-CG2 4.18Å; F87-I230 HydrophobicContact CE1-CD1 4.17Å; L89-I230 HydrophobicContact CD1-CD1 3.66Å; L89-I230 HydrophobicContact CD2-CD1 4.49Å; L89-I230 HydrophobicContact CG-CD1 3.72Å; A226-I230 VanDerWaalsContact O-CG1 3.3Å; A226-I230 WeakPolarHBondContact O-CG1 3.26Å; A226-I230 PolarHBondContact O-N 2.69Å; N227-I230 PolarHBondContact O-N 3.16Å; I230-S232 VanDerWaalsContact C-N 3.3Å; I230-S232 PolarHBondContact O-N 2.91Å; I230-L233 PolarHBondContact O-N 2.95Å; I230-R234 WeakPolarHBondContact O-CB 3.36Å; I230-R234 PolarHBondContact O-N 3.42Å |
| 231 | M | 88 | Confident | 88.9 | Confident | 109 Ų | 109 | 69.2 Ų | 69.2 | 54% | 0.537 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -60.5 | -40.4 | 178.3 | -173 | -179.5 | 71.4 | 0 | 0 | 112.1 | N227 F228 T229 | N227-M231 WeakPolarHBondContact O-CB 3.37Å; N227-M231 PolarHBondContact O-N 3.49Å; F228-M231 HydrophobicContact CD2-CE 3.93Å; F228-M231 HydrophobicContact CE2-CE 4.19Å; F228-M231 PolarHBondContact O-N 2.92Å; T229-M231 VanDerWaalsContact C-N 3.33Å; T229-M231 PolarHBondContact O-N 3.36Å |
| 232 | S | 87.9 | Confident | 88.9 | Confident | 54 Ų | 54 | 70.5 Ų | 70.5 | 38% | 0.378 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -70 | -35.2 | 179.5 | -59.2 | 0 | 0 | 0 | 0 | 112.8 | F228 T229 I230 P235 | F228-S232 WeakPolarHBondContact O-CB 3.49Å; F228-S232 PolarHBondContact O-N 3.24Å; F228-S232 PolarHBondContact O-OG 3.48Å; T229-S232 PolarHBondContact O-N 3.33Å; I230-S232 VanDerWaalsContact C-N 3.3Å; I230-S232 PolarHBondContact O-N 2.91Å; S232-P235 WeakPolarHBondContact O-CD 3.49Å |
| 233 | L | 87.1 | Confident | 88.9 | Confident | 101 Ų | 101 | 72.2 Ų | 72.2 | 53% | 0.529 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -83.2 | -22.9 | 179.5 | -69.3 | 176.1 | 0 | 0 | 0 | 113.4 | T229 I230 P235 H236 L237 | T229-L233 HydrophobicContact CG2-CD1 3.86Å; T229-L233 HydrophobicContact CG2-CG 4.36Å; T229-L233 WeakPolarHBondContact O-CB 3.43Å; T229-L233 WeakPolarHBondContact O-CG 3.36Å; T229-L233 PolarHBondContact O-N 3.34Å; I230-L233 PolarHBondContact O-N 2.95Å; L233-P235 VanDerWaalsContact C-CD 3.44Å; L233-H236 WeakPolarHBondContact O-CA 3.46Å; L233-H236 WeakPolarHBondContact O-CB 3.27Å; L233-H236 PolarHBondContact O-N 2.83Å; L233-L237 PolarHBondContact O-N 3.3Å |
| 234 | R | 89.6 | Confident | 89 | Confident | 31 Ų | 31 | 73.9 Ų | 73.9 | 12% | 0.117 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -48.5 | -45.6 | -177.4 | -178.8 | -178.9 | -68.7 | 151.7 | -2.7 | 114.1 | I81 N84 E85 F87 I230 H236 L237 Q238 | I81-R234 PolarHBondContact O-NE 3.16Å; N84-R234 PolarHBondContact O-NH2 3.28Å; E85-R234 PolarHBondContact O-NH1 3.09Å; E85-R234 PolarHBondContact O-NH2 3.3Å; F87-R234 PolarHBondContact O-NH2 3.21Å; I230-R234 WeakPolarHBondContact O-CB 3.36Å; I230-R234 PolarHBondContact O-N 3.42Å; R234-H236 VanDerWaalsContact C-N 3.25Å; R234-H236 PolarHBondContact O-N 3.08Å; R234-L237 PolarHBondContact O-N 2.87Å; R234-Q238 HydrophobicContact CG-CG 4.33Å; R234-Q238 WeakPolarHBondContact O-CG 3.49Å; R234-Q238 PolarHBondContact O-N 2.87Å |
| 235 | P | 90.3 | Very high | 89 | Confident | 59 Ų | 59 | 72.1 Ų | 72.1 | 38% | 0.383 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -63.6 | -30.5 | 179.3 | -21.8 | 34.2 | 0 | 0 | 0 | 113.5 | S232 L233 R239 | S232-P235 WeakPolarHBondContact O-CD 3.49Å; L233-P235 VanDerWaalsContact C-CD 3.44Å; P235-R239 WeakPolarHBondContact O-CG 3.41Å |
| 236 | H | 88.4 | Confident | 89.2 | Confident | 110 Ų | 110 | 72.6 Ų | 72.6 | 51% | 0.509 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -73.9 | -43.1 | 175.8 | -62.9 | -83.8 | 0 | 0 | 0 | 110.6 | L233 R234 Q238 R239 Q240 | L233-H236 WeakPolarHBondContact O-CA 3.46Å; L233-H236 WeakPolarHBondContact O-CB 3.27Å; L233-H236 PolarHBondContact O-N 2.83Å; R234-H236 VanDerWaalsContact C-N 3.25Å; R234-H236 PolarHBondContact O-N 3.08Å; H236-Q238 PolarHBondContact O-N 3.04Å; H236-R239 PolarHBondContact O-N 3.18Å; H236-Q240 PolarHBondContact O-N 2.98Å |
| 237 | L | 87.2 | Confident | 89.3 | Confident | 47 Ų | 47 | 74 Ų | 74 | 25% | 0.246 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -60.6 | -45 | 176.4 | -170 | 65.2 | 0 | 0 | 0 | 111.4 | A78 I81 A82 L233 R234 R239 Q240 L241 | A78-L237 WeakPolarHBondContact O-CD2 3.38Å; I81-L237 HydrophobicContact CB-CD2 3.88Å; I81-L237 HydrophobicContact CG2-CD2 3.6Å; A82-L237 HydrophobicContact CB-CD2 3.95Å; A82-L237 HydrophobicContact CB-CG 4.1Å; L233-L237 PolarHBondContact O-N 3.3Å; R234-L237 PolarHBondContact O-N 2.87Å; L237-R239 PolarHBondContact O-N 2.83Å; L237-Q240 CarbonylContact O-C 3.59Å; L237-Q240 PolarHBondContact O-N 3.47Å; L237-Q240 VanDerWaalsContact O-N 3.08Å; L237-L241 WeakPolarHBondContact O-CA 3.16Å; L237-L241 WeakPolarHBondContact O-CB 3.34Å; L237-L241 PolarHBondContact O-N 2.97Å |
| 238 | Q | 87.9 | Confident | 89.2 | Confident | 95 Ų | 95 | 75 Ų | 75 | 44% | 0.444 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -57.2 | -34.1 | 177.5 | -76 | 177.2 | -21.2 | 0 | 0 | 113.5 | A82 R234 H236 | A82-Q238 HydrophobicContact CB-CG 4.16Å; A82-Q238 WeakPolarHBondContact O-CG 3.45Å; A82-Q238 PolarHBondContact O-NE2 3.47Å; R234-Q238 HydrophobicContact CG-CG 4.33Å; R234-Q238 WeakPolarHBondContact O-CG 3.49Å; R234-Q238 PolarHBondContact O-N 2.87Å; H236-Q238 PolarHBondContact O-N 3.04Å |
| 239 | R | 89.1 | Confident | 89.2 | Confident | 199 Ų | 199 | 70.2 Ų | 70.2 | 75% | 0.751 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -70.9 | -30.8 | 178.4 | -70.9 | 175 | -171 | 169.3 | 4.5 | 113.1 | P235 H236 L237 | P235-R239 WeakPolarHBondContact O-CG 3.41Å; H236-R239 PolarHBondContact O-N 3.18Å; L237-R239 PolarHBondContact O-N 2.83Å |
| 240 | Q | 89.5 | Confident | 89.2 | Confident | 140 Ų | 140 | 70.9 Ų | 70.9 | 65% | 0.654 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -105.3 | -6.7 | -175.4 | -66.9 | -176.5 | -34.2 | 0 | 0 | 113.2 | H236 L237 V242 E243 Y244 | H236-Q240 PolarHBondContact O-N 2.98Å; L237-Q240 CarbonylContact O-C 3.59Å; L237-Q240 PolarHBondContact O-N 3.47Å; L237-Q240 VanDerWaalsContact O-N 3.08Å; Q240-V242 VanDerWaalsContact C-N 3.34Å; Q240-V242 PolarHBondContact O-N 2.95Å; Q240-E243 PolarHBondContact O-N 2.92Å; Q240-Y244 WeakPolarHBondContact O-CB 3.27Å; Q240-Y244 PolarHBondContact O-N 2.98Å |
| 241 | L | 90.8 | Very high | 89.1 | Confident | 5 Ų | 5 | 72.8 Ų | 72.8 | 3% | 0.026 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -53.9 | -47.7 | -172.8 | -173.1 | 69.8 | 0 | 0 | 0 | 112.6 | A82 V83 L237 E243 Y244 E245 L486 | A82-L241 HydrophobicContact CB-CD1 3.79Å; A82-L241 HydrophobicContact CB-CD2 3.63Å; A82-L241 HydrophobicContact CB-CG 4.21Å; V83-L241 HydrophobicContact CG2-CD2 4.1Å; L237-L241 WeakPolarHBondContact O-CA 3.16Å; L237-L241 WeakPolarHBondContact O-CB 3.34Å; L237-L241 PolarHBondContact O-N 2.97Å; L241-E243 VanDerWaalsContact C-N 3.32Å; L241-E243 PolarHBondContact O-N 3.45Å; L241-Y244 PolarHBondContact O-N 3.42Å; L241-E245 HydrophobicContact CD1-CG 4.03Å; L241-E245 VanDerWaalsContact CD1-OE1 3.28Å; L241-E245 WeakPolarHBondContact CD1-OE1 3.34Å; L241-E245 HydrophobicContact CG-CG 4.17Å; L241-E245 WeakPolarHBondContact CG-OE1 3.36Å; L241-E245 WeakPolarHBondContact O-CB 3.43Å; L241-E245 WeakPolarHBondContact O-CG 3.22Å; L241-E245 PolarHBondContact O-N 2.81Å; L241-L486 HydrophobicContact CD2-CD1 4.28Å; L241-L486 HydrophobicContact CD2-CD2 4.18Å |
| 242 | V | 91.2 | Very high | 88.9 | Confident | 34 Ų | 34 | 68.6 Ų | 68.6 | 21% | 0.206 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -59.1 | -44.4 | -176.5 | 175.3 | 0 | 0 | 0 | 0 | 111.8 | Q240 R246 L486 Q489 V490 | Q240-V242 VanDerWaalsContact C-N 3.34Å; Q240-V242 PolarHBondContact O-N 2.95Å; V242-R246 VanDerWaalsContact O-CB 3.24Å; V242-R246 WeakPolarHBondContact O-CB 3.18Å; V242-R246 PolarHBondContact O-N 3.07Å; V242-R246 VanDerWaalsContact O-N 3.15Å; V242-L486 HydrophobicContact CG2-CD1 4.12Å; V242-Q489 HydrophobicContact CG1-CB 4.25Å; V242-Q489 HydrophobicContact CG2-CB 4.21Å; V242-V490 HydrophobicContact CB-CG2 4.47Å; V242-V490 HydrophobicContact CG1-CG2 4.37Å; V242-V490 HydrophobicContact CG2-CG2 4.32Å |
| 243 | E | 91.5 | Very high | 88.7 | Confident | 114 Ų | 114 | 67.1 Ų | 67.1 | 53% | 0.533 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -72.1 | -44.5 | -179.7 | -168 | 65.1 | -172.3 | 0 | 0 | 110.5 | Q240 L241 E245 R246 T247 | Q240-E243 PolarHBondContact O-N 2.92Å; L241-E243 VanDerWaalsContact C-N 3.32Å; L241-E243 PolarHBondContact O-N 3.45Å; E243-E245 PolarHBondContact O-N 3.39Å; E243-R246 PolarHBondContact O-N 3.27Å; E243-R246 IonicContact OE2-NH1 2.77Å; E243-R246 PolarHBondContact OE2-NH1 2.91Å; E243-T247 PolarHBondContact O-N 3.4Å; E243-T247 PolarHBondContact O-OG1 3.27Å |
| 244 | Y | 89.9 | Confident | 88.6 | Confident | 81 Ų | 81 | 68.6 Ų | 68.6 | 32% | 0.318 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -57.4 | -51.2 | 177.6 | 176.6 | -97.1 | 0 | 0 | 0 | 112.3 | L75 A78 Q240 L241 R246 T247 K248 | L75-Y244 HydrophobicContact CD1-CE1 4.39Å; A78-Y244 HydrophobicContact CB-CD1 4.2Å; A78-Y244 HydrophobicContact CB-CE1 3.67Å; Q240-Y244 WeakPolarHBondContact O-CB 3.27Å; Q240-Y244 PolarHBondContact O-N 2.98Å; L241-Y244 PolarHBondContact O-N 3.42Å; Y244-R246 VanDerWaalsContact C-N 3.34Å; Y244-R246 PolarHBondContact O-N 3.49Å; Y244-T247 PolarHBondContact O-N 3.39Å; Y244-K248 HydrophobicContact CD2-CG 4.4Å; Y244-K248 HydrophobicContact CE1-CG 4.19Å; Y244-K248 HydrophobicContact CE2-CG 3.98Å; Y244-K248 WeakPolarHBondContact O-CB 3.33Å; Y244-K248 WeakPolarHBondContact O-CG 3.32Å; Y244-K248 PolarHBondContact O-N 2.95Å |
| 245 | E | 91.2 | Very high | 88.2 | Confident | 2 Ų | 2 | 71.6 Ų | 71.6 | 1% | 0.009 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -63.2 | -41.7 | 179.8 | -71.1 | -172.6 | -168.7 | 0 | 0 | 111.6 | L75 H79 L241 E243 K248 F249 V490 | L75-E245 HydrophobicContact CD1-CB 3.89Å; L75-E245 HydrophobicContact CD1-CG 3.68Å; H79-E245 WeakPolarHBondContact CB-OE1 3.42Å; H79-E245 IonicContact CE1-OE1 2.69Å; H79-E245 IonicContact CG-OE1 3.94Å; H79-E245 IonicContact ND1-OE1 2.74Å; H79-E245 PolarHBondContact ND1-OE1 3.37Å; H79-E245 IonicContact ND1-OE2 2.94Å; L241-E245 HydrophobicContact CD1-CG 4.03Å; L241-E245 VanDerWaalsContact CD1-OE1 3.28Å; L241-E245 WeakPolarHBondContact CD1-OE1 3.34Å; L241-E245 HydrophobicContact CG-CG 4.17Å; L241-E245 WeakPolarHBondContact CG-OE1 3.36Å; L241-E245 WeakPolarHBondContact O-CB 3.43Å; L241-E245 WeakPolarHBondContact O-CG 3.22Å; L241-E245 PolarHBondContact O-N 2.81Å; E243-E245 PolarHBondContact O-N 3.39Å; E245-K248 PolarHBondContact O-N 2.99Å; E245-F249 WeakPolarHBondContact O-CB 3.3Å; E245-F249 PolarHBondContact O-N 2.94Å; E245-V490 HydrophobicContact CB-CG1 3.64Å; E245-V490 HydrophobicContact CB-CG2 4.34Å; E245-V490 WeakPolarHBondContact OE2-CG2 3.43Å |
| 246 | R | 91.3 | Very high | 87.5 | Confident | 74 Ų | 74 | 71.4 Ų | 71.4 | 28% | 0.279 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -63.5 | -47.2 | 178.5 | -174.2 | -172.9 | -64.6 | 153.3 | -2.7 | 111.7 | V242 E243 Y244 F249 Q250 Q489 V490 F494 | V242-R246 VanDerWaalsContact O-CB 3.24Å; V242-R246 WeakPolarHBondContact O-CB 3.18Å; V242-R246 PolarHBondContact O-N 3.07Å; V242-R246 VanDerWaalsContact O-N 3.15Å; E243-R246 PolarHBondContact O-N 3.27Å; E243-R246 IonicContact OE2-NH1 2.77Å; E243-R246 PolarHBondContact OE2-NH1 2.91Å; Y244-R246 VanDerWaalsContact C-N 3.34Å; Y244-R246 PolarHBondContact O-N 3.49Å; R246-F249 PolarHBondContact O-N 2.79Å; R246-Q250 VanDerWaalsContact O-CB 3.3Å; R246-Q250 WeakPolarHBondContact O-CB 3.3Å; R246-Q250 PolarHBondContact O-N 2.76Å; R246-Q489 PolarHBondContact NH2-O 3.47Å; R246-V490 PolarHBondContact NE-O 3.33Å; R246-F494 HydrophobicContact CG-CE2 4.16Å; R246-F494 HydrophobicContact CG-CZ 4.33Å |
| 247 | T | 90.8 | Very high | 86.6 | Confident | 65 Ų | 65 | 71.9 Ų | 71.9 | 40% | 0.399 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -62.8 | -46.5 | 178.8 | -56.7 | 0 | 0 | 0 | 0 | 110.8 | E243 Y244 F249 Q250 E251 | E243-T247 PolarHBondContact O-N 3.4Å; E243-T247 PolarHBondContact O-OG1 3.27Å; Y244-T247 PolarHBondContact O-N 3.39Å; T247-F249 PolarHBondContact O-N 3.49Å; T247-Q250 WeakPolarHBondContact O-CB 3.46Å; T247-Q250 PolarHBondContact O-N 3.44Å; T247-E251 WeakPolarHBondContact O-CG 3.42Å; T247-E251 PolarHBondContact O-N 2.86Å |
| 248 | K | 87.7 | Confident | 85.8 | Confident | 51 Ų | 51 | 73.4 Ų | 73.4 | 22% | 0.222 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -65.9 | -38.4 | 178.5 | -73.6 | -47 | -169.2 | -169.3 | 0 | 113.2 | L75 Y244 E245 Q250 E251 I252 | L75-K248 HydrophobicContact CD1-CB 4.05Å; Y244-K248 HydrophobicContact CD2-CG 4.4Å; Y244-K248 HydrophobicContact CE1-CG 4.19Å; Y244-K248 HydrophobicContact CE2-CG 3.98Å; Y244-K248 WeakPolarHBondContact O-CB 3.33Å; Y244-K248 WeakPolarHBondContact O-CG 3.32Å; Y244-K248 PolarHBondContact O-N 2.95Å; E245-K248 PolarHBondContact O-N 2.99Å; K248-Q250 VanDerWaalsContact C-N 3.35Å; K248-E251 WeakPolarHBondContact CD-OE2 3.2Å; K248-E251 IonicContact NZ-OE1 2.95Å; K248-E251 PolarHBondContact NZ-OE1 3.47Å; K248-E251 IonicContact NZ-OE2 3.41Å; K248-E251 PolarHBondContact NZ-OE2 3.33Å; K248-E251 PolarHBondContact O-N 3.38Å; K248-I252 WeakPolarHBondContact O-CG1 3.3Å; K248-I252 PolarHBondContact O-N 3.25Å; K248-I252 VanDerWaalsContact O-N 3.14Å |
| 249 | F | 87.9 | Confident | 85.3 | Confident | 14 Ų | 14 | 70 Ų | 70 | 6% | 0.061 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -66.7 | -38.9 | 174.4 | -167.1 | -104.4 | 0 | 0 | 0 | 111.7 | E245 R246 T247 E251 I252 L253 L260 T321 Y491 F494 | E245-F249 WeakPolarHBondContact O-CB 3.3Å; E245-F249 PolarHBondContact O-N 2.94Å; R246-F249 PolarHBondContact O-N 2.79Å; T247-F249 PolarHBondContact O-N 3.49Å; F249-E251 PolarHBondContact O-N 2.96Å; F249-I252 PolarHBondContact O-N 2.8Å; F249-L253 HydrophobicContact CD1-CD1 3.82Å; F249-L253 HydrophobicContact CD1-CG 4.04Å; F249-L253 HydrophobicContact CE1-CD1 3.69Å; F249-L253 HydrophobicContact CE1-CD2 3.98Å; F249-L253 HydrophobicContact CE1-CG 3.9Å; F249-L253 HydrophobicContact CZ-CD2 4.18Å; F249-L253 HydrophobicContact CZ-CG 4.49Å; F249-L253 WeakPolarHBondContact O-CG 3.44Å; F249-L253 PolarHBondContact O-N 3.03Å; F249-L260 HydrophobicContact CE1-CD2 3.95Å; F249-L260 HydrophobicContact CZ-CD2 3.81Å; F249-T321 HydrophobicContact CE1-CG2 4.15Å; F249-T321 HydrophobicContact CZ-CG2 3.9Å; F249-Y491 HydrophobicContact CB-CE1 4.08Å; F249-Y491 AromaticContact CD1-CD1 3.88Å; F249-Y491 HydrophobicContact CD1-CD1 3.88Å; F249-Y491 AromaticContact CD1-CE1 3.72Å; F249-Y491 HydrophobicContact CD1-CE1 3.72Å; F249-Y491 AromaticContact CD2-CE1 3.75Å; F249-Y491 HydrophobicContact CD2-CE1 3.75Å; F249-Y491 AromaticContact CE1-CD1 3.98Å; F249-Y491 HydrophobicContact CE1-CD1 3.98Å; F249-Y491 AromaticContact CE1-CE1 3.98Å; F249-Y491 HydrophobicContact CE1-CE1 3.98Å; F249-Y491 HydrophobicContact CE2-CE1 4.03Å; F249-Y491 HydrophobicContact CG-CD1 4.22Å; F249-Y491 AromaticContact CG-CE1 3.58Å; F249-Y491 HydrophobicContact CG-CE1 3.58Å; F249-Y491 HydrophobicContact CZ-CD1 4.43Å; F249-Y491 HydrophobicContact CZ-CE1 4.14Å; F249-F494 HydrophobicContact CD1-CD2 4.07Å; F249-F494 HydrophobicContact CD1-CE1 4.29Å; F249-F494 AromaticContact CD1-CE2 3.68Å; F249-F494 HydrophobicContact CD1-CE2 3.68Å; F249-F494 AromaticContact CD1-CZ 3.8Å; F249-F494 HydrophobicContact CD1-CZ 3.8Å; F249-F494 HydrophobicContact CE1-CD2 4.27Å; F249-F494 HydrophobicContact CE1-CE2 4.33Å; F249-F494 HydrophobicContact CE1-CG 4.47Å |
| 250 | Q | 87.9 | Confident | 85 | Confident | 76 Ų | 76 | 61.9 Ų | 61.9 | 36% | 0.355 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -60.4 | -43.5 | 174.3 | -178.9 | 61.9 | 50.2 | 0 | 0 | 112 | R246 T247 K248 I252 L253 E254 F494 | R246-Q250 VanDerWaalsContact O-CB 3.3Å; R246-Q250 WeakPolarHBondContact O-CB 3.3Å; R246-Q250 PolarHBondContact O-N 2.76Å; T247-Q250 WeakPolarHBondContact O-CB 3.46Å; T247-Q250 PolarHBondContact O-N 3.44Å; K248-Q250 VanDerWaalsContact C-N 3.35Å; Q250-I252 VanDerWaalsContact C-N 3.32Å; Q250-I252 PolarHBondContact O-N 2.91Å; Q250-L253 PolarHBondContact O-N 3.4Å; Q250-E254 PolarHBondContact NE2-OE1 3.44Å; Q250-E254 WeakPolarHBondContact O-CG 3.48Å; Q250-E254 PolarHBondContact O-N 3.43Å; Q250-F494 HydrophobicContact CB-CZ 4.39Å; Q250-F494 VanDerWaalsContact OE1-CE1 3.25Å |
| 251 | E | 87.1 | Confident | 84.8 | Confident | 67 Ų | 67 | 60.1 Ų | 60.1 | 31% | 0.313 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -57.3 | -44.8 | 173.4 | -69.6 | 171 | -162.8 | 0 | 0 | 111.3 | T247 K248 F249 L253 E254 E255 | T247-E251 WeakPolarHBondContact O-CG 3.42Å; T247-E251 PolarHBondContact O-N 2.86Å; K248-E251 WeakPolarHBondContact CD-OE2 3.2Å; K248-E251 IonicContact NZ-OE1 2.95Å; K248-E251 PolarHBondContact NZ-OE1 3.47Å; K248-E251 IonicContact NZ-OE2 3.41Å; K248-E251 PolarHBondContact NZ-OE2 3.33Å; K248-E251 PolarHBondContact O-N 3.38Å; F249-E251 PolarHBondContact O-N 2.96Å; E251-L253 VanDerWaalsContact C-N 3.35Å; E251-L253 PolarHBondContact O-N 3.11Å; E251-E254 PolarHBondContact O-N 2.93Å; E251-E255 PolarHBondContact O-N 2.62Å |
| 252 | I | 83.3 | Confident | 84.5 | Confident | 21 Ų | 21 | 62.3 Ų | 62.3 | 11% | 0.108 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.5 | -41.1 | 178 | -66.1 | 165.2 | 0 | 0 | 0 | 111.3 | L75 K248 F249 Q250 E254 E255 T256 | L75-I252 HydrophobicContact CD2-CD1 4.44Å; K248-I252 WeakPolarHBondContact O-CG1 3.3Å; K248-I252 PolarHBondContact O-N 3.25Å; K248-I252 VanDerWaalsContact O-N 3.14Å; F249-I252 PolarHBondContact O-N 2.8Å; Q250-I252 VanDerWaalsContact C-N 3.32Å; Q250-I252 PolarHBondContact O-N 2.91Å; I252-E254 VanDerWaalsContact C-N 3.34Å; I252-E254 PolarHBondContact O-N 2.71Å; I252-E255 PolarHBondContact O-N 3.43Å; I252-T256 PolarHBondContact O-N 3.37Å; I252-T256 PolarHBondContact O-OG1 3.34Å |
| 253 | L | 82.9 | Confident | 84.3 | Confident | 23 Ų | 23 | 60.7 Ų | 60.7 | 12% | 0.12 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -67.2 | -33 | 178.3 | -68.2 | -179.6 | 0 | 0 | 0 | 113.1 | F249 Q250 E251 E255 T256 A259 L260 F494 | F249-L253 HydrophobicContact CD1-CD1 3.82Å; F249-L253 HydrophobicContact CD1-CG 4.04Å; F249-L253 HydrophobicContact CE1-CD1 3.69Å; F249-L253 HydrophobicContact CE1-CD2 3.98Å; F249-L253 HydrophobicContact CE1-CG 3.9Å; F249-L253 HydrophobicContact CZ-CD2 4.18Å; F249-L253 HydrophobicContact CZ-CG 4.49Å; F249-L253 WeakPolarHBondContact O-CG 3.44Å; F249-L253 PolarHBondContact O-N 3.03Å; Q250-L253 PolarHBondContact O-N 3.4Å; E251-L253 VanDerWaalsContact C-N 3.35Å; E251-L253 PolarHBondContact O-N 3.11Å; L253-E255 VanDerWaalsContact C-N 3.32Å; L253-T256 CarbonylContact O-C 3.17Å; L253-T256 PolarHBondContact O-N 3.4Å; L253-A259 HydrophobicContact CD2-CB 3.93Å; L253-L260 HydrophobicContact CD1-CD1 3.88Å; L253-L260 HydrophobicContact CD2-CD1 3.89Å; L253-L260 HydrophobicContact CD2-CD2 4.22Å; L253-L260 HydrophobicContact CD2-CG 3.65Å; L253-F494 HydrophobicContact CD1-CD1 3.57Å; L253-F494 HydrophobicContact CD1-CE1 3.35Å; L253-F494 HydrophobicContact CD1-CG 4.48Å; L253-F494 HydrophobicContact CD1-CZ 4.14Å |
| 254 | E | 84.4 | Confident | 84.1 | Confident | 133 Ų | 133 | 57.1 Ų | 57.1 | 62% | 0.621 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -68 | -34.9 | 175.6 | -74 | 172.1 | -163.2 | 0 | 0 | 111.8 | Q250 E251 I252 | Q250-E254 PolarHBondContact NE2-OE1 3.44Å; Q250-E254 WeakPolarHBondContact O-CG 3.48Å; Q250-E254 PolarHBondContact O-N 3.43Å; E251-E254 PolarHBondContact O-N 2.93Å; I252-E254 VanDerWaalsContact C-N 3.34Å; I252-E254 PolarHBondContact O-N 2.71Å |
| 255 | E | 81.4 | Confident | 84 | Confident | 93 Ų | 93 | 57.3 Ų | 57.3 | 44% | 0.435 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -74.9 | -30.6 | 173.1 | -66.8 | -177.8 | 170.7 | 0 | 0 | 112.3 | E251 I252 L253 | E251-E255 PolarHBondContact O-N 2.62Å; I252-E255 PolarHBondContact O-N 3.43Å; L253-E255 VanDerWaalsContact C-N 3.32Å |
| 256 | T | 76.9 | Confident | 83.9 | Confident | 56 Ų | 56 | 57.2 Ų | 57.2 | 34% | 0.344 | 30% | 0.303 | S | S | . | . | trans | -133.3 | 85.3 | -175.8 | 53.8 | 0 | 0 | 0 | 0 | 112.9 | I252 L253 S258 A259 | I252-T256 PolarHBondContact O-N 3.37Å; I252-T256 PolarHBondContact O-OG1 3.34Å; L253-T256 CarbonylContact O-C 3.17Å; L253-T256 PolarHBondContact O-N 3.4Å; T256-S258 PolarHBondContact O-N 2.87Å; T256-S258 VanDerWaalsContact O-N 3.12Å; T256-A259 WeakPolarHBondContact O-CB 3.42Å; T256-A259 PolarHBondContact O-N 2.9Å; T256-A259 VanDerWaalsContact O-N 3.08Å; T256-A259 WeakPolarHBondContact OG1-CB 3.45Å | ||
| 257 | P | 68.3 | Low | 83.8 | Confident | 120 Ų | 120 | 53.7 Ų | 53.7 | 78% | 0.779 | 29% | 0.289 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -20.6 | -174.3 | -24.6 | 34.2 | 0 | 0 | 0 | 115.8 | ||
| 258 | S | 71.8 | Confident | 83.6 | Confident | 79 Ų | 79 | 54.1 Ų | 54.1 | 55% | 0.552 | 29% | 0.286 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.6 | 11.2 | 177 | 61.4 | 0 | 0 | 0 | 0 | 113.6 | T256 L260 D261 | T256-S258 PolarHBondContact O-N 2.87Å; T256-S258 VanDerWaalsContact O-N 3.12Å; S258-L260 PolarHBondContact O-N 3.18Å; S258-L260 VanDerWaalsContact O-N 3.11Å; S258-D261 VanDerWaalsContact O-CG 3.32Å |
| 259 | A | 76.1 | Confident | 83.5 | Confident | 24 Ų | 24 | 55 Ų | 55 | 20% | 0.198 | 29% | 0.29 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.1 | 11.7 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | L253 T256 E320 | L253-A259 HydrophobicContact CD2-CB 3.93Å; T256-A259 WeakPolarHBondContact O-CB 3.42Å; T256-A259 PolarHBondContact O-N 2.9Å; T256-A259 VanDerWaalsContact O-N 3.08Å; T256-A259 WeakPolarHBondContact OG1-CB 3.45Å; A259-E320 WeakPolarHBondContact O-CB 3.32Å; A259-E320 WeakPolarHBondContact O-CG 3.34Å |
| 260 | L | 83.7 | Confident | 83.3 | Confident | 28 Ų | 28 | 54.3 Ų | 54.3 | 15% | 0.147 | 29% | 0.288 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -124.8 | 17 | 179.5 | -71.8 | 176.1 | 0 | 0 | 0 | 113.2 | F249 L253 S258 T263 T264 T321 | F249-L260 HydrophobicContact CE1-CD2 3.95Å; F249-L260 HydrophobicContact CZ-CD2 3.81Å; L253-L260 HydrophobicContact CD1-CD1 3.88Å; L253-L260 HydrophobicContact CD2-CD1 3.89Å; L253-L260 HydrophobicContact CD2-CD2 4.22Å; L253-L260 HydrophobicContact CD2-CG 3.65Å; S258-L260 PolarHBondContact O-N 3.18Å; S258-L260 VanDerWaalsContact O-N 3.11Å; L260-T263 HydrophobicContact CD2-CG2 4.48Å; L260-T263 PolarHBondContact O-N 3.08Å; L260-T264 VanDerWaalsContact O-CB 3.3Å; L260-T264 WeakPolarHBondContact O-CB 3.34Å; L260-T264 PolarHBondContact O-N 3.02Å; L260-T264 PolarHBondContact O-OG1 2.95Å; L260-T321 HydrophobicContact CD2-CG2 4Å |
| 261 | D | 85.3 | Confident | 83.1 | Confident | 102 Ų | 102 | 51.3 Ų | 51.3 | 55% | 0.545 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -64.7 | -43.4 | -176.5 | -70.1 | -15 | 0 | 0 | 0 | 110.7 | S258 T264 E265 E320 | S258-D261 VanDerWaalsContact O-CG 3.32Å; D261-T264 PolarHBondContact O-N 2.93Å; D261-E265 PolarHBondContact O-N 3.49Å; D261-E320 PolarHBondContact N-OE1 3.46Å |
| 262 | Q | 84.4 | Confident | 82.9 | Confident | 51 Ų | 51 | 51.4 Ų | 51.4 | 24% | 0.238 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -70.5 | -39.9 | -179.7 | -171.4 | 60 | 14.8 | 0 | 0 | 111.7 | T264 E265 W266 E317 L318 E320 | Q262-T264 VanDerWaalsContact C-N 3.27Å; Q262-T264 PolarHBondContact O-N 3.48Å; Q262-E265 PolarHBondContact O-N 2.77Å; Q262-W266 VanDerWaalsContact O-CB 3.27Å; Q262-W266 WeakPolarHBondContact O-CB 3.22Å; Q262-W266 PolarHBondContact O-N 3.21Å; Q262-E317 HydrophobicContact CG-CB 4.28Å; Q262-E317 PolarHBondContact NE2-O 3.37Å; Q262-L318 WeakPolarHBondContact CG-O 3.36Å; Q262-E320 VanDerWaalsContact CB-OE1 3.27Å; Q262-E320 WeakPolarHBondContact CB-OE1 3.47Å; Q262-E320 PolarHBondContact N-OE1 3.23Å |
| 263 | T | 86.9 | Confident | 82.8 | Confident | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.7 | -37.7 | 173.1 | -61.7 | 0 | 0 | 0 | 0 | 111.4 | L260 W266 I267 E320 T321 Y495 I498 | L260-T263 HydrophobicContact CD2-CG2 4.48Å; L260-T263 PolarHBondContact O-N 3.08Å; T263-W266 HydrophobicContact CG2-CE3 4.4Å; T263-I267 HydrophobicContact CG2-CD1 4.25Å; T263-I267 WeakPolarHBondContact O-CG1 3.24Å; T263-I267 PolarHBondContact O-N 3.43Å; T263-I267 VanDerWaalsContact O-N 3.16Å; T263-E320 VanDerWaalsContact CB-OE2 3.28Å; T263-E320 WeakPolarHBondContact CB-OE2 3.07Å; T263-E320 PolarHBondContact N-OE2 2.97Å; T263-E320 PolarHBondContact OG1-N 3.45Å; T263-E320 PolarHBondContact OG1-OE2 3.32Å; T263-T321 HydrophobicContact CG2-CG2 4.06Å; T263-T321 PolarHBondContact OG1-OG1 3.49Å; T263-Y495 HydrophobicContact CG2-CD1 4.07Å; T263-Y495 HydrophobicContact CG2-CE1 3.62Å; T263-I498 HydrophobicContact CG2-CD1 3.83Å |
| 264 | T | 87.3 | Confident | 82.6 | Confident | 39 Ų | 39 | 56.3 Ų | 56.3 | 24% | 0.239 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -69.5 | -46.8 | 178.4 | -60.1 | 0 | 0 | 0 | 0 | 111.6 | L260 D261 Q262 I267 K268 I498 | L260-T264 VanDerWaalsContact O-CB 3.3Å; L260-T264 WeakPolarHBondContact O-CB 3.34Å; L260-T264 PolarHBondContact O-N 3.02Å; L260-T264 PolarHBondContact O-OG1 2.95Å; D261-T264 PolarHBondContact O-N 2.93Å; Q262-T264 VanDerWaalsContact C-N 3.27Å; Q262-T264 PolarHBondContact O-N 3.48Å; T264-I267 PolarHBondContact O-N 2.88Å; T264-K268 VanDerWaalsContact O-CB 3.24Å; T264-K268 WeakPolarHBondContact O-CB 3.49Å; T264-K268 PolarHBondContact O-N 3.38Å; T264-I498 HydrophobicContact CG2-CG2 4.08Å |
| 265 | E | 87.5 | Confident | 82.2 | Confident | 85 Ų | 85 | 54 Ų | 54 | 40% | 0.397 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -64.2 | -40.9 | 176.9 | -73.2 | -59.2 | 132.1 | 0 | 0 | 111.8 | D261 Q262 I267 K268 E269 | D261-E265 PolarHBondContact O-N 3.49Å; Q262-E265 PolarHBondContact O-N 2.77Å; E265-I267 PolarHBondContact O-N 2.85Å; E265-K268 PolarHBondContact O-N 3.01Å; E265-K268 VanDerWaalsContact O-N 3.17Å; E265-K268 IonicContact OE1-NZ 2.77Å; E265-K268 PolarHBondContact OE1-NZ 3.35Å; E265-K268 IonicContact OE2-NZ 3.24Å; E265-K268 PolarHBondContact OE2-NZ 2.89Å; E265-E269 WeakPolarHBondContact O-CG 3.35Å; E265-E269 PolarHBondContact O-N 2.63Å |
| 266 | W | 90.1 | Very high | 81.9 | Confident | 1 Ų | 1 | 56.4 Ų | 56.4 | 0% | 0.004 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -57.9 | -43.2 | 174.8 | 168.3 | 62.9 | 0 | 0 | 0 | 113.2 | Q262 T263 S270 L301 S304 Y305 L308 W311 P319 L322 Y495 | Q262-W266 VanDerWaalsContact O-CB 3.27Å; Q262-W266 WeakPolarHBondContact O-CB 3.22Å; Q262-W266 PolarHBondContact O-N 3.21Å; T263-W266 HydrophobicContact CG2-CE3 4.4Å; W266-S270 PolarHBondContact O-OG 2.92Å; W266-L301 HydrophobicContact CH2-CD1 4.24Å; W266-L301 HydrophobicContact CZ3-CD1 4.41Å; W266-S304 VanDerWaalsContact CE2-CB 3.49Å; W266-S304 WeakPolarHBondContact CZ2-O 3.33Å; W266-S304 PolarHBondContact NE1-O 3.43Å; W266-Y305 AromaticContact CH2-CD1 3.9Å; W266-Y305 HydrophobicContact CH2-CD1 3.9Å; W266-Y305 AromaticContact CH2-CE1 3.72Å; W266-Y305 HydrophobicContact CH2-CE1 3.72Å; W266-Y305 HydrophobicContact CH2-CE2 4.39Å; W266-Y305 HydrophobicContact CH2-CG 4.3Å; W266-Y305 AromaticContact CH2-CZ 3.98Å; W266-Y305 AromaticContact CZ2-CD1 3.99Å; W266-Y305 HydrophobicContact CZ2-CD1 3.99Å; W266-Y305 HydrophobicContact CZ2-CE1 4.27Å; W266-Y305 HydrophobicContact CZ2-CG 4.29Å; W266-L308 HydrophobicContact CZ2-CD1 3.83Å; W266-L308 HydrophobicContact CZ2-CG 4.17Å; W266-W311 AromaticContact CD1-CZ3 3.9Å; W266-P319 HydrophobicContact CB-CG 3.88Å; W266-P319 HydrophobicContact CD2-CB 4.35Å; W266-P319 HydrophobicContact CD2-CG 3.58Å; W266-P319 HydrophobicContact CE3-CB 4.08Å; W266-P319 HydrophobicContact CE3-CG 3.81Å; W266-P319 HydrophobicContact CG-CG 3.61Å; W266-L322 HydrophobicContact CH2-CD1 4.12Å; W266-L322 HydrophobicContact CZ2-CD1 4.28Å; W266-L322 HydrophobicContact CZ3-CD1 4.49Å; W266-Y495 HydrophobicContact CZ3-CE1 4.26Å |
| 267 | I | 87.4 | Confident | 81.6 | Confident | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -69.2 | -41.9 | 176 | -68.6 | 172.1 | 0 | 0 | 0 | 110.6 | T263 T264 E265 E269 S270 V271 V300 Y495 I498 L499 L502 | T263-I267 HydrophobicContact CG2-CD1 4.25Å; T263-I267 WeakPolarHBondContact O-CG1 3.24Å; T263-I267 PolarHBondContact O-N 3.43Å; T263-I267 VanDerWaalsContact O-N 3.16Å; T264-I267 PolarHBondContact O-N 2.88Å; E265-I267 PolarHBondContact O-N 2.85Å; I267-E269 PolarHBondContact O-N 3.43Å; I267-S270 WeakPolarHBondContact O-CB 3.34Å; I267-S270 PolarHBondContact O-N 2.92Å; I267-S270 VanDerWaalsContact O-N 3.08Å; I267-V271 HydrophobicContact CG2-CG2 4.25Å; I267-V271 WeakPolarHBondContact O-CG2 3.32Å; I267-V271 PolarHBondContact O-N 3.43Å; I267-V300 HydrophobicContact CG2-CG1 4.43Å; I267-Y495 HydrophobicContact CD1-CD1 3.72Å; I267-Y495 HydrophobicContact CD1-CE1 4.38Å; I267-Y495 HydrophobicContact CD1-CG 4.4Å; I267-I498 HydrophobicContact CB-CG2 4.39Å; I267-I498 HydrophobicContact CD1-CB 4.38Å; I267-I498 HydrophobicContact CD1-CD1 4.28Å; I267-I498 HydrophobicContact CD1-CG2 4.01Å; I267-I498 HydrophobicContact CG2-CG2 4.38Å; I267-L499 HydrophobicContact CG2-CD2 3.49Å; I267-L499 VanDerWaalsContact CG2-CD2 3.49Å; I267-L499 HydrophobicContact CG2-CG 4.1Å; I267-L502 HydrophobicContact CB-CD1 4.44Å; I267-L502 HydrophobicContact CG2-CD1 3.93Å |
| 268 | K | 86.4 | Confident | 81.6 | Confident | 73 Ų | 73 | 53.8 Ų | 53.8 | 32% | 0.317 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -63.4 | -39.2 | -179.3 | -178.7 | -179.5 | 165.1 | -156.5 | 0 | 112.9 | T264 E265 S270 V271 N272 L502 | T264-K268 VanDerWaalsContact O-CB 3.24Å; T264-K268 WeakPolarHBondContact O-CB 3.49Å; T264-K268 PolarHBondContact O-N 3.38Å; E265-K268 PolarHBondContact O-N 3.01Å; E265-K268 VanDerWaalsContact O-N 3.17Å; E265-K268 IonicContact OE1-NZ 2.77Å; E265-K268 PolarHBondContact OE1-NZ 3.35Å; E265-K268 IonicContact OE2-NZ 3.24Å; E265-K268 PolarHBondContact OE2-NZ 2.89Å; K268-S270 PolarHBondContact O-N 3.46Å; K268-V271 PolarHBondContact O-N 3.37Å; K268-N272 WeakPolarHBondContact O-CB 3.26Å; K268-N272 VanDerWaalsContact O-CG 3.27Å; K268-N272 PolarHBondContact O-N 3.43Å; K268-N272 PolarHBondContact O-ND2 2.97Å; K268-L502 HydrophobicContact CB-CD1 4.06Å; K268-L502 HydrophobicContact CB-CD2 4.38Å; K268-L502 HydrophobicContact CD-CD2 4.33Å; K268-L502 HydrophobicContact CG-CD2 4.35Å |
| 269 | E | 85.8 | Confident | 81.1 | Confident | 69 Ų | 69 | 52.9 Ų | 52.9 | 32% | 0.322 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -53.8 | -41.1 | 171.2 | -76.1 | -174.1 | 173.2 | 0 | 0 | 111.2 | E265 I267 E273 K307 K316 | E265-E269 WeakPolarHBondContact O-CG 3.35Å; E265-E269 PolarHBondContact O-N 2.63Å; I267-E269 PolarHBondContact O-N 3.43Å; E269-E273 PolarHBondContact O-N 3.46Å; E269-K307 PolarHBondContact O-NZ 3.4Å; E269-K316 IonicContact OE1-NZ 3.35Å; E269-K316 IonicContact OE2-NZ 3.88Å |
| 270 | S | 84.1 | Confident | 80.4 | Confident | 1 Ų | 1 | 58.7 Ų | 58.7 | 1% | 0.007 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -76.9 | -35.7 | 179.9 | -55.8 | 0 | 0 | 0 | 0 | 113.1 | W266 I267 K268 E274 S304 K307 | W266-S270 PolarHBondContact O-OG 2.92Å; I267-S270 WeakPolarHBondContact O-CB 3.34Å; I267-S270 PolarHBondContact O-N 2.92Å; I267-S270 VanDerWaalsContact O-N 3.08Å; K268-S270 PolarHBondContact O-N 3.46Å; S270-E274 WeakPolarHBondContact O-CG 3.43Å; S270-E274 PolarHBondContact O-N 3.43Å; S270-E274 VanDerWaalsContact O-N 3.1Å; S270-S304 WeakPolarHBondContact CB-OG 3.28Å; S270-S304 VanDerWaalsContact OG-CA 3.26Å; S270-S304 WeakPolarHBondContact OG-CA 3.45Å; S270-S304 PolarHBondContact OG-OG 3.07Å; S270-K307 VanDerWaalsContact OG-CE 3.29Å; S270-K307 WeakPolarHBondContact OG-CE 3.5Å; S270-K307 PolarHBondContact OG-NZ 3.38Å |
| 271 | V | 83.3 | Confident | 79.1 | Confident | 13 Ų | 13 | 61.1 Ų | 61.1 | 8% | 0.079 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -60.2 | -46.8 | 171.6 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | I267 K268 E274 L275 L295 V300 L499 L503 | I267-V271 HydrophobicContact CG2-CG2 4.25Å; I267-V271 WeakPolarHBondContact O-CG2 3.32Å; I267-V271 PolarHBondContact O-N 3.43Å; K268-V271 PolarHBondContact O-N 3.37Å; V271-E274 PolarHBondContact O-N 3.46Å; V271-L275 WeakPolarHBondContact O-CB 3.33Å; V271-L275 PolarHBondContact O-N 2.9Å; V271-L295 HydrophobicContact CG1-CD2 4.24Å; V271-V300 HydrophobicContact CG2-CG1 3.55Å; V271-L499 HydrophobicContact CG2-CD2 4.35Å; V271-L503 HydrophobicContact CG1-CD2 4.06Å; V271-L503 HydrophobicContact CG2-CD2 4.48Å |
| 272 | N | 83.1 | Confident | 77.6 | Confident | 69 Ų | 69 | 60 Ų | 60 | 37% | 0.369 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.7 | -47.8 | -178.1 | -71.9 | -21.6 | 0 | 0 | 0 | 111.2 | K268 E274 L275 F276 | K268-N272 WeakPolarHBondContact O-CB 3.26Å; K268-N272 VanDerWaalsContact O-CG 3.27Å; K268-N272 PolarHBondContact O-N 3.43Å; K268-N272 PolarHBondContact O-ND2 2.97Å; N272-E274 PolarHBondContact O-N 3.43Å; N272-L275 WeakPolarHBondContact O-CB 3.4Å; N272-L275 PolarHBondContact O-N 3.23Å; N272-F276 HydrophobicContact CB-CD2 4.48Å; N272-F276 HydrophobicContact CB-CE2 4.4Å; N272-F276 WeakPolarHBondContact O-CD2 3.35Å; N272-F276 PolarHBondContact O-N 3.37Å |
| 273 | E | 81 | Confident | 76 | Confident | 109 Ų | 109 | 64.4 Ų | 64.4 | 51% | 0.509 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.9 | -42.8 | 177.3 | -80.3 | 177.2 | -148.8 | 0 | 0 | 113.1 | E269 L275 F276 S277 K307 | E269-E273 PolarHBondContact O-N 3.46Å; E273-L275 VanDerWaalsContact C-N 3.32Å; E273-L275 PolarHBondContact O-N 2.79Å; E273-F276 PolarHBondContact O-N 3.3Å; E273-S277 PolarHBondContact O-N 2.88Å; E273-K307 IonicContact OE1-NZ 3.21Å; E273-K307 PolarHBondContact OE1-NZ 2.88Å; E273-K307 WeakPolarHBondContact OE2-CE 3.45Å; E273-K307 IonicContact OE2-NZ 3.66Å; E273-K307 PolarHBondContact OE2-NZ 3.44Å |
| 274 | E | 78.8 | Confident | 74 | Confident | 37 Ų | 37 | 69 Ų | 69 | 17% | 0.173 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.1 | -41.1 | 175.9 | -72.6 | -64.2 | 128 | 0 | 0 | 111.1 | S270 V271 N272 S277 L278 L295 V300 N303 | S270-E274 WeakPolarHBondContact O-CG 3.43Å; S270-E274 PolarHBondContact O-N 3.43Å; S270-E274 VanDerWaalsContact O-N 3.1Å; V271-E274 PolarHBondContact O-N 3.46Å; N272-E274 PolarHBondContact O-N 3.43Å; E274-S277 PolarHBondContact O-N 3.49Å; E274-S277 PolarHBondContact O-OG 2.66Å; E274-L278 VanDerWaalsContact O-CG 3.27Å; E274-L278 WeakPolarHBondContact O-CG 3.37Å; E274-L278 PolarHBondContact O-N 2.97Å; E274-L295 HydrophobicContact CB-CD2 3.65Å; E274-L295 HydrophobicContact CB-CG 4.32Å; E274-V300 HydrophobicContact CG-CG2 4.42Å; E274-N303 PolarHBondContact OE1-ND2 2.72Å |
| 275 | L | 77.4 | Confident | 71.7 | Confident | 84 Ų | 84 | 73.7 Ų | 73.7 | 44% | 0.44 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -63.4 | -41.8 | 175.7 | -171.4 | 67.2 | 0 | 0 | 0 | 112.1 | V271 N272 E273 L278 S279 P293 L295 | V271-L275 WeakPolarHBondContact O-CB 3.33Å; V271-L275 PolarHBondContact O-N 2.9Å; N272-L275 WeakPolarHBondContact O-CB 3.4Å; N272-L275 PolarHBondContact O-N 3.23Å; E273-L275 VanDerWaalsContact C-N 3.32Å; E273-L275 PolarHBondContact O-N 2.79Å; L275-L278 PolarHBondContact O-N 2.98Å; L275-S279 PolarHBondContact O-N 3.3Å; L275-P293 HydrophobicContact CD1-CG 4.33Å; L275-L295 HydrophobicContact CD1-CD1 4.23Å |
| 276 | F | 73.8 | Confident | 69.8 | Low | 145 Ų | 145 | 73.5 Ų | 73.5 | 64% | 0.636 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -61.8 | -46.1 | 174.1 | -80.9 | -67.1 | 0 | 0 | 0 | 111.4 | N272 E273 L278 S279 E280 | N272-F276 HydrophobicContact CB-CD2 4.48Å; N272-F276 HydrophobicContact CB-CE2 4.4Å; N272-F276 WeakPolarHBondContact O-CD2 3.35Å; N272-F276 PolarHBondContact O-N 3.37Å; E273-F276 PolarHBondContact O-N 3.3Å; F276-L278 VanDerWaalsContact C-N 3.32Å; F276-L278 PolarHBondContact O-N 2.94Å; F276-S279 PolarHBondContact O-N 3.29Å; F276-S279 VanDerWaalsContact O-N 3.11Å; F276-S279 PolarHBondContact O-OG 3.4Å; F276-E280 PolarHBondContact O-N 3.15Å |
| 277 | S | 72.1 | Confident | 67.4 | Low | 53 Ų | 53 | 78 Ų | 78 | 37% | 0.371 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.7 | -36.7 | 179.1 | 75.1 | 0 | 0 | 0 | 0 | 113.2 | E273 E274 E280 S281 | E273-S277 PolarHBondContact O-N 2.88Å; E274-S277 PolarHBondContact O-N 3.49Å; E274-S277 PolarHBondContact O-OG 2.66Å; S277-E280 PolarHBondContact O-N 2.68Å; S277-S281 PolarHBondContact O-N 2.84Å; S277-S281 VanDerWaalsContact O-N 3.07Å |
| 278 | L | 68.1 | Low | 65.4 | Low | 68 Ų | 68 | 86.9 Ų | 86.9 | 36% | 0.356 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -70.1 | -34.3 | 175.2 | -69.5 | 169.3 | 0 | 0 | 0 | 111.6 | E274 L275 F276 S281 A282 P293 L295 | E274-L278 VanDerWaalsContact O-CG 3.27Å; E274-L278 WeakPolarHBondContact O-CG 3.37Å; E274-L278 PolarHBondContact O-N 2.97Å; L275-L278 PolarHBondContact O-N 2.98Å; F276-L278 VanDerWaalsContact C-N 3.32Å; F276-L278 PolarHBondContact O-N 2.94Å; L278-S281 PolarHBondContact O-N 3.48Å; L278-A282 WeakPolarHBondContact O-CB 3.48Å; L278-A282 PolarHBondContact O-N 3.12Å; L278-P293 HydrophobicContact CB-CB 4.46Å; L278-P293 HydrophobicContact CD1-CB 3.91Å; L278-L295 HydrophobicContact CD1-CD1 3.6Å; L278-L295 HydrophobicContact CD1-CG 4.04Å |
| 279 | S | 61.3 | Low | 63.2 | Low | 59 Ų | 59 | 90.7 Ų | 90.7 | 41% | 0.413 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.2 | -36.4 | 175.4 | 76.3 | 0 | 0 | 0 | 0 | 112.7 | L275 F276 A282 L283 | L275-S279 PolarHBondContact O-N 3.3Å; F276-S279 PolarHBondContact O-N 3.29Å; F276-S279 VanDerWaalsContact O-N 3.11Å; F276-S279 PolarHBondContact O-OG 3.4Å; S279-A282 PolarHBondContact O-N 2.97Å; S279-L283 WeakPolarHBondContact O-CG 3.49Å |
| 280 | E | 60.1 | Low | 61.4 | Low | 146 Ų | 146 | 94.8 Ų | 94.8 | 68% | 0.682 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -69.1 | -41.1 | 173.4 | -73.5 | -173.1 | 161.7 | 0 | 0 | 112.1 | F276 S277 A282 L283 | F276-E280 PolarHBondContact O-N 3.15Å; S277-E280 PolarHBondContact O-N 2.68Å; E280-A282 VanDerWaalsContact C-N 3.28Å; E280-A282 PolarHBondContact O-N 3.28Å; E280-L283 PolarHBondContact O-N 3.35Å |
| 281 | S | 57.6 | Low | 59.6 | Low | 79 Ų | 79 | 99.3 Ų | 99.3 | 55% | 0.552 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -69.6 | -23.6 | 176.9 | -171.7 | 0 | 0 | 0 | 0 | 113.2 | S277 L278 L283 T284 | S277-S281 PolarHBondContact O-N 2.84Å; S277-S281 VanDerWaalsContact O-N 3.07Å; L278-S281 PolarHBondContact O-N 3.48Å; S281-L283 VanDerWaalsContact C-N 3.29Å; S281-T284 PolarHBondContact O-OG1 3.28Å |
| 282 | A | 53.4 | Low | 58.1 | Low | 79 Ų | 79 | 108 Ų | 108 | 65% | 0.653 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | -14.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | L278 S279 E280 T284 | L278-A282 WeakPolarHBondContact O-CB 3.48Å; L278-A282 PolarHBondContact O-N 3.12Å; S279-A282 PolarHBondContact O-N 2.97Å; E280-A282 VanDerWaalsContact C-N 3.28Å; E280-A282 PolarHBondContact O-N 3.28Å; A282-T284 VanDerWaalsContact C-N 3.31Å |
| 283 | L | 49.6 | Very low | 56.6 | Low | 144 Ų | 144 | 108.3 Ų | 108.3 | 75% | 0.754 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | -1.3 | 177.4 | -68.3 | 166.6 | 0 | 0 | 0 | 113.5 | S279 E280 S281 | S279-L283 WeakPolarHBondContact O-CG 3.49Å; E280-L283 PolarHBondContact O-N 3.35Å; S281-L283 VanDerWaalsContact C-N 3.29Å |
| 284 | T | 44.8 | Very low | 55.6 | Low | 96 Ų | 96 | 108.5 Ų | 108.5 | 59% | 0.589 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -72.2 | 121 | 168.8 | 54.7 | 0 | 0 | 0 | 0 | 110 | S281 A282 G286 | S281-T284 PolarHBondContact O-OG1 3.28Å; A282-T284 VanDerWaalsContact C-N 3.31Å; T284-G286 PolarHBondContact O-N 3.21Å; T284-G286 VanDerWaalsContact O-N 3.12Å |
| 285 | P | 40.7 | Very low | 55.2 | Low | 137 Ų | 137 | 108 Ų | 108 | 89% | 0.89 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.5 | 107.8 | -172.2 | 29.8 | -34.7 | 0 | 0 | 0 | 110.2 | ||
| 286 | G | 47 | Very low | 55.3 | Low | 82 Ų | 82 | 106.8 Ų | 106.8 | 85% | 0.845 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 162.9 | -7 | 171.1 | 0 | 0 | 0 | 0 | 0 | 118.6 | T284 | T284-G286 PolarHBondContact O-N 3.21Å; T284-G286 VanDerWaalsContact O-N 3.12Å |
| 287 | A | 39.7 | Very low | 55.6 | Low | 96 Ų | 96 | 102.7 Ų | 102.7 | 79% | 0.793 | 63% | 0.632 | S | S | * | * | trans | -119.3 | 85.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | N289 | A287-N289 PolarHBondContact O-N 3.44Š| ||
| 288 | E | 45.1 | Very low | 56.1 | Low | 185 Ų | 185 | 104.6 Ų | 104.6 | 86% | 0.864 | 64% | 0.641 | S | S | * | * | trans | -65.2 | 111.5 | 155.7 | -67.7 | -176.6 | 171 | 0 | 0 | 107.3 | ||||
| 289 | N | 40.2 | Very low | 56.7 | Low | 153 Ų | 153 | 104.1 Ų | 104.1 | 82% | 0.818 | 64% | 0.639 | S | S | * | * | trans | -165.5 | 123.8 | 149.9 | -87.5 | -32 | 0 | 0 | 0 | 112 | A287 S291 | A287-N289 PolarHBondContact O-N 3.44Å; N289-S291 PolarHBondContact O-N 3.19Å | ||
| 290 | T | 47.3 | Very low | 57.8 | Low | 156 Ų | 156 | 101.4 Ų | 101.4 | 96% | 0.957 | 62% | 0.62 | S | S | * | * | trans | -65.6 | 78 | 177.9 | 10.5 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 291 | S | 47.1 | Very low | 59 | Low | 95 Ų | 95 | 95.3 Ų | 95.3 | 66% | 0.664 | 59% | 0.592 | S | S | * | * | trans | -133.4 | 129.3 | 160.5 | 62.8 | 0 | 0 | 0 | 0 | 109.6 | N289 | N289-S291 PolarHBondContact O-N 3.19Š| ||
| 292 | K | 52.3 | Low | 60.4 | Low | 195 Ų | 195 | 91.8 Ų | 91.8 | 85% | 0.848 | 57% | 0.567 | S | S | * | * | trans | -51.2 | 135.6 | 168.9 | -78.6 | -179.1 | 175.6 | -179.3 | 0 | 107.6 | S294 | K292-S294 PolarHBondContact O-N 3.13Š| ||
| 293 | P | 51 | Low | 61.9 | Low | 76 Ų | 76 | 88.7 Ų | 88.7 | 49% | 0.494 | 54% | 0.539 | S | S | . | . | trans | -56.4 | 108.6 | 175.2 | 20.6 | -29.5 | 0 | 0 | 0 | 108.6 | L275 L278 L295 | L275-P293 HydrophobicContact CD1-CG 4.33Å; L278-P293 HydrophobicContact CB-CB 4.46Å; L278-P293 HydrophobicContact CD1-CB 3.91Å; P293-L295 PolarHBondContact O-N 3.13Å | ||
| 294 | S | 59.6 | Low | 63.6 | Low | 114 Ų | 114 | 81.9 Ų | 81.9 | 80% | 0.797 | 50% | 0.503 | S | S | * | . | trans | -83.3 | 94 | 177.4 | 51.2 | 0 | 0 | 0 | 0 | 108.3 | K292 S296 | K292-S294 PolarHBondContact O-N 3.13Å; S294-S296 PolarHBondContact O-N 3.15Å | ||
| 295 | L | 71.5 | Confident | 65.7 | Low | 27 Ų | 27 | 77.3 Ų | 77.3 | 14% | 0.141 | 48% | 0.476 | C | S | . | . | trans | -61.8 | 126.8 | 169.6 | -84.1 | 78 | 0 | 0 | 0 | 108.6 | V271 E274 L275 L278 P293 P297 V300 L503 | V271-L295 HydrophobicContact CG1-CD2 4.24Å; E274-L295 HydrophobicContact CB-CD2 3.65Å; E274-L295 HydrophobicContact CB-CG 4.32Å; L275-L295 HydrophobicContact CD1-CD1 4.23Å; L278-L295 HydrophobicContact CD1-CD1 3.6Å; L278-L295 HydrophobicContact CD1-CG 4.04Å; P293-L295 PolarHBondContact O-N 3.13Å; L295-P297 VanDerWaalsContact O-CD 3.3Å; L295-P297 WeakPolarHBondContact O-CD 3.17Å; L295-V300 HydrophobicContact CB-CG2 4.16Å; L295-V300 HydrophobicContact CD2-CG2 3.73Å; L295-V300 HydrophobicContact CG-CG2 4.41Å; L295-L503 HydrophobicContact CB-CD2 4.28Å; L295-L503 HydrophobicContact CD2-CD2 4.39Å | ||
| 296 | S | 79.1 | Confident | 67.9 | Low | 57 Ų | 57 | 71.6 Ų | 71.6 | 40% | 0.399 | 44% | 0.437 | S | S | . | . | trans | -72.7 | 119.4 | 169.9 | 175.5 | 0 | 0 | 0 | 0 | 108.9 | S294 T298 L299 V300 | S294-S296 PolarHBondContact O-N 3.15Å; S296-T298 PolarHBondContact O-N 3.14Å; S296-L299 WeakPolarHBondContact O-CB 3.29Å; S296-L299 PolarHBondContact O-N 2.93Å; S296-V300 PolarHBondContact O-N 3.13Å; S296-V300 VanDerWaalsContact O-N 3.08Å | ||
| 297 | P | 81 | Confident | 69.7 | Low | 60 Ų | 60 | 69.1 Ų | 69.1 | 39% | 0.39 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -56.8 | -34.3 | 179.2 | -25.8 | 35.4 | 0 | 0 | 0 | 112.6 | L295 L301 L499 L503 | L295-P297 VanDerWaalsContact O-CD 3.3Å; L295-P297 WeakPolarHBondContact O-CD 3.17Å; P297-L301 WeakPolarHBondContact O-CB 3.43Å; P297-L301 PolarHBondContact O-N 3.46Å; P297-L499 HydrophobicContact CB-CD1 3.99Å; P297-L503 HydrophobicContact CG-CD1 4.11Å |
| 298 | T | 81 | Confident | 72 | Confident | 93 Ų | 93 | 64.6 Ų | 64.6 | 57% | 0.571 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -67.4 | -38.9 | 176.6 | -48.5 | 0 | 0 | 0 | 0 | 112.3 | S296 N302 | S296-T298 PolarHBondContact O-N 3.14Å; T298-N302 WeakPolarHBondContact O-CB 3.24Å; T298-N302 VanDerWaalsContact O-CG 3.26Å; T298-N302 PolarHBondContact O-N 2.84Å |
| 299 | L | 81.4 | Confident | 73.8 | Confident | 58 Ų | 58 | 56.1 Ų | 56.1 | 30% | 0.304 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -67.5 | -45.5 | 177.8 | -179.9 | 62.9 | 0 | 0 | 0 | 110.9 | S296 L301 N302 N303 | S296-L299 WeakPolarHBondContact O-CB 3.29Å; S296-L299 PolarHBondContact O-N 2.93Å; L299-L301 VanDerWaalsContact C-N 3.34Å; L299-L301 PolarHBondContact O-N 2.97Å; L299-N302 PolarHBondContact O-N 3.3Å; L299-N303 PolarHBondContact O-N 3.21Å; L299-N303 PolarHBondContact O-ND2 3.42Å |
| 300 | V | 84.3 | Confident | 75.8 | Confident | 1 Ų | 1 | 53.6 Ų | 53.6 | 1% | 0.006 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -55.4 | -52.4 | 175.6 | 173.4 | 0 | 0 | 0 | 0 | 109.9 | I267 V271 E274 L295 S296 N302 N303 S304 L499 | I267-V300 HydrophobicContact CG2-CG1 4.43Å; V271-V300 HydrophobicContact CG2-CG1 3.55Å; E274-V300 HydrophobicContact CG-CG2 4.42Å; L295-V300 HydrophobicContact CB-CG2 4.16Å; L295-V300 HydrophobicContact CD2-CG2 3.73Å; L295-V300 HydrophobicContact CG-CG2 4.41Å; S296-V300 PolarHBondContact O-N 3.13Å; S296-V300 VanDerWaalsContact O-N 3.08Å; V300-N302 PolarHBondContact O-N 3.18Å; V300-N303 PolarHBondContact O-N 3.38Å; V300-N303 VanDerWaalsContact O-N 3.16Å; V300-S304 PolarHBondContact O-N 2.83Å; V300-S304 PolarHBondContact O-OG 2.97Å; V300-L499 HydrophobicContact CB-CD2 4.46Å; V300-L499 HydrophobicContact CG1-CD2 3.98Å |
| 301 | L | 85.5 | Confident | 77.5 | Confident | 18 Ų | 18 | 47.1 Ų | 47.1 | 9% | 0.094 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -61.6 | -42.4 | -179 | -176.6 | 62.1 | 0 | 0 | 0 | 112.1 | W266 P297 L299 N303 S304 Y305 K488 Y495 | W266-L301 HydrophobicContact CH2-CD1 4.24Å; W266-L301 HydrophobicContact CZ3-CD1 4.41Å; P297-L301 WeakPolarHBondContact O-CB 3.43Å; P297-L301 PolarHBondContact O-N 3.46Å; L299-L301 VanDerWaalsContact C-N 3.34Å; L299-L301 PolarHBondContact O-N 2.97Å; L301-N303 VanDerWaalsContact C-N 3.33Å; L301-N303 PolarHBondContact O-N 3.48Å; L301-S304 WeakPolarHBondContact O-CB 3.43Å; L301-S304 PolarHBondContact O-N 3.41Å; L301-Y305 HydrophobicContact CD1-CD2 4.26Å; L301-Y305 HydrophobicContact CD1-CE2 3.64Å; L301-Y305 HydrophobicContact CD2-CE2 4.13Å; L301-Y305 HydrophobicContact CG-CD2 4.07Å; L301-Y305 HydrophobicContact CG-CE2 3.57Å; L301-Y305 WeakPolarHBondContact O-CD2 3.4Å; L301-Y305 PolarHBondContact O-N 2.73Å; L301-K488 HydrophobicContact CD2-CG 4.19Å; L301-Y495 HydrophobicContact CD1-CD2 4.13Å; L301-Y495 HydrophobicContact CD1-CE2 4.47Å; L301-Y495 HydrophobicContact CD1-CG 4.27Å; L301-Y495 HydrophobicContact CD2-CD2 4.06Å |
| 302 | N | 86.3 | Confident | 79 | Confident | 5 Ų | 5 | 45.4 Ų | 45.4 | 3% | 0.027 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -61.2 | -41.1 | 175.1 | -78.2 | -2.5 | 0 | 0 | 0 | 112.3 | T298 L299 V300 Y305 L306 K488 | T298-N302 WeakPolarHBondContact O-CB 3.24Å; T298-N302 VanDerWaalsContact O-CG 3.26Å; T298-N302 PolarHBondContact O-N 2.84Å; L299-N302 PolarHBondContact O-N 3.3Å; V300-N302 PolarHBondContact O-N 3.18Å; N302-Y305 PolarHBondContact O-N 3.45Å; N302-L306 WeakPolarHBondContact O-CG 3.45Å; N302-L306 PolarHBondContact O-N 2.89Å; N302-K488 WeakPolarHBondContact OD1-CE 3.31Å; N302-K488 PolarHBondContact OD1-NZ 2.77Å |
| 303 | N | 84.6 | Confident | 80.3 | Confident | 15 Ų | 15 | 38 Ų | 38 | 8% | 0.08 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -68.4 | -37.4 | 176.4 | -67.7 | -23.7 | 0 | 0 | 0 | 111.3 | E274 L299 V300 L301 Y305 L306 K307 K447 | E274-N303 PolarHBondContact OE1-ND2 2.72Å; L299-N303 PolarHBondContact O-N 3.21Å; L299-N303 PolarHBondContact O-ND2 3.42Å; V300-N303 PolarHBondContact O-N 3.38Å; V300-N303 VanDerWaalsContact O-N 3.16Å; L301-N303 VanDerWaalsContact C-N 3.33Å; L301-N303 PolarHBondContact O-N 3.48Å; N303-Y305 VanDerWaalsContact C-N 3.3Å; N303-Y305 PolarHBondContact O-N 2.9Å; N303-L306 PolarHBondContact O-N 3.33Å; N303-L306 VanDerWaalsContact O-N 3.13Å; N303-K307 WeakPolarHBondContact O-CG 3.46Å; N303-K307 PolarHBondContact O-N 3.05Å; N303-K307 VanDerWaalsContact O-N 3.08Å; N303-K447 PolarHBondContact OD1-NZ 3.49Å |
| 304 | S | 86.3 | Confident | 81.4 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -56.3 | -44.8 | 172 | -51.4 | 0 | 0 | 0 | 0 | 111.7 | W266 S270 V300 L301 K307 | W266-S304 VanDerWaalsContact CE2-CB 3.49Å; W266-S304 WeakPolarHBondContact CZ2-O 3.33Å; W266-S304 PolarHBondContact NE1-O 3.43Å; S270-S304 WeakPolarHBondContact CB-OG 3.28Å; S270-S304 VanDerWaalsContact OG-CA 3.26Å; S270-S304 WeakPolarHBondContact OG-CA 3.45Å; S270-S304 PolarHBondContact OG-OG 3.07Å; V300-S304 PolarHBondContact O-N 2.83Å; V300-S304 PolarHBondContact O-OG 2.97Å; L301-S304 WeakPolarHBondContact O-CB 3.43Å; L301-S304 PolarHBondContact O-N 3.41Å; S304-K307 PolarHBondContact O-N 2.83Å |
| 305 | Y | 88.5 | Confident | 82.2 | Confident | 1 Ų | 1 | 44.5 Ų | 44.5 | 0% | 0.004 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.7 | -46.1 | 174.4 | -72.9 | -66.8 | 0 | 0 | 0 | 111.4 | W266 L301 N302 N303 K307 L308 L322 Y480 V484 N487 K488 Y495 | W266-Y305 AromaticContact CH2-CD1 3.9Å; W266-Y305 HydrophobicContact CH2-CD1 3.9Å; W266-Y305 AromaticContact CH2-CE1 3.72Å; W266-Y305 HydrophobicContact CH2-CE1 3.72Å; W266-Y305 HydrophobicContact CH2-CE2 4.39Å; W266-Y305 HydrophobicContact CH2-CG 4.3Å; W266-Y305 AromaticContact CH2-CZ 3.98Å; W266-Y305 AromaticContact CZ2-CD1 3.99Å; W266-Y305 HydrophobicContact CZ2-CD1 3.99Å; W266-Y305 HydrophobicContact CZ2-CE1 4.27Å; W266-Y305 HydrophobicContact CZ2-CG 4.29Å; L301-Y305 HydrophobicContact CD1-CD2 4.26Å; L301-Y305 HydrophobicContact CD1-CE2 3.64Å; L301-Y305 HydrophobicContact CD2-CE2 4.13Å; L301-Y305 HydrophobicContact CG-CD2 4.07Å; L301-Y305 HydrophobicContact CG-CE2 3.57Å; L301-Y305 WeakPolarHBondContact O-CD2 3.4Å; L301-Y305 PolarHBondContact O-N 2.73Å; N302-Y305 PolarHBondContact O-N 3.45Å; N303-Y305 VanDerWaalsContact C-N 3.3Å; N303-Y305 PolarHBondContact O-N 2.9Å; Y305-K307 PolarHBondContact O-N 2.85Å; Y305-K307 VanDerWaalsContact O-N 3.1Å; Y305-L308 HydrophobicContact CD1-CD1 3.83Å; Y305-L308 WeakPolarHBondContact O-CA 3.44Å; Y305-L308 WeakPolarHBondContact O-CB 3.42Å; Y305-L308 PolarHBondContact O-N 3.48Å; Y305-L322 HydrophobicContact CE1-CD1 4.21Å; Y305-L322 HydrophobicContact CE1-CD2 4.16Å; Y305-Y480 PolarHBondContact O-OH 3.3Å; Y305-V484 HydrophobicContact CD1-CB 4.44Å; Y305-V484 HydrophobicContact CD1-CG1 4.07Å; Y305-V484 HydrophobicContact CD1-CG2 3.72Å; Y305-V484 HydrophobicContact CD2-CG1 3.56Å; Y305-V484 HydrophobicContact CE1-CG1 4.2Å; Y305-V484 HydrophobicContact CE1-CG2 4.24Å; Y305-V484 HydrophobicContact CE2-CG1 3.69Å; Y305-V484 HydrophobicContact CG-CG1 3.78Å; Y305-V484 HydrophobicContact CG-CG2 3.91Å; Y305-N487 PolarHBondContact OH-OD1 3.28Å; Y305-K488 HydrophobicContact CE2-CD 4.32Å; Y305-K488 HydrophobicContact CE2-CG 3.92Å; Y305-Y495 VanDerWaalsContact OH-CE2 3.23Å; Y305-Y495 WeakPolarHBondContact OH-CE2 3.47Å |
| 306 | L | 86.5 | Confident | 82.6 | Confident | 16 Ų | 16 | 47.5 Ų | 47.5 | 8% | 0.084 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -57.5 | -29.8 | 178.4 | -70.3 | 171 | 0 | 0 | 0 | 113.9 | N302 N303 L308 L309 M446 K447 L450 | N302-L306 WeakPolarHBondContact O-CG 3.45Å; N302-L306 PolarHBondContact O-N 2.89Å; N303-L306 PolarHBondContact O-N 3.33Å; N303-L306 VanDerWaalsContact O-N 3.13Å; L306-L308 VanDerWaalsContact C-N 3.27Å; L306-L308 PolarHBondContact O-N 2.71Å; L306-L309 HydrophobicContact CD2-CD1 4.38Å; L306-L309 PolarHBondContact O-N 2.88Å; L306-M446 HydrophobicContact CD2-CB 3.65Å; L306-K447 HydrophobicContact CD1-CB 3.62Å; L306-K447 HydrophobicContact CD1-CD 4.14Å; L306-K447 HydrophobicContact CD1-CG 3.86Å; L306-L450 HydrophobicContact CD2-CD1 3.59Å; L306-L450 HydrophobicContact CG-CD1 3.78Å |
| 307 | K | 85.9 | Confident | 82.8 | Confident | 31 Ų | 31 | 51.7 Ų | 51.7 | 14% | 0.135 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -67 | -28.1 | 173.8 | -66.7 | -174.5 | -170.9 | -170.3 | 0 | 112.9 | E269 S270 E273 N303 S304 Y305 L309 Q310 W311 | E269-K307 PolarHBondContact O-NZ 3.4Å; S270-K307 VanDerWaalsContact OG-CE 3.29Å; S270-K307 WeakPolarHBondContact OG-CE 3.5Å; S270-K307 PolarHBondContact OG-NZ 3.38Å; E273-K307 IonicContact OE1-NZ 3.21Å; E273-K307 PolarHBondContact OE1-NZ 2.88Å; E273-K307 WeakPolarHBondContact OE2-CE 3.45Å; E273-K307 IonicContact OE2-NZ 3.66Å; E273-K307 PolarHBondContact OE2-NZ 3.44Å; N303-K307 WeakPolarHBondContact O-CG 3.46Å; N303-K307 PolarHBondContact O-N 3.05Å; N303-K307 VanDerWaalsContact O-N 3.08Å; S304-K307 PolarHBondContact O-N 2.83Å; Y305-K307 PolarHBondContact O-N 2.85Å; Y305-K307 VanDerWaalsContact O-N 3.1Å; K307-L309 PolarHBondContact O-N 3.16Å; K307-Q310 CarbonylContact O-C 3.48Å; K307-Q310 PolarHBondContact O-N 3.48Å; K307-W311 PolarHBondContact O-N 2.72Å |
| 308 | L | 86.9 | Confident | 83 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62.2 | -29.9 | 176.9 | -61.5 | 170.1 | 0 | 0 | 0 | 112 | W266 Y305 L306 Q310 W311 Y313 L322 | W266-L308 HydrophobicContact CZ2-CD1 3.83Å; W266-L308 HydrophobicContact CZ2-CG 4.17Å; Y305-L308 HydrophobicContact CD1-CD1 3.83Å; Y305-L308 WeakPolarHBondContact O-CA 3.44Å; Y305-L308 WeakPolarHBondContact O-CB 3.42Å; Y305-L308 PolarHBondContact O-N 3.48Å; L306-L308 VanDerWaalsContact C-N 3.27Å; L306-L308 PolarHBondContact O-N 2.71Å; L308-Q310 PolarHBondContact O-N 2.92Å; L308-Q310 VanDerWaalsContact O-N 3.17Å; L308-W311 HydrophobicContact CD2-CD2 4.21Å; L308-W311 HydrophobicContact CD2-CE3 4.14Å; L308-W311 WeakPolarHBondContact O-CB 3.26Å; L308-W311 PolarHBondContact O-N 3.15Å; L308-W311 VanDerWaalsContact O-N 3.13Å; L308-Y313 PolarHBondContact O-OH 3.32Å; L308-L322 HydrophobicContact CD1-CD1 3.42Å; L308-L322 VanDerWaalsContact CD1-CD1 3.42Å; L308-L322 HydrophobicContact CD2-CD1 4.45Å |
| 309 | L | 84.4 | Confident | 83.3 | Confident | 8 Ų | 8 | 45.9 Ų | 45.9 | 4% | 0.042 | 21% | 0.214 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.1 | -6.4 | 174.9 | -63.3 | 175.8 | 0 | 0 | 0 | 113.9 | L306 K307 T333 L336 M446 Y480 | L306-L309 HydrophobicContact CD2-CD1 4.38Å; L306-L309 PolarHBondContact O-N 2.88Å; K307-L309 PolarHBondContact O-N 3.16Å; L309-T333 WeakPolarHBondContact O-CG2 3.38Å; L309-L336 HydrophobicContact CB-CD2 4.04Å; L309-L336 HydrophobicContact CD1-CD2 4.15Å; L309-L336 HydrophobicContact CD2-CD2 4.11Å; L309-L336 HydrophobicContact CG-CD2 4.34Å; L309-M446 HydrophobicContact CD1-CB 4.24Å; L309-M446 HydrophobicContact CD1-CG 4.03Å; L309-Y480 HydrophobicContact CD1-CD1 4.49Å; L309-Y480 HydrophobicContact CD1-CE1 4.2Å; L309-Y480 HydrophobicContact CD2-CD2 3.67Å; L309-Y480 HydrophobicContact CD2-CE1 4.39Å; L309-Y480 HydrophobicContact CD2-CE2 3.49Å; L309-Y480 VanDerWaalsContact CD2-CE2 3.49Å; L309-Y480 HydrophobicContact CD2-CG 4.2Å; L309-Y480 HydrophobicContact CG-CE1 4.29Å; L309-Y480 HydrophobicContact CG-CE2 4.01Å |
| 310 | Q | 81.9 | Confident | 83.6 | Confident | 99 Ų | 99 | 45.5 Ų | 45.5 | 46% | 0.463 | 21% | 0.21 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -122.7 | 14.8 | 175.1 | -74 | 157.3 | 78.1 | 0 | 0 | 111.1 | K307 L308 K443 | K307-Q310 CarbonylContact O-C 3.48Å; K307-Q310 PolarHBondContact O-N 3.48Å; L308-Q310 PolarHBondContact O-N 2.92Å; L308-Q310 VanDerWaalsContact O-N 3.17Å; Q310-K443 VanDerWaalsContact CD-NZ 3.26Å |
| 311 | W | 81.5 | Confident | 83.8 | Confident | 20 Ų | 20 | 45.5 Ų | 45.5 | 8% | 0.076 | 21% | 0.21 | C | C | . | . | trans | -72.7 | 139.7 | -174.2 | -156.4 | -102.2 | 0 | 0 | 0 | 111.3 | W266 K307 L308 Y313 K316 E317 | W266-W311 AromaticContact CD1-CZ3 3.9Å; K307-W311 PolarHBondContact O-N 2.72Å; L308-W311 HydrophobicContact CD2-CD2 4.21Å; L308-W311 HydrophobicContact CD2-CE3 4.14Å; L308-W311 WeakPolarHBondContact O-CB 3.26Å; L308-W311 PolarHBondContact O-N 3.15Å; L308-W311 VanDerWaalsContact O-N 3.13Å; W311-Y313 HydrophobicContact CB-CD2 4.16Å; W311-Y313 HydrophobicContact CB-CE2 3.8Å; W311-Y313 VanDerWaalsContact O-CD2 3.27Å; W311-Y313 WeakPolarHBondContact O-CD2 3.26Å; W311-Y313 PolarHBondContact O-N 3.29Å; W311-K316 HydrophobicContact CD2-CB 4.4Å; W311-K316 HydrophobicContact CD2-CD 4.24Å; W311-K316 VanDerWaalsContact CE2-CB 3.49Å; W311-K316 HydrophobicContact CE3-CD 4.42Å; W311-K316 HydrophobicContact CH2-CD 3.88Å; W311-K316 HydrophobicContact CZ2-CB 3.64Å; W311-K316 HydrophobicContact CZ2-CD 3.67Å; W311-K316 HydrophobicContact CZ2-CG 4.31Å; W311-K316 HydrophobicContact CZ3-CD 4.25Å; W311-K316 VanDerWaalsContact NE1-CB 3.27Å; W311-K316 PolarHBondContact NE1-O 3.01Å; W311-K316 VanDerWaalsContact NE1-O 3.13Å; W311-E317 WeakPolarHBondContact CZ2-O 3.25Å | ||
| 312 | D | 79.3 | Confident | 84 | Confident | 60 Ų | 60 | 44.7 Ų | 44.7 | 32% | 0.321 | 21% | 0.206 | S | C | . | . | trans | -86.3 | 89.5 | 168.6 | -172.4 | -13.6 | 0 | 0 | 0 | 108.5 | Q314 K315 K316 | D312-Q314 PolarHBondContact O-N 2.88Å; D312-Q314 VanDerWaalsContact O-N 3.1Å; D312-Q314 WeakPolarHBondContact OD1-CB 3.5Å; D312-Q314 PolarHBondContact OD1-N 3.37Å; D312-Q314 VanDerWaalsContact OD1-N 3.11Å; D312-K315 PolarHBondContact O-N 2.87Å; D312-K315 PolarHBondContact OD1-N 3.43Å; D312-K315 VanDerWaalsContact OD2-CD 3.23Å; D312-K315 WeakPolarHBondContact OD2-CD 3.29Å; D312-K315 WeakPolarHBondContact OD2-CE 3.45Å; D312-K315 WeakPolarHBondContact OD2-CG 3.46Å; D312-K315 IonicContact OD2-NZ 2.63Å; D312-K315 PolarHBondContact OD2-NZ 3.07Å; D312-K316 PolarHBondContact O-N 2.89Å | ||
| 313 | Y | 79.5 | Confident | 83.9 | Confident | 40 Ų | 40 | 50.1 Ų | 50.1 | 16% | 0.157 | 23% | 0.233 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -12.1 | -179.8 | -69.7 | -91.9 | 0 | 0 | 0 | 113.8 | L308 W311 L318 L329 Q330 T333 | L308-Y313 PolarHBondContact O-OH 3.32Å; W311-Y313 HydrophobicContact CB-CD2 4.16Å; W311-Y313 HydrophobicContact CB-CE2 3.8Å; W311-Y313 VanDerWaalsContact O-CD2 3.27Å; W311-Y313 WeakPolarHBondContact O-CD2 3.26Å; W311-Y313 PolarHBondContact O-N 3.29Å; Y313-L318 HydrophobicContact CD1-CD1 4.12Å; Y313-L318 HydrophobicContact CD1-CD2 4.03Å; Y313-L318 HydrophobicContact CD1-CG 4.32Å; Y313-L318 HydrophobicContact CE1-CD1 4.13Å; Y313-L318 HydrophobicContact CE1-CD2 3.65Å; Y313-L318 HydrophobicContact CE1-CG 4.34Å; Y313-L329 HydrophobicContact CE1-CB 4.27Å; Y313-L329 WeakPolarHBondContact OH-CB 3.26Å; Y313-L329 PolarHBondContact OH-O 2.88Å; Y313-Q330 HydrophobicContact CD1-CB 3.92Å; Y313-Q330 HydrophobicContact CD1-CG 4.32Å; Y313-Q330 HydrophobicContact CD2-CB 4.42Å; Y313-Q330 HydrophobicContact CD2-CG 4.27Å; Y313-Q330 HydrophobicContact CE1-CB 4.04Å; Y313-Q330 HydrophobicContact CG-CB 4.13Å; Y313-Q330 HydrophobicContact CG-CG 4.04Å; Y313-T333 HydrophobicContact CE2-CG2 4.02Å; Y313-T333 PolarHBondContact OH-OG1 2.72Å |
| 314 | Q | 73.4 | Confident | 84 | Confident | 151 Ų | 151 | 50.4 Ų | 50.4 | 71% | 0.706 | 24% | 0.235 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -89.8 | -25.6 | 177.8 | -60.5 | -63 | -18.3 | 0 | 0 | 112.9 | D312 | D312-Q314 PolarHBondContact O-N 2.88Å; D312-Q314 VanDerWaalsContact O-N 3.1Å; D312-Q314 WeakPolarHBondContact OD1-CB 3.5Å; D312-Q314 PolarHBondContact OD1-N 3.37Å; D312-Q314 VanDerWaalsContact OD1-N 3.11Å |
| 315 | K | 76.8 | Confident | 84.2 | Confident | 174 Ų | 174 | 50.6 Ų | 50.6 | 76% | 0.757 | 24% | 0.236 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -116.5 | -28.2 | -173 | -62.7 | -175.4 | -164.2 | 137.5 | 0 | 114.3 | D312 | D312-K315 PolarHBondContact O-N 2.87Å; D312-K315 PolarHBondContact OD1-N 3.43Å; D312-K315 VanDerWaalsContact OD2-CD 3.23Å; D312-K315 WeakPolarHBondContact OD2-CD 3.29Å; D312-K315 WeakPolarHBondContact OD2-CE 3.45Å; D312-K315 WeakPolarHBondContact OD2-CG 3.46Å; D312-K315 IonicContact OD2-NZ 2.63Å; D312-K315 PolarHBondContact OD2-NZ 3.07Å |
| 316 | K | 80.7 | Confident | 84.1 | Confident | 90 Ų | 90 | 50.9 Ų | 50.9 | 39% | 0.391 | 24% | 0.239 | S | C | . | . | S | Bend | trans | -107.3 | 126.8 | -176.9 | -72.8 | -164.4 | 174.4 | -159.9 | 0 | 110.8 | E269 W311 D312 | E269-K316 IonicContact OE1-NZ 3.35Å; E269-K316 IonicContact OE2-NZ 3.88Å; W311-K316 HydrophobicContact CD2-CB 4.4Å; W311-K316 HydrophobicContact CD2-CD 4.24Å; W311-K316 VanDerWaalsContact CE2-CB 3.49Å; W311-K316 HydrophobicContact CE3-CD 4.42Å; W311-K316 HydrophobicContact CH2-CD 3.88Å; W311-K316 HydrophobicContact CZ2-CB 3.64Å; W311-K316 HydrophobicContact CZ2-CD 3.67Å; W311-K316 HydrophobicContact CZ2-CG 4.31Å; W311-K316 HydrophobicContact CZ3-CD 4.25Å; W311-K316 VanDerWaalsContact NE1-CB 3.27Å; W311-K316 PolarHBondContact NE1-O 3.01Å; W311-K316 VanDerWaalsContact NE1-O 3.13Å; D312-K316 PolarHBondContact O-N 2.89Å |
| 317 | E | 82.6 | Confident | 84.2 | Confident | 146 Ų | 146 | 53.9 Ų | 53.9 | 68% | 0.682 | 27% | 0.266 | S | S | * | . | P | Polyproline II helix | trans | -63.2 | 140.7 | 173.4 | -63.9 | -178 | 177.9 | 0 | 0 | 111.3 | Q262 W311 | Q262-E317 HydrophobicContact CG-CB 4.28Å; Q262-E317 PolarHBondContact NE2-O 3.37Å; W311-E317 WeakPolarHBondContact CZ2-O 3.25Å |
| 318 | L | 85.6 | Confident | 84.4 | Confident | 31 Ų | 31 | 54.5 Ų | 54.5 | 16% | 0.162 | 27% | 0.268 | C | S | . | . | P | Polyproline II helix | trans | -77.1 | 147.2 | 177.7 | -76.5 | 169.4 | 0 | 0 | 0 | 110.8 | Q262 Y313 E320 M323 | Q262-L318 WeakPolarHBondContact CG-O 3.36Å; Y313-L318 HydrophobicContact CD1-CD1 4.12Å; Y313-L318 HydrophobicContact CD1-CD2 4.03Å; Y313-L318 HydrophobicContact CD1-CG 4.32Å; Y313-L318 HydrophobicContact CE1-CD1 4.13Å; Y313-L318 HydrophobicContact CE1-CD2 3.65Å; Y313-L318 HydrophobicContact CE1-CG 4.34Å; L318-E320 PolarHBondContact O-N 3.27Å; L318-M323 HydrophobicContact CB-SD 3.84Å |
| 319 | P | 88 | Confident | 84.6 | Confident | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 27% | 0.268 | C | S | . | . | P | Polyproline II helix | trans | -53.8 | 137.4 | 170.4 | -25.9 | 36.2 | 0 | 0 | 0 | 110.9 | W266 T321 L322 M323 | W266-P319 HydrophobicContact CB-CG 3.88Å; W266-P319 HydrophobicContact CD2-CB 4.35Å; W266-P319 HydrophobicContact CD2-CG 3.58Å; W266-P319 HydrophobicContact CE3-CB 4.08Å; W266-P319 HydrophobicContact CE3-CG 3.81Å; W266-P319 HydrophobicContact CG-CG 3.61Å; P319-T321 PolarHBondContact O-N 3.07Å; P319-T321 VanDerWaalsContact O-N 3.13Å; P319-L322 HydrophobicContact CB-CB 4.49Å; P319-L322 HydrophobicContact CB-CD1 4.16Å; P319-L322 HydrophobicContact CG-CD1 4.05Å; P319-L322 PolarHBondContact O-N 2.98Å; P319-M323 PolarHBondContact O-N 3.4Å |
| 320 | E | 87.8 | Confident | 84.8 | Confident | 50 Ų | 50 | 57.1 Ų | 57.1 | 23% | 0.234 | 28% | 0.28 | C | S | . | . | G | 310 helix | trans | -57.3 | -35.5 | -176 | -55.6 | 91.4 | 161.4 | 0 | 0 | 111.5 | A259 D261 Q262 T263 L318 L322 M323 | A259-E320 WeakPolarHBondContact O-CB 3.32Å; A259-E320 WeakPolarHBondContact O-CG 3.34Å; D261-E320 PolarHBondContact N-OE1 3.46Å; Q262-E320 VanDerWaalsContact CB-OE1 3.27Å; Q262-E320 WeakPolarHBondContact CB-OE1 3.47Å; Q262-E320 PolarHBondContact N-OE1 3.23Å; T263-E320 VanDerWaalsContact CB-OE2 3.28Å; T263-E320 WeakPolarHBondContact CB-OE2 3.07Å; T263-E320 PolarHBondContact N-OE2 2.97Å; T263-E320 PolarHBondContact OG1-N 3.45Å; T263-E320 PolarHBondContact OG1-OE2 3.32Å; L318-E320 PolarHBondContact O-N 3.27Å; E320-L322 PolarHBondContact O-N 3.24Å; E320-M323 PolarHBondContact O-N 3.49Å |
| 321 | T | 87.9 | Confident | 85.2 | Confident | 1 Ų | 1 | 56.7 Ų | 56.7 | 1% | 0.006 | 28% | 0.278 | C | S | . | . | G | 310 helix | trans | -66.6 | -11.7 | 176 | 54.5 | 0 | 0 | 0 | 0 | 114.8 | F249 L260 T263 P319 N487 Y491 Y495 | F249-T321 HydrophobicContact CE1-CG2 4.15Å; F249-T321 HydrophobicContact CZ-CG2 3.9Å; L260-T321 HydrophobicContact CD2-CG2 4Å; T263-T321 HydrophobicContact CG2-CG2 4.06Å; T263-T321 PolarHBondContact OG1-OG1 3.49Å; P319-T321 PolarHBondContact O-N 3.07Å; P319-T321 VanDerWaalsContact O-N 3.13Å; T321-N487 PolarHBondContact O-ND2 3.24Å; T321-Y491 HydrophobicContact CG2-CD1 3.78Å; T321-Y491 HydrophobicContact CG2-CE1 4.3Å; T321-Y491 HydrophobicContact CG2-CG 3.97Å; T321-Y491 WeakPolarHBondContact O-CE2 3.44Å; T321-Y495 WeakPolarHBondContact CB-OH 3.38Å; T321-Y495 HydrophobicContact CG2-CE1 3.91Å; T321-Y495 PolarHBondContact OG1-OH 3.11Å |
| 322 | L | 88.7 | Confident | 85.6 | Confident | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 28% | 0.276 | C | S | . | . | G | 310 helix | trans | -117.9 | 2.8 | -178.3 | -71.9 | 164.5 | 0 | 0 | 0 | 113.1 | W266 Y305 L308 P319 E320 T324 D325 G326 L329 N487 | W266-L322 HydrophobicContact CH2-CD1 4.12Å; W266-L322 HydrophobicContact CZ2-CD1 4.28Å; W266-L322 HydrophobicContact CZ3-CD1 4.49Å; Y305-L322 HydrophobicContact CE1-CD1 4.21Å; Y305-L322 HydrophobicContact CE1-CD2 4.16Å; L308-L322 HydrophobicContact CD1-CD1 3.42Å; L308-L322 VanDerWaalsContact CD1-CD1 3.42Å; L308-L322 HydrophobicContact CD2-CD1 4.45Å; P319-L322 HydrophobicContact CB-CB 4.49Å; P319-L322 HydrophobicContact CB-CD1 4.16Å; P319-L322 HydrophobicContact CG-CD1 4.05Å; P319-L322 PolarHBondContact O-N 2.98Å; E320-L322 PolarHBondContact O-N 3.24Å; L322-T324 VanDerWaalsContact C-N 3.27Å; L322-T324 PolarHBondContact O-N 2.88Å; L322-D325 CarbonylContact O-C 3.55Å; L322-D325 PolarHBondContact O-N 3.28Å; L322-D325 VanDerWaalsContact O-N 3.1Å; L322-G326 PolarHBondContact O-N 3.05Å; L322-G326 VanDerWaalsContact O-N 3.08Å; L322-L329 HydrophobicContact CB-CD1 4.22Å; L322-L329 HydrophobicContact CD2-CD1 4.08Å; L322-N487 HydrophobicContact CD2-CB 4.3Å; L322-N487 VanDerWaalsContact CD2-ND2 3.35Å; L322-N487 WeakPolarHBondContact CD2-ND2 3.27Å |
| 323 | M | 85.9 | Confident | 86.1 | Confident | 119 Ų | 119 | 53.6 Ų | 53.6 | 59% | 0.586 | 26% | 0.263 | S | S | * | . | G | 310 helix | trans | -58.2 | -39.2 | -176.9 | -74 | -66 | -70.4 | 0 | 0 | 112.6 | L318 P319 E320 D325 G326 | L318-M323 HydrophobicContact CB-SD 3.84Å; P319-M323 PolarHBondContact O-N 3.4Å; E320-M323 PolarHBondContact O-N 3.49Å; M323-D325 VanDerWaalsContact C-N 3.28Å; M323-D325 PolarHBondContact O-N 2.9Å; M323-G326 PolarHBondContact O-N 2.89Å; M323-G326 VanDerWaalsContact O-N 3.15Å |
| 324 | T | 86.7 | Confident | 86.5 | Confident | 22 Ų | 22 | 53.9 Ų | 53.9 | 14% | 0.135 | 27% | 0.266 | C | S | . | . | G | 310 helix | trans | -62 | -35.2 | 178.4 | -40.8 | 0 | 0 | 0 | 0 | 112.7 | T76 H79 L322 R328 | T76-T324 HydrophobicContact CG2-CG2 4.14Å; H79-T324 HydrophobicContact CB-CG2 3.64Å; H79-T324 VanDerWaalsContact CD2-CG2 3.43Å; H79-T324 WeakPolarHBondContact CD2-CG2 3.48Å; H79-T324 VanDerWaalsContact CG-CG2 3.46Å; L322-T324 VanDerWaalsContact C-N 3.27Å; L322-T324 PolarHBondContact O-N 2.88Å; T324-R328 PolarHBondContact O-NH2 2.96Å |
| 325 | D | 89.3 | Confident | 87.3 | Confident | 4 Ų | 4 | 50.6 Ų | 50.6 | 2% | 0.021 | 25% | 0.249 | C | C | . | . | G | 310 helix | trans | -93.6 | 2.1 | 179 | -72.9 | -67.9 | 0 | 0 | 0 | 112.8 | H79 L322 M323 A327 R328 L329 I483 | H79-D325 IonicContact CE1-OD1 2.75Å; H79-D325 IonicContact CE1-OD2 3.6Å; H79-D325 IonicContact NE2-OD1 2.62Å; H79-D325 PolarHBondContact NE2-OD1 3.49Å; H79-D325 IonicContact NE2-OD2 2.69Å; L322-D325 CarbonylContact O-C 3.55Å; L322-D325 PolarHBondContact O-N 3.28Å; L322-D325 VanDerWaalsContact O-N 3.1Å; M323-D325 VanDerWaalsContact C-N 3.28Å; M323-D325 PolarHBondContact O-N 2.9Å; D325-A327 PolarHBondContact O-N 3.24Å; D325-R328 PolarHBondContact O-N 2.87Å; D325-R328 IonicContact OD1-CZ 3.59Å; D325-R328 IonicContact OD1-NE 3.57Å; D325-R328 IonicContact OD1-NH1 3.13Å; D325-R328 PolarHBondContact OD1-NH1 2.98Å; D325-R328 IonicContact OD1-NH2 3.56Å; D325-R328 PolarHBondContact OD1-NH2 2.91Å; D325-L329 HydrophobicContact CB-CD1 4.1Å; D325-L329 HydrophobicContact CB-CG 4.23Å; D325-L329 WeakPolarHBondContact O-CG 3.36Å; D325-L329 PolarHBondContact O-N 3.38Å; D325-I483 HydrophobicContact CB-CG2 3.91Å |
| 326 | G | 87.7 | Confident | 87.9 | Confident | 7 Ų | 7 | 42.4 Ų | 42.4 | 7% | 0.072 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -55.9 | -48.9 | -167.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | L322 M323 R328 L329 Q330 | L322-G326 PolarHBondContact O-N 3.05Å; L322-G326 VanDerWaalsContact O-N 3.08Å; M323-G326 PolarHBondContact O-N 2.89Å; M323-G326 VanDerWaalsContact O-N 3.15Å; G326-R328 VanDerWaalsContact C-N 3.34Å; G326-R328 PolarHBondContact O-N 2.97Å; G326-L329 PolarHBondContact O-N 3.32Å; G326-Q330 PolarHBondContact O-N 3.06Å |
| 327 | A | 88 | Confident | 88.3 | Confident | 78 Ų | 78 | 40.3 Ų | 40.3 | 65% | 0.645 | 21% | 0.206 | S | C | * | . | H | α-helix | trans | -63.7 | -38.2 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | D325 Q330 E331 | D325-A327 PolarHBondContact O-N 3.24Å; A327-Q330 PolarHBondContact O-N 3.31Å; A327-E331 PolarHBondContact O-N 3.36Å |
| 328 | R | 90 | Very high | 88.6 | Confident | 44 Ų | 44 | 35.2 Ų | 35.2 | 17% | 0.166 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -68 | -40.5 | 177.3 | -76.4 | -178 | -89.7 | 135.6 | 5.9 | 111.4 | H79 E80 T324 D325 G326 E331 L332 I483 | H79-R328 PolarHBondContact CD2-NH2 3.43Å; H79-R328 PolarHBondContact NE2-NH2 2.97Å; E80-R328 IonicContact OE1-CZ 2.9Å; E80-R328 IonicContact OE1-NE 3.33Å; E80-R328 PolarHBondContact OE1-NE 3.46Å; E80-R328 IonicContact OE1-NH2 2.76Å; E80-R328 PolarHBondContact OE1-NH2 3.42Å; T324-R328 PolarHBondContact O-NH2 2.96Å; D325-R328 PolarHBondContact O-N 2.87Å; D325-R328 IonicContact OD1-CZ 3.59Å; D325-R328 IonicContact OD1-NE 3.57Å; D325-R328 IonicContact OD1-NH1 3.13Å; D325-R328 PolarHBondContact OD1-NH1 2.98Å; D325-R328 IonicContact OD1-NH2 3.56Å; D325-R328 PolarHBondContact OD1-NH2 2.91Å; G326-R328 VanDerWaalsContact C-N 3.34Å; G326-R328 PolarHBondContact O-N 2.97Å; R328-E331 PolarHBondContact O-N 2.95Å; R328-L332 WeakPolarHBondContact O-CB 3.34Å; R328-L332 VanDerWaalsContact O-CG 3.23Å; R328-L332 WeakPolarHBondContact O-CG 3.5Å; R328-L332 PolarHBondContact O-N 3.08Å; R328-I483 HydrophobicContact CB-CD1 4.31Å |
| 329 | L | 90.6 | Very high | 88.7 | Confident | 1 Ų | 1 | 34.6 Ų | 34.6 | 1% | 0.005 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -65 | -39.9 | 175.4 | -68.9 | 168.9 | 0 | 0 | 0 | 112 | Y313 L322 D325 G326 L332 T333 Y480 I483 | Y313-L329 HydrophobicContact CE1-CB 4.27Å; Y313-L329 WeakPolarHBondContact OH-CB 3.26Å; Y313-L329 PolarHBondContact OH-O 2.88Å; L322-L329 HydrophobicContact CB-CD1 4.22Å; L322-L329 HydrophobicContact CD2-CD1 4.08Å; D325-L329 HydrophobicContact CB-CD1 4.1Å; D325-L329 HydrophobicContact CB-CG 4.23Å; D325-L329 WeakPolarHBondContact O-CG 3.36Å; D325-L329 PolarHBondContact O-N 3.38Å; G326-L329 PolarHBondContact O-N 3.32Å; L329-L332 PolarHBondContact O-N 3.44Å; L329-T333 WeakPolarHBondContact O-CB 3.24Å; L329-T333 PolarHBondContact O-N 3.18Å; L329-T333 PolarHBondContact O-OG1 3.44Å; L329-Y480 HydrophobicContact CD2-CD2 3.99Å; L329-Y480 HydrophobicContact CD2-CE2 3.62Å; L329-I483 HydrophobicContact CD2-CD1 4.44Å; L329-I483 HydrophobicContact CD2-CG2 4.1Å |
| 330 | Q | 89.8 | Confident | 88.8 | Confident | 62 Ų | 62 | 35 Ų | 35 | 29% | 0.29 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -61.1 | -52.4 | 173.8 | -176.4 | -177.1 | -15.7 | 0 | 0 | 110.6 | Y313 G326 A327 L332 T333 E334 | Y313-Q330 HydrophobicContact CD1-CB 3.92Å; Y313-Q330 HydrophobicContact CD1-CG 4.32Å; Y313-Q330 HydrophobicContact CD2-CB 4.42Å; Y313-Q330 HydrophobicContact CD2-CG 4.27Å; Y313-Q330 HydrophobicContact CE1-CB 4.04Å; Y313-Q330 HydrophobicContact CG-CB 4.13Å; Y313-Q330 HydrophobicContact CG-CG 4.04Å; G326-Q330 PolarHBondContact O-N 3.06Å; A327-Q330 PolarHBondContact O-N 3.31Å; Q330-L332 VanDerWaalsContact C-N 3.28Å; Q330-L332 PolarHBondContact O-N 3.08Å; Q330-T333 PolarHBondContact O-N 3.15Å; Q330-E334 HydrophobicContact CG-CG 4.37Å; Q330-E334 WeakPolarHBondContact CG-OE1 3.37Å; Q330-E334 PolarHBondContact NE2-OE1 3.39Å; Q330-E334 WeakPolarHBondContact O-CB 3.26Å; Q330-E334 VanDerWaalsContact O-CG 3.26Å; Q330-E334 WeakPolarHBondContact O-CG 3.36Å; Q330-E334 PolarHBondContact O-N 2.94Å |
| 331 | E | 89.5 | Confident | 88.8 | Confident | 91 Ų | 91 | 32.9 Ų | 32.9 | 43% | 0.425 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -57.4 | -40.4 | 178.7 | -171.3 | -171.7 | 167.8 | 0 | 0 | 112.2 | A327 R328 E334 K335 | A327-E331 PolarHBondContact O-N 3.36Å; R328-E331 PolarHBondContact O-N 2.95Å; E331-E334 PolarHBondContact O-N 3.39Å; E331-K335 HydrophobicContact CG-CD 4.43Å; E331-K335 WeakPolarHBondContact O-CB 3.3Å; E331-K335 WeakPolarHBondContact O-CG 3.35Å; E331-K335 PolarHBondContact O-N 3.35Å; E331-K335 WeakPolarHBondContact OE1-CE 3.43Å; E331-K335 IonicContact OE1-NZ 3.41Å; E331-K335 PolarHBondContact OE1-NZ 3.45Å |
| 332 | L | 90.3 | Very high | 88.9 | Confident | 8 Ų | 8 | 33.1 Ų | 33.1 | 4% | 0.042 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -65.3 | -41.1 | 175.7 | -72.3 | 171 | 0 | 0 | 0 | 112.2 | R328 L329 Q330 K335 L336 L476 Q479 Y480 I483 | R328-L332 WeakPolarHBondContact O-CB 3.34Å; R328-L332 VanDerWaalsContact O-CG 3.23Å; R328-L332 WeakPolarHBondContact O-CG 3.5Å; R328-L332 PolarHBondContact O-N 3.08Å; L329-L332 PolarHBondContact O-N 3.44Å; Q330-L332 VanDerWaalsContact C-N 3.28Å; Q330-L332 PolarHBondContact O-N 3.08Å; L332-K335 PolarHBondContact O-N 2.85Å; L332-L336 VanDerWaalsContact O-CB 3.31Å; L332-L336 WeakPolarHBondContact O-CB 3.37Å; L332-L336 PolarHBondContact O-N 3.38Å; L332-L476 HydrophobicContact CD2-CD2 4.48Å; L332-L476 HydrophobicContact CD2-CG 3.95Å; L332-Q479 HydrophobicContact CD2-CB 4.07Å; L332-Y480 HydrophobicContact CD1-CD2 4.2Å; L332-I483 HydrophobicContact CD1-CD1 3.62Å |
| 333 | T | 89.2 | Confident | 88.8 | Confident | 6 Ų | 6 | 33.2 Ų | 33.2 | 4% | 0.037 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -66.2 | -41.6 | 178 | -61.2 | 0 | 0 | 0 | 0 | 111.3 | L309 Y313 L329 Q330 L336 N337 | L309-T333 WeakPolarHBondContact O-CG2 3.38Å; Y313-T333 HydrophobicContact CE2-CG2 4.02Å; Y313-T333 PolarHBondContact OH-OG1 2.72Å; L329-T333 WeakPolarHBondContact O-CB 3.24Å; L329-T333 PolarHBondContact O-N 3.18Å; L329-T333 PolarHBondContact O-OG1 3.44Å; Q330-T333 PolarHBondContact O-N 3.15Å; T333-L336 WeakPolarHBondContact O-CB 3.46Å; T333-L336 PolarHBondContact O-N 2.9Å; T333-N337 PolarHBondContact O-N 3.27Å; T333-N337 PolarHBondContact O-ND2 3.29Å |
| 334 | E | 88.3 | Confident | 89 | Confident | 47 Ų | 47 | 27.5 Ų | 27.5 | 22% | 0.22 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -60.1 | -50 | 175 | -71.2 | 178.1 | 179.3 | 0 | 0 | 111.7 | Q330 E331 L336 N337 Q338 N379 | Q330-E334 HydrophobicContact CG-CG 4.37Å; Q330-E334 WeakPolarHBondContact CG-OE1 3.37Å; Q330-E334 PolarHBondContact NE2-OE1 3.39Å; Q330-E334 WeakPolarHBondContact O-CB 3.26Å; Q330-E334 VanDerWaalsContact O-CG 3.26Å; Q330-E334 WeakPolarHBondContact O-CG 3.36Å; Q330-E334 PolarHBondContact O-N 2.94Å; E331-E334 PolarHBondContact O-N 3.39Å; E334-L336 VanDerWaalsContact C-N 3.3Å; E334-L336 PolarHBondContact O-N 2.92Å; E334-N337 PolarHBondContact O-N 3.34Å; E334-Q338 PolarHBondContact O-N 2.77Å; E334-N379 VanDerWaalsContact CB-ND2 3.32Å; E334-N379 WeakPolarHBondContact CB-ND2 3.42Å; E334-N379 HydrophobicContact CG-CB 4.13Å; E334-N379 VanDerWaalsContact CG-ND2 3.34Å; E334-N379 WeakPolarHBondContact CG-ND2 3.46Å; E334-N379 WeakPolarHBondContact CG-OD1 3.36Å; E334-N379 PolarHBondContact OE2-ND2 2.95Å |
| 335 | K | 89.3 | Confident | 89 | Confident | 82 Ų | 82 | 26.7 Ų | 26.7 | 36% | 0.357 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -59.6 | -40.3 | 173.9 | -74.1 | 175.6 | -175.4 | 169.2 | 0 | 111.8 | E331 L332 N337 Q338 L339 L476 | E331-K335 HydrophobicContact CG-CD 4.43Å; E331-K335 WeakPolarHBondContact O-CB 3.3Å; E331-K335 WeakPolarHBondContact O-CG 3.35Å; E331-K335 PolarHBondContact O-N 3.35Å; E331-K335 WeakPolarHBondContact OE1-CE 3.43Å; E331-K335 IonicContact OE1-NZ 3.41Å; E331-K335 PolarHBondContact OE1-NZ 3.45Å; L332-K335 PolarHBondContact O-N 2.85Å; K335-N337 VanDerWaalsContact C-N 3.34Å; K335-N337 PolarHBondContact O-N 3.45Å; K335-Q338 PolarHBondContact O-N 2.92Å; K335-L339 WeakPolarHBondContact O-CG 3.46Å; K335-L339 PolarHBondContact O-N 2.92Å; K335-L476 HydrophobicContact CB-CD1 3.89Å |
| 336 | L | 90.3 | Very high | 88.9 | Confident | 2 Ų | 2 | 27.2 Ų | 27.2 | 1% | 0.01 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -62.6 | -42.8 | 178.4 | -174.8 | 64.8 | 0 | 0 | 0 | 111.2 | L309 L332 T333 E334 L339 K340 I442 M446 L473 L476 | L309-L336 HydrophobicContact CB-CD2 4.04Å; L309-L336 HydrophobicContact CD1-CD2 4.15Å; L309-L336 HydrophobicContact CD2-CD2 4.11Å; L309-L336 HydrophobicContact CG-CD2 4.34Å; L332-L336 VanDerWaalsContact O-CB 3.31Å; L332-L336 WeakPolarHBondContact O-CB 3.37Å; L332-L336 PolarHBondContact O-N 3.38Å; T333-L336 WeakPolarHBondContact O-CB 3.46Å; T333-L336 PolarHBondContact O-N 2.9Å; E334-L336 VanDerWaalsContact C-N 3.3Å; E334-L336 PolarHBondContact O-N 2.92Å; L336-L339 PolarHBondContact O-N 3.32Å; L336-K340 WeakPolarHBondContact O-CG 3.31Å; L336-K340 PolarHBondContact O-N 3.41Å; L336-I442 HydrophobicContact CD1-CG2 3.87Å; L336-I442 HydrophobicContact CD2-CG2 4.43Å; L336-M446 HydrophobicContact CD1-CE 4.17Å; L336-L473 HydrophobicContact CD1-CD1 3.66Å; L336-L476 HydrophobicContact CB-CD1 3.92Å; L336-L476 HydrophobicContact CB-CD2 4.45Å; L336-L476 HydrophobicContact CD1-CD1 4.24Å; L336-L476 HydrophobicContact CD1-CD2 4.24Å |
| 337 | N | 88.4 | Confident | 88.8 | Confident | 45 Ų | 45 | 29 Ų | 29 | 24% | 0.241 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -65.1 | -40 | 177.5 | -71.5 | -27.7 | 0 | 0 | 0 | 111.8 | T333 E334 K335 L339 K340 I341 M378 | T333-N337 PolarHBondContact O-N 3.27Å; T333-N337 PolarHBondContact O-ND2 3.29Å; E334-N337 PolarHBondContact O-N 3.34Å; K335-N337 VanDerWaalsContact C-N 3.34Å; K335-N337 PolarHBondContact O-N 3.45Å; N337-L339 VanDerWaalsContact C-N 3.34Å; N337-L339 PolarHBondContact O-N 2.84Å; N337-K340 WeakPolarHBondContact O-CB 3.46Å; N337-K340 PolarHBondContact O-N 3.1Å; N337-I341 WeakPolarHBondContact O-CG1 3.43Å; N337-I341 PolarHBondContact O-N 2.99Å; N337-I341 VanDerWaalsContact O-N 3.15Å; N337-M378 HydrophobicContact CB-CE 3.52Å |
| 338 | Q | 89 | Confident | 88.7 | Confident | 40 Ų | 40 | 25.3 Ų | 25.3 | 19% | 0.187 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -58.9 | -45.3 | 171.5 | -70.3 | 176.2 | -22.1 | 0 | 0 | 111.5 | E334 K335 K340 I341 I342 L375 M378 | E334-Q338 PolarHBondContact O-N 2.77Å; K335-Q338 PolarHBondContact O-N 2.92Å; Q338-K340 VanDerWaalsContact C-N 3.35Å; Q338-K340 PolarHBondContact O-N 3.25Å; Q338-I341 PolarHBondContact O-N 2.95Å; Q338-I342 WeakPolarHBondContact O-CG1 3.42Å; Q338-I342 PolarHBondContact O-N 3.31Å; Q338-L375 HydrophobicContact CG-CB 4.49Å; Q338-L375 PolarHBondContact NE2-O 2.98Å; Q338-M378 HydrophobicContact CG-CE 3.96Å |
| 339 | L | 89 | Confident | 88.4 | Confident | 18 Ų | 18 | 23.8 Ų | 23.8 | 9% | 0.094 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -63.9 | -37.1 | 177.3 | -69 | 177.1 | 0 | 0 | 0 | 112.6 | K335 L336 N337 I341 I342 A343 I469 E472 L476 | K335-L339 WeakPolarHBondContact O-CG 3.46Å; K335-L339 PolarHBondContact O-N 2.92Å; L336-L339 PolarHBondContact O-N 3.32Å; N337-L339 VanDerWaalsContact C-N 3.34Å; N337-L339 PolarHBondContact O-N 2.84Å; L339-I341 VanDerWaalsContact C-N 3.35Å; L339-I341 PolarHBondContact O-N 3.48Å; L339-I342 PolarHBondContact O-N 3.35Å; L339-A343 WeakPolarHBondContact O-CB 3.34Å; L339-A343 PolarHBondContact O-N 3.49Å; L339-I469 HydrophobicContact CB-CD1 4.1Å; L339-I469 HydrophobicContact CD2-CB 4.31Å; L339-I469 HydrophobicContact CD2-CG2 4.24Å; L339-E472 HydrophobicContact CD1-CB 3.87Å; L339-E472 HydrophobicContact CD2-CB 3.67Å; L339-E472 HydrophobicContact CD2-CG 4.22Å; L339-E472 HydrophobicContact CG-CB 4.44Å; L339-L476 HydrophobicContact CD1-CD1 3.93Å |
| 340 | K | 89.3 | Confident | 88.1 | Confident | 7 Ų | 7 | 27.4 Ų | 27.4 | 3% | 0.03 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -58.6 | -46.6 | 174.1 | -73.1 | 177 | -171.1 | -177.7 | 0 | 111.1 | L336 N337 Q338 A343 C344 W435 D439 I442 | L336-K340 WeakPolarHBondContact O-CG 3.31Å; L336-K340 PolarHBondContact O-N 3.41Å; N337-K340 WeakPolarHBondContact O-CB 3.46Å; N337-K340 PolarHBondContact O-N 3.1Å; Q338-K340 VanDerWaalsContact C-N 3.35Å; Q338-K340 PolarHBondContact O-N 3.25Å; K340-A343 PolarHBondContact O-N 3.45Å; K340-C344 PolarHBondContact O-N 3.14Å; K340-C344 PolarHBondContact O-SG 3.41Å; K340-W435 HydrophobicContact CB-CE3 4.39Å; K340-W435 HydrophobicContact CB-CH2 3.66Å; K340-W435 HydrophobicContact CB-CZ3 3.55Å; K340-W435 HydrophobicContact CD-CH2 3.77Å; K340-W435 HydrophobicContact CD-CZ2 3.96Å; K340-W435 HydrophobicContact CD-CZ3 4.41Å; K340-W435 HydrophobicContact CG-CH2 4.37Å; K340-D439 WeakPolarHBondContact CE-OD1 3.23Å; K340-D439 IonicContact NZ-OD1 3.21Å; K340-D439 PolarHBondContact NZ-OD1 3.13Å; K340-I442 HydrophobicContact CG-CD1 3.62Å |
| 341 | I | 88.6 | Confident | 87.7 | Confident | 7 Ų | 7 | 30.9 Ų | 30.9 | 4% | 0.036 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -63.6 | -47.9 | 178.4 | -63.4 | 170.9 | 0 | 0 | 0 | 110.1 | N337 Q338 L339 A343 C344 L345 L375 M378 L385 L389 W435 | N337-I341 WeakPolarHBondContact O-CG1 3.43Å; N337-I341 PolarHBondContact O-N 2.99Å; N337-I341 VanDerWaalsContact O-N 3.15Å; Q338-I341 PolarHBondContact O-N 2.95Å; L339-I341 VanDerWaalsContact C-N 3.35Å; L339-I341 PolarHBondContact O-N 3.48Å; I341-A343 VanDerWaalsContact C-N 3.26Å; I341-A343 PolarHBondContact O-N 2.83Å; I341-C344 WeakPolarHBondContact O-CB 3.45Å; I341-C344 PolarHBondContact O-N 3.27Å; I341-L345 HydrophobicContact CG2-CD1 3.77Å; I341-L345 HydrophobicContact CG2-CG 4.12Å; I341-L345 VanDerWaalsContact O-CG 3.25Å; I341-L345 WeakPolarHBondContact O-CG 3.4Å; I341-L345 PolarHBondContact O-N 2.89Å; I341-L375 HydrophobicContact CB-CD1 4.05Å; I341-L375 HydrophobicContact CD1-CD2 4.22Å; I341-L375 HydrophobicContact CG2-CD1 3.73Å; I341-L375 HydrophobicContact CG2-CD2 4.12Å; I341-M378 HydrophobicContact CD1-CE 4.32Å; I341-M378 HydrophobicContact CD1-SD 3.33Å; I341-M378 WeakPolarHBondContact CD1-SD 3.37Å; I341-L385 HydrophobicContact CD1-CD1 3.94Å; I341-L389 HydrophobicContact CG2-CD2 3.9Å; I341-W435 HydrophobicContact CG1-CH2 4.41Å; I341-W435 HydrophobicContact CG1-CZ3 3.8Å |
| 342 | I | 88.8 | Confident | 87.1 | Confident | 6 Ų | 6 | 29 Ų | 29 | 3% | 0.031 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -57.2 | -41.2 | 177.3 | -67.7 | 169.1 | 0 | 0 | 0 | 111.4 | Q338 L339 S346 K368 A372 L375 I469 | Q338-I342 WeakPolarHBondContact O-CG1 3.42Å; Q338-I342 PolarHBondContact O-N 3.31Å; L339-I342 PolarHBondContact O-N 3.35Å; I342-S346 VanDerWaalsContact O-CB 3.24Å; I342-S346 WeakPolarHBondContact O-CB 3.48Å; I342-S346 PolarHBondContact O-N 3.13Å; I342-S346 PolarHBondContact O-OG 3.13Å; I342-K368 HydrophobicContact CG2-CG 4.03Å; I342-A372 HydrophobicContact CD1-CB 4.05Å; I342-L375 HydrophobicContact CD1-CD1 4.45Å; I342-L375 HydrophobicContact CG1-CD1 3.81Å; I342-I469 HydrophobicContact CB-CG2 4.32Å; I342-I469 HydrophobicContact CG2-CG2 3.77Å |
| 343 | A | 88 | Confident | 86.2 | Confident | 1 Ų | 1 | 28.6 Ų | 28.6 | 1% | 0.008 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -65.8 | -40.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L339 K340 I341 S346 L347 I438 L466 I469 | L339-A343 WeakPolarHBondContact O-CB 3.34Å; L339-A343 PolarHBondContact O-N 3.49Å; K340-A343 PolarHBondContact O-N 3.45Å; I341-A343 VanDerWaalsContact C-N 3.26Å; I341-A343 PolarHBondContact O-N 2.83Å; A343-S346 PolarHBondContact O-N 3.19Å; A343-L347 WeakPolarHBondContact O-CB 3.39Å; A343-L347 PolarHBondContact O-N 3.4Å; A343-I438 HydrophobicContact CB-CD1 4.24Å; A343-I438 HydrophobicContact CB-CG2 4Å; A343-L466 HydrophobicContact CB-CD2 3.98Å; A343-I469 HydrophobicContact CB-CD1 3.9Å; A343-I469 HydrophobicContact CB-CG1 4.27Å; A343-I469 HydrophobicContact CB-CG2 4.43Å |
| 344 | C | 88.6 | Confident | 85.2 | Confident | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -61.7 | -50.4 | 174.5 | -66 | 0 | 0 | 0 | 0 | 111.3 | K340 I341 S346 L347 I348 I427 I434 | K340-C344 PolarHBondContact O-N 3.14Å; K340-C344 PolarHBondContact O-SG 3.41Å; I341-C344 WeakPolarHBondContact O-CB 3.45Å; I341-C344 PolarHBondContact O-N 3.27Å; C344-S346 VanDerWaalsContact C-N 3.3Å; C344-S346 PolarHBondContact O-N 2.85Å; C344-L347 PolarHBondContact O-N 3.49Å; C344-L347 VanDerWaalsContact O-N 3.15Å; C344-I348 WeakPolarHBondContact O-CG1 3.5Å; C344-I348 PolarHBondContact O-N 3.37Å; C344-I427 HydrophobicContact CB-CD1 3.92Å; C344-I427 HydrophobicContact CB-CG1 4.41Å; C344-I427 HydrophobicContact CB-CG2 4.46Å; C344-I434 HydrophobicContact CB-CG2 4.04Å |
| 345 | L | 88.2 | Confident | 84 | Confident | 4 Ų | 4 | 32.4 Ų | 32.4 | 2% | 0.021 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -58 | -43.1 | 177.2 | -65.5 | 169.9 | 0 | 0 | 0 | 111.7 | I341 I348 T349 L389 I392 F424 I427 | I341-L345 HydrophobicContact CG2-CD1 3.77Å; I341-L345 HydrophobicContact CG2-CG 4.12Å; I341-L345 VanDerWaalsContact O-CG 3.25Å; I341-L345 WeakPolarHBondContact O-CG 3.4Å; I341-L345 PolarHBondContact O-N 2.89Å; L345-I348 PolarHBondContact O-N 3.35Å; L345-T349 WeakPolarHBondContact O-CB 3.22Å; L345-T349 PolarHBondContact O-N 2.96Å; L345-T349 PolarHBondContact O-OG1 3.34Å; L345-L389 HydrophobicContact CD2-CD2 4.04Å; L345-I392 HydrophobicContact CD1-CD1 4.14Å; L345-I392 HydrophobicContact CD1-CG2 3.94Å; L345-I392 HydrophobicContact CD2-CG2 4.43Å; L345-F424 HydrophobicContact CB-CE1 4.42Å; L345-F424 HydrophobicContact CB-CZ 4.27Å; L345-F424 HydrophobicContact CD2-CB 3.98Å; L345-F424 HydrophobicContact CD2-CD1 3.57Å; L345-F424 HydrophobicContact CD2-CD2 3.39Å; L345-F424 HydrophobicContact CD2-CE1 3.78Å; L345-F424 HydrophobicContact CD2-CE2 3.63Å; L345-F424 HydrophobicContact CD2-CG 3.36Å; L345-F424 HydrophobicContact CD2-CZ 3.82Å; L345-I427 HydrophobicContact CD2-CD1 3.6Å; L345-I427 HydrophobicContact CG-CD1 4.04Å |
| 346 | S | 86.4 | Confident | 82.7 | Confident | 16 Ų | 16 | 32.4 Ų | 32.4 | 11% | 0.112 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -65.9 | -39.9 | 177.3 | -61.2 | 0 | 0 | 0 | 0 | 111.9 | I342 A343 C344 N350 | I342-S346 VanDerWaalsContact O-CB 3.24Å; I342-S346 WeakPolarHBondContact O-CB 3.48Å; I342-S346 PolarHBondContact O-N 3.13Å; I342-S346 PolarHBondContact O-OG 3.13Å; A343-S346 PolarHBondContact O-N 3.19Å; C344-S346 VanDerWaalsContact C-N 3.3Å; C344-S346 PolarHBondContact O-N 2.85Å; S346-N350 VanDerWaalsContact O-CB 3.26Å; S346-N350 WeakPolarHBondContact O-CB 3.34Å; S346-N350 VanDerWaalsContact O-CG 3.24Å; S346-N350 PolarHBondContact O-N 3.31Å; S346-N350 PolarHBondContact O-ND2 3Å; S346-N350 VanDerWaalsContact O-ND2 3.16Å |
| 347 | L | 85.4 | Confident | 81.2 | Confident | 43 Ų | 43 | 33.1 Ų | 33.1 | 23% | 0.225 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -66.6 | -44.1 | 177.7 | -170.4 | 71.1 | 0 | 0 | 0 | 111.3 | A343 C344 N350 N351 I434 L437 I438 | A343-L347 WeakPolarHBondContact O-CB 3.39Å; A343-L347 PolarHBondContact O-N 3.4Å; C344-L347 PolarHBondContact O-N 3.49Å; C344-L347 VanDerWaalsContact O-N 3.15Å; L347-N350 PolarHBondContact O-N 3.15Å; L347-N351 WeakPolarHBondContact O-CB 3.25Å; L347-N351 PolarHBondContact O-N 3.49Å; L347-I434 HydrophobicContact CD2-CG2 3.89Å; L347-L437 HydrophobicContact CD2-CD2 4.5Å; L347-I438 HydrophobicContact CD2-CD1 4.38Å |
| 348 | I | 86.4 | Confident | 79.7 | Confident | 1 Ų | 1 | 34.3 Ų | 34.3 | 1% | 0.005 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61 | -48.7 | 176.1 | -68.2 | 163.1 | 0 | 0 | 0 | 110.1 | C344 L345 N350 N351 M352 L420 Q423 F424 I427 I434 | C344-I348 WeakPolarHBondContact O-CG1 3.5Å; C344-I348 PolarHBondContact O-N 3.37Å; L345-I348 PolarHBondContact O-N 3.35Å; I348-N350 VanDerWaalsContact C-N 3.34Å; I348-N350 PolarHBondContact O-N 3.46Å; I348-N351 PolarHBondContact O-N 3.01Å; I348-N351 VanDerWaalsContact O-N 3.13Å; I348-M352 HydrophobicContact CG2-SD 4.3Å; I348-M352 PolarHBondContact O-N 2.9Å; I348-L420 HydrophobicContact CG2-CD1 3.89Å; I348-Q423 HydrophobicContact CD1-CB 4.46Å; I348-Q423 HydrophobicContact CG2-CB 3.92Å; I348-F424 HydrophobicContact CB-CD1 4.23Å; I348-F424 HydrophobicContact CB-CE1 3.81Å; I348-F424 HydrophobicContact CD1-CD1 3.96Å; I348-F424 HydrophobicContact CD1-CE1 4.33Å; I348-F424 HydrophobicContact CG2-CD1 3.82Å; I348-F424 HydrophobicContact CG2-CE1 3.54Å; I348-I427 HydrophobicContact CD1-CD1 3.81Å; I348-I427 HydrophobicContact CD1-CG1 4Å; I348-I434 HydrophobicContact CD1-CD1 4.13Å; I348-I434 HydrophobicContact CG1-CD1 3.57Å |
| 349 | T | 84.2 | Confident | 78.5 | Confident | 12 Ų | 12 | 35.5 Ų | 35.5 | 7% | 0.074 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -60.9 | -43.5 | 178.5 | -53.5 | 0 | 0 | 0 | 0 | 111.2 | L345 N351 M352 V353 L367 T396 F424 | L345-T349 WeakPolarHBondContact O-CB 3.22Å; L345-T349 PolarHBondContact O-N 2.96Å; L345-T349 PolarHBondContact O-OG1 3.34Å; T349-N351 VanDerWaalsContact C-N 3.33Å; T349-N351 PolarHBondContact O-N 3.06Å; T349-M352 PolarHBondContact O-N 2.88Å; T349-V353 HydrophobicContact CG2-CG2 4.26Å; T349-V353 WeakPolarHBondContact O-CA 3.19Å; T349-V353 VanDerWaalsContact O-CB 3.27Å; T349-V353 WeakPolarHBondContact O-CB 3.4Å; T349-V353 VanDerWaalsContact O-CG2 3.29Å; T349-V353 WeakPolarHBondContact O-CG2 3.21Å; T349-V353 PolarHBondContact O-N 2.97Å; T349-L367 HydrophobicContact CG2-CD1 4.08Å; T349-T396 HydrophobicContact CG2-CG2 4.15Å; T349-F424 WeakPolarHBondContact OG1-CZ 3.35Å |
| 350 | N | 82.4 | Confident | 77.5 | Confident | 78 Ų | 78 | 36.5 Ų | 36.5 | 42% | 0.417 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -68.7 | -31 | 176.6 | -76.2 | -30.4 | 0 | 0 | 0 | 112.7 | S346 L347 I348 G354 | S346-N350 VanDerWaalsContact O-CB 3.26Å; S346-N350 WeakPolarHBondContact O-CB 3.34Å; S346-N350 VanDerWaalsContact O-CG 3.24Å; S346-N350 PolarHBondContact O-N 3.31Å; S346-N350 PolarHBondContact O-ND2 3Å; S346-N350 VanDerWaalsContact O-ND2 3.16Å; L347-N350 PolarHBondContact O-N 3.15Å; I348-N350 VanDerWaalsContact C-N 3.34Å; I348-N350 PolarHBondContact O-N 3.46Å; N350-G354 WeakPolarHBondContact O-CA 3.48Å; N350-G354 PolarHBondContact O-N 3Å |
| 351 | N | 82.9 | Confident | 76.8 | Confident | 134 Ų | 134 | 40.5 Ų | 40.5 | 72% | 0.717 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -68.7 | -42.8 | 175.4 | -172.4 | -96 | 0 | 0 | 0 | 111.6 | L347 I348 T349 | L347-N351 WeakPolarHBondContact O-CB 3.25Å; L347-N351 PolarHBondContact O-N 3.49Å; I348-N351 PolarHBondContact O-N 3.01Å; I348-N351 VanDerWaalsContact O-N 3.13Å; T349-N351 VanDerWaalsContact C-N 3.33Å; T349-N351 PolarHBondContact O-N 3.06Å |
| 352 | M | 76.6 | Confident | 76.3 | Confident | 51 Ų | 51 | 45.6 Ų | 45.6 | 25% | 0.251 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -78.8 | -34.1 | -178.9 | -66.7 | -173 | 71.9 | 0 | 0 | 113.4 | I348 T349 I416 N419 L420 | I348-M352 HydrophobicContact CG2-SD 4.3Å; I348-M352 PolarHBondContact O-N 2.9Å; T349-M352 PolarHBondContact O-N 2.88Å; M352-I416 HydrophobicContact CE-CG2 4.11Å; M352-N419 HydrophobicContact CE-CB 4.04Å; M352-L420 HydrophobicContact CE-CB 4.15Å; M352-L420 HydrophobicContact CE-CD1 4.49Å; M352-L420 HydrophobicContact CG-CD1 4.45Å; M352-L420 HydrophobicContact SD-CB 3.96Å; M352-L420 HydrophobicContact SD-CD1 3.4Å; M352-L420 WeakPolarHBondContact SD-CD1 3.38Å; M352-L420 HydrophobicContact SD-CG 4.3Å |
| 353 | V | 71.1 | Confident | 75.9 | Confident | 1 Ų | 1 | 45.9 Ų | 45.9 | 1% | 0.006 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -122.9 | -11 | -166.5 | -159.4 | 0 | 0 | 0 | 0 | 112.6 | T349 A355 I356 T357 V400 F412 | T349-V353 HydrophobicContact CG2-CG2 4.26Å; T349-V353 WeakPolarHBondContact O-CA 3.19Å; T349-V353 VanDerWaalsContact O-CB 3.27Å; T349-V353 WeakPolarHBondContact O-CB 3.4Å; T349-V353 VanDerWaalsContact O-CG2 3.29Å; T349-V353 WeakPolarHBondContact O-CG2 3.21Å; T349-V353 PolarHBondContact O-N 2.97Å; V353-A355 PolarHBondContact O-N 3.25Å; V353-I356 HydrophobicContact CG1-CB 4.29Å; V353-I356 WeakPolarHBondContact O-CA 3.32Å; V353-I356 WeakPolarHBondContact O-CB 3.44Å; V353-I356 PolarHBondContact O-N 3.42Å; V353-T357 HydrophobicContact CG1-CG2 3.6Å; V353-T357 PolarHBondContact O-N 3.29Å; V353-T357 PolarHBondContact O-OG1 2.75Å; V353-V400 HydrophobicContact CG1-CG1 4.02Å; V353-F412 HydrophobicContact CB-CZ 4.21Å; V353-F412 HydrophobicContact CG1-CE1 4.16Å; V353-F412 HydrophobicContact CG1-CZ 3.68Å; V353-F412 HydrophobicContact CG2-CE1 4.4Å; V353-F412 HydrophobicContact CG2-CE2 4.06Å; V353-F412 HydrophobicContact CG2-CZ 3.42Å; V353-F412 VanDerWaalsContact CG2-CZ 3.42Å |
| 354 | G | 67.3 | Low | 75.5 | Confident | 22 Ų | 22 | 47.2 Ų | 47.2 | 23% | 0.227 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -60.6 | -24.3 | -170.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | N350 I356 G358 | N350-G354 WeakPolarHBondContact O-CA 3.48Å; N350-G354 PolarHBondContact O-N 3Å; G354-I356 VanDerWaalsContact C-N 3.29Å; G354-I356 PolarHBondContact O-N 2.9Å; G354-G358 VanDerWaalsContact O-CA 3.3Å; G354-G358 WeakPolarHBondContact O-CA 3.27Å; G354-G358 PolarHBondContact O-N 3.41Å |
| 355 | A | 64.6 | Low | 75.2 | Confident | 110 Ų | 110 | 50.4 Ų | 50.4 | 91% | 0.909 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -69.5 | -26.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | V353 | V353-A355 PolarHBondContact O-N 3.25Å |
| 356 | I | 60.9 | Low | 75 | Confident | 82 Ų | 82 | 54.3 Ų | 54.3 | 42% | 0.421 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -96.2 | -32.8 | -177.9 | -53 | 171.3 | 0 | 0 | 0 | 110.9 | V353 G354 L404 L409 | V353-I356 HydrophobicContact CG1-CB 4.29Å; V353-I356 WeakPolarHBondContact O-CA 3.32Å; V353-I356 WeakPolarHBondContact O-CB 3.44Å; V353-I356 PolarHBondContact O-N 3.42Å; G354-I356 VanDerWaalsContact C-N 3.29Å; G354-I356 PolarHBondContact O-N 2.9Å; I356-L404 HydrophobicContact CG2-CD2 3.47Å; I356-L404 VanDerWaalsContact CG2-CD2 3.47Å; I356-L409 HydrophobicContact CG2-CD1 3.99Å |
| 357 | T | 59.7 | Low | 74.9 | Confident | 17 Ų | 17 | 54.2 Ų | 54.2 | 10% | 0.104 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -103.3 | -1.2 | -177.2 | 51.4 | 0 | 0 | 0 | 0 | 114.4 | V353 G359 L360 L363 | V353-T357 HydrophobicContact CG1-CG2 3.6Å; V353-T357 PolarHBondContact O-N 3.29Å; V353-T357 PolarHBondContact O-OG1 2.75Å; T357-G359 PolarHBondContact O-N 3.07Å; T357-L360 PolarHBondContact O-N 2.96Å; T357-L363 HydrophobicContact CG2-CD2 3.59Å |
| 358 | G | 57.5 | Low | 75 | Confident | 71 Ų | 71 | 53.4 Ų | 53.4 | 73% | 0.732 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.3 | 92 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | G354 | G354-G358 VanDerWaalsContact O-CA 3.3Å; G354-G358 WeakPolarHBondContact O-CA 3.27Å; G354-G358 PolarHBondContact O-N 3.41Å |
| 359 | G | 62 | Low | 75 | Confident | 64 Ų | 64 | 62 Ų | 62 | 66% | 0.66 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 133.5 | 1 | -174.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | T357 P361 | T357-G359 PolarHBondContact O-N 3.07Å; G359-P361 VanDerWaalsContact O-CD 3.31Å; G359-P361 WeakPolarHBondContact O-CD 3.31Å |
| 360 | L | 68.7 | Low | 75.1 | Confident | 39 Ų | 39 | 63.4 Ų | 63.4 | 20% | 0.204 | 37% | 0.374 | C | S | . | . | trans | -115.2 | 79.6 | 176.6 | -78.2 | 172.7 | 0 | 0 | 0 | 112.5 | T357 E362 L363 T403 | T357-L360 PolarHBondContact O-N 2.96Å; L360-E362 PolarHBondContact O-N 3.43Å; L360-L363 HydrophobicContact CB-CB 4.16Å; L360-L363 PolarHBondContact O-N 2.95Å; L360-T403 HydrophobicContact CD1-CG2 3.58Å | ||
| 361 | P | 74.1 | Confident | 75.2 | Confident | 92 Ų | 92 | 60 Ų | 60 | 60% | 0.597 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -62.8 | -25 | 175.6 | 26.3 | -34 | 0 | 0 | 0 | 112.6 | G359 N365 | G359-P361 VanDerWaalsContact O-CD 3.31Å; G359-P361 WeakPolarHBondContact O-CD 3.31Å; P361-N365 PolarHBondContact O-N 3.19Å; P361-N365 PolarHBondContact O-ND2 3.32Å |
| 362 | E | 79.2 | Confident | 75.4 | Confident | 114 Ų | 114 | 55.6 Ų | 55.6 | 53% | 0.533 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -67.5 | -39.1 | 178.8 | -162.2 | 179.3 | 160.7 | 0 | 0 | 112.7 | L360 N365 R366 | L360-E362 PolarHBondContact O-N 3.43Å; E362-N365 PolarHBondContact O-N 3.3Å; E362-R366 WeakPolarHBondContact O-CG 3.48Å; E362-R366 PolarHBondContact O-N 2.81Å; E362-R366 IonicContact OE1-CZ 3.21Å; E362-R366 IonicContact OE1-NE 3.95Å; E362-R366 IonicContact OE1-NH2 3.79Å; E362-R366 PolarHBondContact OE1-NH2 2.96Å |
| 363 | L | 79.4 | Confident | 75.9 | Confident | 11 Ų | 11 | 57.7 Ų | 57.7 | 6% | 0.058 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -64.6 | -46.2 | 176.1 | 177 | 61.9 | 0 | 0 | 0 | 110.9 | T357 L360 N365 R366 L367 E399 V400 T403 | T357-L363 HydrophobicContact CG2-CD2 3.59Å; L360-L363 HydrophobicContact CB-CB 4.16Å; L360-L363 PolarHBondContact O-N 2.95Å; L363-N365 VanDerWaalsContact C-N 3.27Å; L363-N365 PolarHBondContact O-N 3.48Å; L363-R366 PolarHBondContact O-N 3.48Å; L363-R366 VanDerWaalsContact O-N 3.16Å; L363-L367 HydrophobicContact CD1-CD1 4.2Å; L363-L367 HydrophobicContact CD1-CG 4.13Å; L363-L367 HydrophobicContact CG-CD1 4.11Å; L363-L367 HydrophobicContact CG-CG 4.43Å; L363-L367 WeakPolarHBondContact O-CG 3.49Å; L363-L367 PolarHBondContact O-N 3.01Å; L363-E399 HydrophobicContact CD1-CG 3.76Å; L363-V400 HydrophobicContact CD2-CG2 4.36Å; L363-T403 HydrophobicContact CD2-CG2 4.28Å |
| 364 | A | 79.4 | Confident | 76.6 | Confident | 29 Ų | 29 | 60 Ų | 60 | 24% | 0.24 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -58.4 | -40.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | K368 | A364-K368 WeakPolarHBondContact O-CB 3.39Å; A364-K368 PolarHBondContact O-N 3.31Å |
| 365 | N | 83.3 | Confident | 77.4 | Confident | 67 Ų | 67 | 59 Ų | 59 | 36% | 0.358 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -67.8 | -38 | 175.9 | -78.4 | -34.6 | 0 | 0 | 0 | 113.2 | P361 E362 L363 K368 R369 | P361-N365 PolarHBondContact O-N 3.19Å; P361-N365 PolarHBondContact O-ND2 3.32Å; E362-N365 PolarHBondContact O-N 3.3Å; L363-N365 VanDerWaalsContact C-N 3.27Å; L363-N365 PolarHBondContact O-N 3.48Å; N365-K368 PolarHBondContact O-N 3.02Å; N365-R369 WeakPolarHBondContact O-CG 3.32Å; N365-R369 PolarHBondContact O-N 2.92Å |
| 366 | R | 83.4 | Confident | 78.3 | Confident | 86 Ų | 86 | 60.8 Ų | 60.8 | 33% | 0.325 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -65.6 | -46.8 | 175.1 | -72.4 | 177.9 | -172.7 | -172.1 | 5.9 | 111.5 | E362 L363 K368 R369 I370 E399 | E362-R366 WeakPolarHBondContact O-CG 3.48Å; E362-R366 PolarHBondContact O-N 2.81Å; E362-R366 IonicContact OE1-CZ 3.21Å; E362-R366 IonicContact OE1-NE 3.95Å; E362-R366 IonicContact OE1-NH2 3.79Å; E362-R366 PolarHBondContact OE1-NH2 2.96Å; L363-R366 PolarHBondContact O-N 3.48Å; L363-R366 VanDerWaalsContact O-N 3.16Å; R366-K368 VanDerWaalsContact C-N 3.3Å; R366-K368 PolarHBondContact O-N 3.2Å; R366-R369 PolarHBondContact O-N 3.31Å; R366-R369 VanDerWaalsContact O-N 3.15Å; R366-I370 WeakPolarHBondContact O-CG1 3.22Å; R366-I370 PolarHBondContact O-N 3.44Å; R366-E399 WeakPolarHBondContact CD-OE1 3.22Å; R366-E399 IonicContact NH1-OE1 2.84Å; R366-E399 PolarHBondContact NH1-OE1 3.37Å; R366-E399 VanDerWaalsContact NH1-OE1 3.13Å |
| 367 | L | 84.4 | Confident | 78.9 | Confident | 15 Ų | 15 | 57.8 Ų | 57.8 | 8% | 0.079 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -61.6 | -39.1 | 176.4 | -67.2 | 177.7 | 0 | 0 | 0 | 111.8 | T349 L363 I370 S371 T396 E399 V400 | T349-L367 HydrophobicContact CG2-CD1 4.08Å; L363-L367 HydrophobicContact CD1-CD1 4.2Å; L363-L367 HydrophobicContact CD1-CG 4.13Å; L363-L367 HydrophobicContact CG-CD1 4.11Å; L363-L367 HydrophobicContact CG-CG 4.43Å; L363-L367 WeakPolarHBondContact O-CG 3.49Å; L363-L367 PolarHBondContact O-N 3.01Å; L367-I370 PolarHBondContact O-N 3.25Å; L367-S371 WeakPolarHBondContact O-CB 3.38Å; L367-S371 PolarHBondContact O-N 3.36Å; L367-S371 PolarHBondContact O-OG 3.02Å; L367-T396 HydrophobicContact CD1-CG2 4.05Å; L367-T396 HydrophobicContact CD2-CG2 3.91Å; L367-E399 HydrophobicContact CD2-CB 4.11Å; L367-E399 HydrophobicContact CD2-CG 4.41Å; L367-V400 HydrophobicContact CD1-CG2 4.4Å |
| 368 | K | 86.9 | Confident | 79.6 | Confident | 26 Ų | 26 | 58.7 Ų | 58.7 | 11% | 0.113 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -59 | -48.2 | 172.1 | 176.7 | 170.9 | 66.1 | 172.8 | 0 | 111.7 | I342 A364 N365 R366 S371 A372 V468 E472 | I342-K368 HydrophobicContact CG2-CG 4.03Å; A364-K368 WeakPolarHBondContact O-CB 3.39Å; A364-K368 PolarHBondContact O-N 3.31Å; N365-K368 PolarHBondContact O-N 3.02Å; R366-K368 VanDerWaalsContact C-N 3.3Å; R366-K368 PolarHBondContact O-N 3.2Å; K368-S371 PolarHBondContact O-N 3.41Å; K368-A372 VanDerWaalsContact O-CB 3.3Å; K368-A372 WeakPolarHBondContact O-CB 3.45Å; K368-A372 PolarHBondContact O-N 3.46Å; K368-V468 HydrophobicContact CB-CG1 4.36Å; K368-V468 HydrophobicContact CD-CG1 4.15Å; K368-V468 WeakPolarHBondContact CD-O 3.36Å; K368-V468 PolarHBondContact NZ-O 2.97Å; K368-E472 WeakPolarHBondContact CE-OE1 3.28Å; K368-E472 IonicContact NZ-OE1 3.16Å; K368-E472 PolarHBondContact NZ-OE1 3.42Å; K368-E472 IonicContact NZ-OE2 3.65Å; K368-E472 PolarHBondContact NZ-OE2 3.44Å |
| 369 | R | 86.6 | Confident | 80 | Confident | 181 Ų | 181 | 58.5 Ų | 58.5 | 68% | 0.683 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -62.7 | -44.7 | 179.1 | -70.9 | 176.9 | -161.2 | -172.5 | 4.8 | 112 | N365 R366 A372 V373 | N365-R369 WeakPolarHBondContact O-CG 3.32Å; N365-R369 PolarHBondContact O-N 2.92Å; R366-R369 PolarHBondContact O-N 3.31Å; R366-R369 VanDerWaalsContact O-N 3.15Å; R369-A372 PolarHBondContact O-N 2.94Å; R369-V373 WeakPolarHBondContact O-CG2 3.34Å; R369-V373 PolarHBondContact O-N 3.03Å |
| 370 | I | 86 | Confident | 80.6 | Confident | 42 Ų | 42 | 62.2 Ų | 62.2 | 22% | 0.215 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.3 | -49.4 | 176.9 | -71.7 | 167 | 0 | 0 | 0 | 110.5 | R366 L367 A372 V373 L374 Q395 | R366-I370 WeakPolarHBondContact O-CG1 3.22Å; R366-I370 PolarHBondContact O-N 3.44Å; L367-I370 PolarHBondContact O-N 3.25Å; I370-A372 VanDerWaalsContact C-N 3.33Å; I370-A372 PolarHBondContact O-N 3.29Å; I370-V373 PolarHBondContact O-N 2.96Å; I370-L374 HydrophobicContact CG2-CD1 4.03Å; I370-L374 WeakPolarHBondContact O-CG 3.49Å; I370-L374 PolarHBondContact O-N 2.85Å; I370-L374 VanDerWaalsContact O-N 3.07Å; I370-Q395 HydrophobicContact CG2-CB 4.15Å |
| 371 | S | 86.3 | Confident | 80.5 | Confident | 6 Ų | 6 | 69.9 Ų | 69.9 | 4% | 0.042 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -61.4 | -42.5 | 178.3 | -55.2 | 0 | 0 | 0 | 0 | 111.6 | L367 K368 L374 L375 | L367-S371 WeakPolarHBondContact O-CB 3.38Å; L367-S371 PolarHBondContact O-N 3.36Å; L367-S371 PolarHBondContact O-OG 3.02Å; K368-S371 PolarHBondContact O-N 3.41Å; S371-L374 PolarHBondContact O-N 3.43Å; S371-L375 VanDerWaalsContact O-CB 3.3Å; S371-L375 WeakPolarHBondContact O-CB 3.38Å; S371-L375 WeakPolarHBondContact O-CD1 3.45Å; S371-L375 WeakPolarHBondContact O-CG 3.24Å; S371-L375 PolarHBondContact O-N 3.06Å |
| 372 | A | 87.1 | Confident | 80.2 | Confident | 41 Ų | 41 | 71.7 Ų | 71.7 | 34% | 0.339 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -63 | -42.8 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | I342 K368 R369 I370 L375 E376 | I342-A372 HydrophobicContact CD1-CB 4.05Å; K368-A372 VanDerWaalsContact O-CB 3.3Å; K368-A372 WeakPolarHBondContact O-CB 3.45Å; K368-A372 PolarHBondContact O-N 3.46Å; R369-A372 PolarHBondContact O-N 2.94Å; I370-A372 VanDerWaalsContact C-N 3.33Å; I370-A372 PolarHBondContact O-N 3.29Å; A372-L375 PolarHBondContact O-N 3.25Å; A372-E376 PolarHBondContact O-N 2.84Å |
| 373 | V | 86.8 | Confident | 80.1 | Confident | 96 Ų | 96 | 68.5 Ų | 68.5 | 58% | 0.582 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -66.4 | -41.8 | 177.4 | 172.5 | 0 | 0 | 0 | 0 | 111.2 | R369 I370 L375 E376 | R369-V373 WeakPolarHBondContact O-CG2 3.34Å; R369-V373 PolarHBondContact O-N 3.03Å; I370-V373 PolarHBondContact O-N 2.96Å; V373-L375 VanDerWaalsContact C-N 3.33Å; V373-L375 PolarHBondContact O-N 2.89Å; V373-E376 VanDerWaalsContact O-CB 3.22Å; V373-E376 WeakPolarHBondContact O-CB 3.3Å; V373-E376 PolarHBondContact O-N 3.28Å |
| 374 | L | 84.7 | Confident | 80.3 | Confident | 50 Ų | 50 | 71.1 Ų | 71.1 | 26% | 0.262 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -72.6 | -26.4 | -179.7 | -69.9 | 176.6 | 0 | 0 | 0 | 113.3 | I370 S371 E376 V388 I392 | I370-L374 HydrophobicContact CG2-CD1 4.03Å; I370-L374 WeakPolarHBondContact O-CG 3.49Å; I370-L374 PolarHBondContact O-N 2.85Å; I370-L374 VanDerWaalsContact O-N 3.07Å; S371-L374 PolarHBondContact O-N 3.43Å; L374-E376 VanDerWaalsContact C-N 3.29Å; L374-V388 HydrophobicContact CB-CG1 4.12Å; L374-V388 VanDerWaalsContact O-CG1 3.27Å; L374-V388 WeakPolarHBondContact O-CG1 3.09Å; L374-I392 HydrophobicContact CB-CD1 4.15Å; L374-I392 HydrophobicContact CB-CG1 3.87Å; L374-I392 HydrophobicContact CD1-CB 4.45Å; L374-I392 HydrophobicContact CD1-CG1 3.53Å; L374-I392 HydrophobicContact CG-CG1 4.37Å |
| 375 | L | 84.8 | Confident | 80.4 | Confident | 0 Ų | 0 | 71.5 Ų | 71.5 | 0% | 0 | 36% | 0.358 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | 1 | 174.5 | -66.5 | 168.5 | 0 | 0 | 0 | 113 | Q338 I341 I342 S371 A372 V373 G377 M378 F383 L385 V388 I392 | Q338-L375 HydrophobicContact CG-CB 4.49Å; Q338-L375 PolarHBondContact NE2-O 2.98Å; I341-L375 HydrophobicContact CB-CD1 4.05Å; I341-L375 HydrophobicContact CD1-CD2 4.22Å; I341-L375 HydrophobicContact CG2-CD1 3.73Å; I341-L375 HydrophobicContact CG2-CD2 4.12Å; I342-L375 HydrophobicContact CD1-CD1 4.45Å; I342-L375 HydrophobicContact CG1-CD1 3.81Å; S371-L375 VanDerWaalsContact O-CB 3.3Å; S371-L375 WeakPolarHBondContact O-CB 3.38Å; S371-L375 WeakPolarHBondContact O-CD1 3.45Å; S371-L375 WeakPolarHBondContact O-CG 3.24Å; S371-L375 PolarHBondContact O-N 3.06Å; A372-L375 PolarHBondContact O-N 3.25Å; V373-L375 VanDerWaalsContact C-N 3.33Å; V373-L375 PolarHBondContact O-N 2.89Å; L375-G377 PolarHBondContact O-N 2.92Å; L375-M378 PolarHBondContact O-N 3.13Å; L375-F383 HydrophobicContact CD2-CZ 4.34Å; L375-L385 HydrophobicContact CD2-CD1 4.24Å; L375-V388 HydrophobicContact CD2-CG1 3.99Å; L375-I392 HydrophobicContact CD1-CD1 4.39Å; L375-I392 HydrophobicContact CD2-CD1 4.1Å; L375-I392 HydrophobicContact CG-CD1 3.95Å |
| 376 | E | 82.3 | Confident | 80.5 | Confident | 148 Ų | 148 | 73.7 Ų | 73.7 | 69% | 0.692 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.3 | 123.1 | 176.4 | -165.9 | 171.9 | -173.2 | 0 | 0 | 110 | A372 V373 L374 | A372-E376 PolarHBondContact O-N 2.84Å; V373-E376 VanDerWaalsContact O-CB 3.22Å; V373-E376 WeakPolarHBondContact O-CB 3.3Å; V373-E376 PolarHBondContact O-N 3.28Å; L374-E376 VanDerWaalsContact C-N 3.29Å |
| 377 | G | 74.1 | Confident | 80.5 | Confident | 19 Ų | 19 | 75.6 Ų | 75.6 | 20% | 0.196 | 38% | 0.377 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 89 | 16.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | L375 N379 K380 F383 | L375-G377 PolarHBondContact O-N 2.92Å; G377-N379 PolarHBondContact O-N 3.17Å; G377-K380 WeakPolarHBondContact O-CB 3.46Å; G377-K380 PolarHBondContact O-N 3.5Å; G377-K380 VanDerWaalsContact O-N 3.07Å; G377-F383 WeakPolarHBondContact O-CD2 3.3Å |
| 378 | M | 74.7 | Confident | 80.6 | Confident | 35 Ų | 35 | 76.1 Ų | 76.1 | 17% | 0.172 | 38% | 0.381 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -50.9 | -21.9 | 172.8 | -171.1 | 174.7 | 74.8 | 0 | 0 | 114.7 | N337 Q338 I341 L375 K380 F383 | N337-M378 HydrophobicContact CB-CE 3.52Å; Q338-M378 HydrophobicContact CG-CE 3.96Å; I341-M378 HydrophobicContact CD1-CE 4.32Å; I341-M378 HydrophobicContact CD1-SD 3.33Å; I341-M378 WeakPolarHBondContact CD1-SD 3.37Å; L375-M378 PolarHBondContact O-N 3.13Å; M378-K380 VanDerWaalsContact C-N 3.33Å; M378-F383 HydrophobicContact CB-CD1 4.26Å; M378-F383 HydrophobicContact CB-CE1 4.01Å; M378-F383 HydrophobicContact CB-CE2 4.44Å; M378-F383 HydrophobicContact CB-CZ 4.09Å; M378-F383 HydrophobicContact CG-CD1 3.99Å; M378-F383 HydrophobicContact CG-CE1 3.74Å; M378-F383 HydrophobicContact CG-CZ 4.29Å |
| 379 | N | 66.9 | Low | 80.6 | Confident | 67 Ų | 67 | 74.9 Ų | 74.9 | 36% | 0.358 | 38% | 0.375 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.8 | 2.1 | -175 | -39.6 | -47 | 0 | 0 | 0 | 112.9 | E334 G377 | E334-N379 VanDerWaalsContact CB-ND2 3.32Å; E334-N379 WeakPolarHBondContact CB-ND2 3.42Å; E334-N379 HydrophobicContact CG-CB 4.13Å; E334-N379 VanDerWaalsContact CG-ND2 3.34Å; E334-N379 WeakPolarHBondContact CG-ND2 3.46Å; E334-N379 WeakPolarHBondContact CG-OD1 3.36Å; E334-N379 PolarHBondContact OE2-ND2 2.95Å; G377-N379 PolarHBondContact O-N 3.17Å |
| 380 | K | 74.5 | Confident | 80.7 | Confident | 143 Ų | 143 | 68.7 Ų | 68.7 | 62% | 0.622 | 36% | 0.356 | S | S | * | . | S | Bend | trans | -85.8 | 138.4 | 175.8 | -64.5 | 178.3 | -179.6 | 175 | 0 | 109.8 | G377 M378 T382 F383 | G377-K380 WeakPolarHBondContact O-CB 3.46Å; G377-K380 PolarHBondContact O-N 3.5Å; G377-K380 VanDerWaalsContact O-N 3.07Å; M378-K380 VanDerWaalsContact C-N 3.33Å; K380-T382 PolarHBondContact O-N 3.15Å; K380-F383 WeakPolarHBondContact O-CB 3.27Å; K380-F383 PolarHBondContact O-N 3.26Å |
| 381 | E | 65.3 | Low | 80.7 | Confident | 200 Ų | 200 | 69.4 Ų | 69.4 | 94% | 0.935 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.8 | -21.4 | 178.4 | -64.5 | -177.7 | 165.9 | 0 | 0 | 114.1 | F383 | E381-F383 VanDerWaalsContact C-N 3.34Š|
| 382 | T | 68.7 | Low | 80.8 | Confident | 130 Ų | 130 | 69.1 Ų | 69.1 | 80% | 0.798 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.2 | -0.9 | 179.1 | 49.3 | 0 | 0 | 0 | 0 | 113.8 | K380 N384 | K380-T382 PolarHBondContact O-N 3.15Å; T382-N384 PolarHBondContact O-N 3.47Å |
| 383 | F | 77.6 | Confident | 80.8 | Confident | 47 Ų | 47 | 67.1 Ų | 67.1 | 21% | 0.206 | 35% | 0.346 | C | S | . | . | trans | -78 | 115.7 | -174.2 | -171.3 | -93.5 | 0 | 0 | 0 | 111.7 | L375 G377 M378 K380 E381 L385 V388 | L375-F383 HydrophobicContact CD2-CZ 4.34Å; G377-F383 WeakPolarHBondContact O-CD2 3.3Å; M378-F383 HydrophobicContact CB-CD1 4.26Å; M378-F383 HydrophobicContact CB-CE1 4.01Å; M378-F383 HydrophobicContact CB-CE2 4.44Å; M378-F383 HydrophobicContact CB-CZ 4.09Å; M378-F383 HydrophobicContact CG-CD1 3.99Å; M378-F383 HydrophobicContact CG-CE1 3.74Å; M378-F383 HydrophobicContact CG-CZ 4.29Å; K380-F383 WeakPolarHBondContact O-CB 3.27Å; K380-F383 PolarHBondContact O-N 3.26Å; E381-F383 VanDerWaalsContact C-N 3.34Å; F383-L385 HydrophobicContact CD1-CB 4.23Å; F383-L385 HydrophobicContact CE1-CB 4.02Å; F383-L385 HydrophobicContact CE1-CD1 3.9Å; F383-L385 PolarHBondContact O-N 3.38Å; F383-V388 HydrophobicContact CE1-CB 4.44Å; F383-V388 HydrophobicContact CE1-CG2 4.3Å; F383-V388 HydrophobicContact CE2-CG2 3.84Å; F383-V388 HydrophobicContact CZ-CB 3.97Å; F383-V388 HydrophobicContact CZ-CG1 3.93Å; F383-V388 HydrophobicContact CZ-CG2 3.67Å | ||
| 384 | N | 81.9 | Confident | 80.9 | Confident | 66 Ų | 66 | 66.7 Ų | 66.7 | 35% | 0.353 | 34% | 0.343 | S | S | . | . | trans | -92.3 | 95.1 | 173.6 | -171.4 | -26.7 | 0 | 0 | 0 | 110.2 | T382 K386 E387 V388 | T382-N384 PolarHBondContact O-N 3.47Å; N384-K386 VanDerWaalsContact C-N 3.27Å; N384-K386 PolarHBondContact O-N 2.95Å; N384-K386 WeakPolarHBondContact OD1-CB 3.5Å; N384-K386 PolarHBondContact OD1-N 3.41Å; N384-E387 HydrophobicContact CB-CB 4.18Å; N384-E387 HydrophobicContact CB-CG 4.31Å; N384-E387 WeakPolarHBondContact ND2-CG 3.47Å; N384-E387 PolarHBondContact ND2-OE1 3.34Å; N384-E387 PolarHBondContact O-N 3.17Å; N384-E387 PolarHBondContact OD1-N 3.47Å; N384-V388 WeakPolarHBondContact O-CG2 3.46Å; N384-V388 PolarHBondContact O-N 3.05Å | ||
| 385 | L | 82.6 | Confident | 81 | Confident | 37 Ų | 37 | 68.1 Ų | 68.1 | 19% | 0.194 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -57.5 | -39.9 | -178.7 | 178.6 | 61.1 | 0 | 0 | 0 | 112 | I341 L375 F383 E387 V388 L389 E428 | I341-L385 HydrophobicContact CD1-CD1 3.94Å; L375-L385 HydrophobicContact CD2-CD1 4.24Å; F383-L385 HydrophobicContact CD1-CB 4.23Å; F383-L385 HydrophobicContact CE1-CB 4.02Å; F383-L385 HydrophobicContact CE1-CD1 3.9Å; F383-L385 PolarHBondContact O-N 3.38Å; L385-E387 PolarHBondContact O-N 2.94Å; L385-V388 PolarHBondContact O-N 3.08Å; L385-L389 HydrophobicContact CD1-CD1 3.94Å; L385-L389 HydrophobicContact CD1-CD2 4.41Å; L385-L389 HydrophobicContact CD1-CG 3.92Å; L385-L389 HydrophobicContact CD2-CD1 4.33Å; L385-L389 HydrophobicContact CG-CD1 3.71Å; L385-L389 HydrophobicContact CG-CG 4.18Å; L385-L389 WeakPolarHBondContact O-CB 3.24Å; L385-L389 VanDerWaalsContact O-CG 3.24Å; L385-L389 WeakPolarHBondContact O-CG 3.43Å; L385-L389 PolarHBondContact O-N 3.2Å; L385-E428 HydrophobicContact CD2-CB 4.43Å; L385-E428 HydrophobicContact CD2-CG 4.29Å |
| 386 | K | 84.3 | Confident | 81 | Confident | 113 Ų | 113 | 68.2 Ų | 68.2 | 49% | 0.491 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -61.8 | -45 | 179.9 | -166.3 | 169.8 | -178.4 | 168.6 | 0 | 113.1 | N384 V388 L389 N390 E428 | N384-K386 VanDerWaalsContact C-N 3.27Å; N384-K386 PolarHBondContact O-N 2.95Å; N384-K386 WeakPolarHBondContact OD1-CB 3.5Å; N384-K386 PolarHBondContact OD1-N 3.41Å; K386-V388 VanDerWaalsContact C-N 3.33Å; K386-L389 PolarHBondContact O-N 3.23Å; K386-N390 WeakPolarHBondContact O-CB 3.4Å; K386-N390 PolarHBondContact O-N 3.13Å; K386-N390 PolarHBondContact O-ND2 3.4Å; K386-E428 WeakPolarHBondContact CB-OE2 3.43Å |
| 387 | E | 85 | Confident | 81.2 | Confident | 125 Ų | 125 | 61.3 Ų | 61.3 | 58% | 0.584 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -66.1 | -38.9 | 178.1 | -76 | 176.7 | -169.8 | 0 | 0 | 111.7 | N384 L385 N390 S391 | N384-E387 HydrophobicContact CB-CB 4.18Å; N384-E387 HydrophobicContact CB-CG 4.31Å; N384-E387 WeakPolarHBondContact ND2-CG 3.47Å; N384-E387 PolarHBondContact ND2-OE1 3.34Å; N384-E387 PolarHBondContact O-N 3.17Å; N384-E387 PolarHBondContact OD1-N 3.47Å; L385-E387 PolarHBondContact O-N 2.94Å; E387-N390 PolarHBondContact O-N 3.48Å; E387-S391 WeakPolarHBondContact O-CB 3.31Å; E387-S391 PolarHBondContact O-N 2.84Å; E387-S391 PolarHBondContact O-OG 3.23Å |
| 388 | V | 86.4 | Confident | 81.8 | Confident | 26 Ų | 26 | 63.2 Ų | 63.2 | 16% | 0.158 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -66.1 | -45.5 | 176.4 | 171.6 | 0 | 0 | 0 | 0 | 111.1 | L374 L375 F383 N384 L385 K386 N390 S391 I392 | L374-V388 HydrophobicContact CB-CG1 4.12Å; L374-V388 VanDerWaalsContact O-CG1 3.27Å; L374-V388 WeakPolarHBondContact O-CG1 3.09Å; L375-V388 HydrophobicContact CD2-CG1 3.99Å; F383-V388 HydrophobicContact CE1-CB 4.44Å; F383-V388 HydrophobicContact CE1-CG2 4.3Å; F383-V388 HydrophobicContact CE2-CG2 3.84Å; F383-V388 HydrophobicContact CZ-CB 3.97Å; F383-V388 HydrophobicContact CZ-CG1 3.93Å; F383-V388 HydrophobicContact CZ-CG2 3.67Å; N384-V388 WeakPolarHBondContact O-CG2 3.46Å; N384-V388 PolarHBondContact O-N 3.05Å; L385-V388 PolarHBondContact O-N 3.08Å; K386-V388 VanDerWaalsContact C-N 3.33Å; V388-N390 VanDerWaalsContact C-N 3.32Å; V388-N390 PolarHBondContact O-N 3.39Å; V388-S391 WeakPolarHBondContact O-CB 3.4Å; V388-S391 PolarHBondContact O-N 3.44Å; V388-S391 VanDerWaalsContact O-N 3.14Å; V388-I392 HydrophobicContact CG1-CD1 3.76Å; V388-I392 HydrophobicContact CG1-CG1 4.33Å; V388-I392 VanDerWaalsContact O-CG1 3.26Å; V388-I392 WeakPolarHBondContact O-CG1 3.35Å; V388-I392 PolarHBondContact O-N 3.35Å |
| 389 | L | 87.1 | Confident | 82.3 | Confident | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -61.1 | -40.3 | 176.4 | -71.5 | 170.3 | 0 | 0 | 0 | 112 | I341 L345 L385 K386 I392 G393 F424 I427 | I341-L389 HydrophobicContact CG2-CD2 3.9Å; L345-L389 HydrophobicContact CD2-CD2 4.04Å; L385-L389 HydrophobicContact CD1-CD1 3.94Å; L385-L389 HydrophobicContact CD1-CD2 4.41Å; L385-L389 HydrophobicContact CD1-CG 3.92Å; L385-L389 HydrophobicContact CD2-CD1 4.33Å; L385-L389 HydrophobicContact CG-CD1 3.71Å; L385-L389 HydrophobicContact CG-CG 4.18Å; L385-L389 WeakPolarHBondContact O-CB 3.24Å; L385-L389 VanDerWaalsContact O-CG 3.24Å; L385-L389 WeakPolarHBondContact O-CG 3.43Å; L385-L389 PolarHBondContact O-N 3.2Å; K386-L389 PolarHBondContact O-N 3.23Å; L389-I392 PolarHBondContact O-N 3.27Å; L389-G393 PolarHBondContact O-N 3.38Å; L389-F424 WeakPolarHBondContact CD1-O 3.2Å; L389-I427 HydrophobicContact CD1-CB 4.36Å; L389-I427 HydrophobicContact CD2-CD1 4.37Å |
| 390 | N | 86.9 | Confident | 83.1 | Confident | 52 Ų | 52 | 59.8 Ų | 59.8 | 28% | 0.278 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -62 | -45.5 | 172.7 | -81.1 | -60 | 0 | 0 | 0 | 111.9 | K386 E387 V388 I392 G393 V394 I421 S425 | K386-N390 WeakPolarHBondContact O-CB 3.4Å; K386-N390 PolarHBondContact O-N 3.13Å; K386-N390 PolarHBondContact O-ND2 3.4Å; E387-N390 PolarHBondContact O-N 3.48Å; V388-N390 VanDerWaalsContact C-N 3.32Å; V388-N390 PolarHBondContact O-N 3.39Å; N390-I392 VanDerWaalsContact C-N 3.34Å; N390-I392 PolarHBondContact O-N 2.95Å; N390-G393 PolarHBondContact O-N 2.72Å; N390-G393 VanDerWaalsContact O-N 3.13Å; N390-V394 WeakPolarHBondContact O-CG2 3.5Å; N390-V394 PolarHBondContact O-N 2.9Å; N390-I421 WeakPolarHBondContact OD1-CG2 3.43Å; N390-S425 PolarHBondContact ND2-OG 3.23Å; N390-S425 PolarHBondContact OD1-OG 3.49Å |
| 391 | S | 87.4 | Confident | 83.6 | Confident | 56 Ų | 56 | 54 Ų | 54 | 39% | 0.392 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61.5 | -42.6 | 177.5 | -60.4 | 0 | 0 | 0 | 0 | 111.7 | E387 V388 G393 V394 Q395 | E387-S391 WeakPolarHBondContact O-CB 3.31Å; E387-S391 PolarHBondContact O-N 2.84Å; E387-S391 PolarHBondContact O-OG 3.23Å; V388-S391 WeakPolarHBondContact O-CB 3.4Å; V388-S391 PolarHBondContact O-N 3.44Å; V388-S391 VanDerWaalsContact O-N 3.14Å; S391-G393 VanDerWaalsContact C-N 3.32Å; S391-G393 PolarHBondContact O-N 3.36Å; S391-V394 PolarHBondContact O-N 3.2Å; S391-Q395 WeakPolarHBondContact O-CG 3.45Å; S391-Q395 PolarHBondContact O-N 3.5Å |
| 392 | I | 88.8 | Confident | 84.6 | Confident | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -62.1 | -41.4 | 173.9 | -66.5 | 165.3 | 0 | 0 | 0 | 110.5 | L345 L374 L375 V388 L389 N390 Q395 T396 F424 | L345-I392 HydrophobicContact CD1-CD1 4.14Å; L345-I392 HydrophobicContact CD1-CG2 3.94Å; L345-I392 HydrophobicContact CD2-CG2 4.43Å; L374-I392 HydrophobicContact CB-CD1 4.15Å; L374-I392 HydrophobicContact CB-CG1 3.87Å; L374-I392 HydrophobicContact CD1-CB 4.45Å; L374-I392 HydrophobicContact CD1-CG1 3.53Å; L374-I392 HydrophobicContact CG-CG1 4.37Å; L375-I392 HydrophobicContact CD1-CD1 4.39Å; L375-I392 HydrophobicContact CD2-CD1 4.1Å; L375-I392 HydrophobicContact CG-CD1 3.95Å; V388-I392 HydrophobicContact CG1-CD1 3.76Å; V388-I392 HydrophobicContact CG1-CG1 4.33Å; V388-I392 VanDerWaalsContact O-CG1 3.26Å; V388-I392 WeakPolarHBondContact O-CG1 3.35Å; V388-I392 PolarHBondContact O-N 3.35Å; L389-I392 PolarHBondContact O-N 3.27Å; N390-I392 VanDerWaalsContact C-N 3.34Å; N390-I392 PolarHBondContact O-N 2.95Å; I392-Q395 PolarHBondContact O-N 3.5Å; I392-T396 VanDerWaalsContact O-CB 3.26Å; I392-T396 WeakPolarHBondContact O-CB 3.33Å; I392-T396 PolarHBondContact O-N 2.95Å; I392-T396 PolarHBondContact O-OG1 2.69Å; I392-F424 HydrophobicContact CG2-CD2 4.25Å; I392-F424 HydrophobicContact CG2-CE2 4Å |
| 393 | G | 86.3 | Confident | 85.2 | Confident | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.4 | -45.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | L389 N390 S391 T396 C397 | L389-G393 PolarHBondContact O-N 3.38Å; N390-G393 PolarHBondContact O-N 2.72Å; N390-G393 VanDerWaalsContact O-N 3.13Å; S391-G393 VanDerWaalsContact C-N 3.32Å; S391-G393 PolarHBondContact O-N 3.36Å; G393-T396 PolarHBondContact O-N 3.44Å; G393-C397 PolarHBondContact O-N 3.41Å; G393-C397 PolarHBondContact O-SG 3.38Å |
| 394 | V | 88.2 | Confident | 85.3 | Confident | 86 Ų | 86 | 41.3 Ų | 41.3 | 52% | 0.521 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -63.3 | -46.5 | 176.4 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | N390 S391 T396 C397 A398 I421 | N390-V394 WeakPolarHBondContact O-CG2 3.5Å; N390-V394 PolarHBondContact O-N 2.9Å; S391-V394 PolarHBondContact O-N 3.2Å; V394-T396 VanDerWaalsContact C-N 3.33Å; V394-T396 PolarHBondContact O-N 2.85Å; V394-C397 WeakPolarHBondContact O-CB 3.32Å; V394-C397 PolarHBondContact O-N 3.13Å; V394-A398 PolarHBondContact O-N 2.98Å; V394-I421 HydrophobicContact CG2-CD1 3.83Å |
| 395 | Q | 86.9 | Confident | 85.4 | Confident | 80 Ų | 80 | 43.9 Ų | 43.9 | 37% | 0.374 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -66.5 | -36.1 | 179.1 | -70.3 | -172.9 | 15.3 | 0 | 0 | 112.4 | I370 S391 I392 A398 E399 | I370-Q395 HydrophobicContact CG2-CB 4.15Å; S391-Q395 WeakPolarHBondContact O-CG 3.45Å; S391-Q395 PolarHBondContact O-N 3.5Å; I392-Q395 PolarHBondContact O-N 3.5Å; Q395-A398 PolarHBondContact O-N 2.83Å; Q395-E399 PolarHBondContact O-N 2.96Å |
| 396 | T | 86.2 | Confident | 85.4 | Confident | 2 Ų | 2 | 48.4 Ų | 48.4 | 1% | 0.012 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -63.1 | -46 | 174 | -59.7 | 0 | 0 | 0 | 0 | 110.6 | T349 L367 I392 G393 V394 A398 E399 V400 L420 F424 | T349-T396 HydrophobicContact CG2-CG2 4.15Å; L367-T396 HydrophobicContact CD1-CG2 4.05Å; L367-T396 HydrophobicContact CD2-CG2 3.91Å; I392-T396 VanDerWaalsContact O-CB 3.26Å; I392-T396 WeakPolarHBondContact O-CB 3.33Å; I392-T396 PolarHBondContact O-N 2.95Å; I392-T396 PolarHBondContact O-OG1 2.69Å; G393-T396 PolarHBondContact O-N 3.44Å; V394-T396 VanDerWaalsContact C-N 3.33Å; V394-T396 PolarHBondContact O-N 2.85Å; T396-A398 VanDerWaalsContact C-N 3.31Å; T396-A398 PolarHBondContact O-N 3.2Å; T396-E399 PolarHBondContact O-N 3.42Å; T396-V400 HydrophobicContact CG2-CG2 4.25Å; T396-V400 WeakPolarHBondContact O-CB 3.27Å; T396-V400 WeakPolarHBondContact O-CG2 3.34Å; T396-V400 PolarHBondContact O-N 2.97Å; T396-L420 HydrophobicContact CG2-CD2 3.89Å; T396-F424 HydrophobicContact CG2-CE2 4.41Å; T396-F424 HydrophobicContact CG2-CZ 4.3Å |
| 397 | C | 85.4 | Confident | 85 | Confident | 3 Ų | 3 | 49.8 Ų | 49.8 | 2% | 0.02 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -58.6 | -42.9 | 174.4 | -68.5 | 0 | 0 | 0 | 0 | 111.9 | G393 V394 N401 Q417 L420 | G393-C397 PolarHBondContact O-N 3.41Å; G393-C397 PolarHBondContact O-SG 3.38Å; V394-C397 WeakPolarHBondContact O-CB 3.32Å; V394-C397 PolarHBondContact O-N 3.13Å; C397-N401 VanDerWaalsContact O-CB 3.27Å; C397-N401 WeakPolarHBondContact O-CB 3.4Å; C397-N401 PolarHBondContact O-N 3.16Å; C397-N401 PolarHBondContact O-ND2 2.76Å; C397-Q417 HydrophobicContact CB-CG 4.08Å; C397-L420 VanDerWaalsContact SG-CD2 3.6Å |
| 398 | A | 86.6 | Confident | 84.4 | Confident | 59 Ų | 59 | 47.3 Ų | 47.3 | 49% | 0.488 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -64.2 | -48 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | V394 Q395 T396 N401 K402 | V394-A398 PolarHBondContact O-N 2.98Å; Q395-A398 PolarHBondContact O-N 2.83Å; T396-A398 VanDerWaalsContact C-N 3.31Å; T396-A398 PolarHBondContact O-N 3.2Å; A398-N401 PolarHBondContact O-N 3.48Å; A398-K402 WeakPolarHBondContact O-CB 3.48Å; A398-K402 PolarHBondContact O-N 2.79Å |
| 399 | E | 84.7 | Confident | 84 | Confident | 29 Ų | 29 | 49.8 Ų | 49.8 | 14% | 0.136 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -70.6 | -35.5 | -178.5 | -169.4 | 64.8 | -170.6 | 0 | 0 | 111.7 | L363 R366 L367 Q395 T396 K402 T403 | L363-E399 HydrophobicContact CD1-CG 3.76Å; R366-E399 WeakPolarHBondContact CD-OE1 3.22Å; R366-E399 IonicContact NH1-OE1 2.84Å; R366-E399 PolarHBondContact NH1-OE1 3.37Å; R366-E399 VanDerWaalsContact NH1-OE1 3.13Å; L367-E399 HydrophobicContact CD2-CB 4.11Å; L367-E399 HydrophobicContact CD2-CG 4.41Å; Q395-E399 PolarHBondContact O-N 2.96Å; T396-E399 PolarHBondContact O-N 3.42Å; E399-K402 PolarHBondContact O-N 2.97Å; E399-T403 WeakPolarHBondContact O-CB 3.18Å; E399-T403 PolarHBondContact O-N 3.2Å; E399-T403 PolarHBondContact O-OG1 3.49Å |
| 400 | V | 84.4 | Confident | 83.4 | Confident | 1 Ų | 1 | 55 Ų | 55 | 1% | 0.006 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.7 | -47.3 | 173 | 175.5 | 0 | 0 | 0 | 0 | 110.7 | V353 L363 L367 T396 K402 T403 L404 F412 | V353-V400 HydrophobicContact CG1-CG1 4.02Å; L363-V400 HydrophobicContact CD2-CG2 4.36Å; L367-V400 HydrophobicContact CD1-CG2 4.4Å; T396-V400 HydrophobicContact CG2-CG2 4.25Å; T396-V400 WeakPolarHBondContact O-CB 3.27Å; T396-V400 WeakPolarHBondContact O-CG2 3.34Å; T396-V400 PolarHBondContact O-N 2.97Å; V400-K402 VanDerWaalsContact C-N 3.31Å; V400-K402 PolarHBondContact O-N 3.23Å; V400-T403 PolarHBondContact O-N 3.44Å; V400-T403 VanDerWaalsContact O-N 3.14Å; V400-L404 HydrophobicContact CG1-CD1 3.89Å; V400-L404 HydrophobicContact CG1-CG 4.26Å; V400-L404 VanDerWaalsContact O-CG 3.28Å; V400-L404 WeakPolarHBondContact O-CG 3.36Å; V400-L404 PolarHBondContact O-N 3.22Å; V400-F412 HydrophobicContact CB-CE2 4.11Å; V400-F412 HydrophobicContact CB-CZ 4.29Å; V400-F412 HydrophobicContact CG1-CD2 4.42Å; V400-F412 HydrophobicContact CG1-CE1 3.94Å; V400-F412 HydrophobicContact CG1-CE2 3.6Å; V400-F412 HydrophobicContact CG1-CZ 3.31Å |
| 401 | N | 85.2 | Confident | 83 | Confident | 21 Ų | 21 | 56 Ų | 56 | 11% | 0.112 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.7 | -41.2 | 176.5 | -78.2 | -27.5 | 0 | 0 | 0 | 112.3 | C397 A398 T403 L404 M405 T411 F412 Q417 | C397-N401 VanDerWaalsContact O-CB 3.27Å; C397-N401 WeakPolarHBondContact O-CB 3.4Å; C397-N401 PolarHBondContact O-N 3.16Å; C397-N401 PolarHBondContact O-ND2 2.76Å; A398-N401 PolarHBondContact O-N 3.48Å; N401-T403 VanDerWaalsContact C-N 3.34Å; N401-T403 PolarHBondContact O-N 2.66Å; N401-L404 PolarHBondContact O-N 2.61Å; N401-M405 WeakPolarHBondContact O-CG 3.48Å; N401-M405 PolarHBondContact O-N 3.28Å; N401-T411 HydrophobicContact CB-CG2 4.28Å; N401-F412 WeakPolarHBondContact OD1-CB 3.19Å; N401-F412 PolarHBondContact OD1-N 3.06Å; N401-Q417 PolarHBondContact ND2-NE2 2.73Å |
| 402 | K | 85.4 | Confident | 82.6 | Confident | 90 Ų | 90 | 54.2 Ų | 54.2 | 39% | 0.391 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -57.8 | -47.9 | 173.9 | -178 | -177.3 | 173.7 | -172.2 | 0 | 111.4 | A398 E399 V400 L404 M405 E406 | A398-K402 WeakPolarHBondContact O-CB 3.48Å; A398-K402 PolarHBondContact O-N 2.79Å; E399-K402 PolarHBondContact O-N 2.97Å; V400-K402 VanDerWaalsContact C-N 3.31Å; V400-K402 PolarHBondContact O-N 3.23Å; K402-L404 VanDerWaalsContact C-N 3.32Å; K402-L404 PolarHBondContact O-N 3.44Å; K402-M405 PolarHBondContact O-N 3.4Å; K402-E406 WeakPolarHBondContact CE-OE1 3.4Å; K402-E406 WeakPolarHBondContact O-CG 3.44Å; K402-E406 PolarHBondContact O-N 3.24Å |
| 403 | T | 81.7 | Confident | 82.2 | Confident | 15 Ų | 15 | 56.8 Ų | 56.8 | 9% | 0.092 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -64.6 | -35.4 | 178.7 | -52.3 | 0 | 0 | 0 | 0 | 112.4 | L360 L363 E399 V400 N401 R407 | L360-T403 HydrophobicContact CD1-CG2 3.58Å; L363-T403 HydrophobicContact CD2-CG2 4.28Å; E399-T403 WeakPolarHBondContact O-CB 3.18Å; E399-T403 PolarHBondContact O-N 3.2Å; E399-T403 PolarHBondContact O-OG1 3.49Å; V400-T403 PolarHBondContact O-N 3.44Å; V400-T403 VanDerWaalsContact O-N 3.14Å; N401-T403 VanDerWaalsContact C-N 3.34Å; N401-T403 PolarHBondContact O-N 2.66Å; T403-R407 PolarHBondContact O-N 3.39Å |
| 404 | L | 81.1 | Confident | 82 | Confident | 7 Ų | 7 | 60.6 Ų | 60.6 | 4% | 0.037 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -68.9 | -42.2 | 175.6 | -68.1 | 171.1 | 0 | 0 | 0 | 111.8 | I356 V400 N401 K402 R407 G408 L409 F412 | I356-L404 HydrophobicContact CG2-CD2 3.47Å; I356-L404 VanDerWaalsContact CG2-CD2 3.47Å; V400-L404 HydrophobicContact CG1-CD1 3.89Å; V400-L404 HydrophobicContact CG1-CG 4.26Å; V400-L404 VanDerWaalsContact O-CG 3.28Å; V400-L404 WeakPolarHBondContact O-CG 3.36Å; V400-L404 PolarHBondContact O-N 3.22Å; N401-L404 PolarHBondContact O-N 2.61Å; K402-L404 VanDerWaalsContact C-N 3.32Å; K402-L404 PolarHBondContact O-N 3.44Å; L404-R407 CarbonylContact O-C 3.52Å; L404-R407 PolarHBondContact O-N 2.68Å; L404-R407 VanDerWaalsContact O-N 3.13Å; L404-G408 PolarHBondContact O-N 2.95Å; L404-G408 VanDerWaalsContact O-N 3.12Å; L404-L409 HydrophobicContact CB-CB 4.25Å; L404-L409 HydrophobicContact CD2-CB 3.94Å; L404-L409 HydrophobicContact CD2-CD1 3.87Å; L404-L409 PolarHBondContact O-N 3.1Å; L404-F412 HydrophobicContact CD1-CD1 3.84Å; L404-F412 HydrophobicContact CD1-CE1 3.76Å |
| 405 | M | 82.8 | Confident | 81.8 | Confident | 120 Ų | 120 | 64.2 Ų | 64.2 | 59% | 0.591 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -62.4 | -42.7 | 175.6 | -73.6 | -173.4 | -68.9 | 0 | 0 | 112 | N401 K402 R407 G408 T411 | N401-M405 WeakPolarHBondContact O-CG 3.48Å; N401-M405 PolarHBondContact O-N 3.28Å; K402-M405 PolarHBondContact O-N 3.4Å; M405-R407 PolarHBondContact O-N 3.43Å; M405-R407 VanDerWaalsContact O-N 3.16Å; M405-G408 PolarHBondContact O-N 3.37Å; M405-T411 HydrophobicContact CG-CG2 3.61Å; M405-T411 HydrophobicContact SD-CG2 4.15Å |
| 406 | E | 82.8 | Confident | 81.5 | Confident | 132 Ų | 132 | 63.9 Ų | 63.9 | 62% | 0.617 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -59.4 | -24.6 | 175.4 | -73.5 | 172.6 | -171.6 | 0 | 0 | 112.7 | K402 | K402-E406 WeakPolarHBondContact CE-OE1 3.4Å; K402-E406 WeakPolarHBondContact O-CG 3.44Å; K402-E406 PolarHBondContact O-N 3.24Å |
| 407 | R | 76 | Confident | 81.4 | Confident | 142 Ų | 142 | 66.5 Ų | 66.5 | 54% | 0.536 | 37% | 0.374 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.6 | 1.6 | 177.3 | -70 | -169.3 | 168.7 | -162.8 | -5.3 | 114.6 | T403 L404 M405 L409 | T403-R407 PolarHBondContact O-N 3.39Å; L404-R407 CarbonylContact O-C 3.52Å; L404-R407 PolarHBondContact O-N 2.68Å; L404-R407 VanDerWaalsContact O-N 3.13Å; M405-R407 PolarHBondContact O-N 3.43Å; M405-R407 VanDerWaalsContact O-N 3.16Å; R407-L409 VanDerWaalsContact C-N 3.26Å; R407-L409 HydrophobicContact CB-CD1 4.29Å; R407-L409 HydrophobicContact CB-CG 4.38Å; R407-L409 PolarHBondContact O-N 2.94Å |
| 408 | G | 73.3 | Confident | 81.4 | Confident | 73 Ų | 73 | 69.4 Ų | 69.4 | 75% | 0.753 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.2 | 22 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | L404 M405 | L404-G408 PolarHBondContact O-N 2.95Å; L404-G408 VanDerWaalsContact O-N 3.12Å; M405-G408 PolarHBondContact O-N 3.37Å |
| 409 | L | 76.3 | Confident | 81.5 | Confident | 77 Ų | 77 | 70.6 Ų | 70.6 | 40% | 0.403 | 40% | 0.396 | S | S | . | . | P | Polyproline II helix | trans | -91.1 | 154.3 | 175.9 | -70.9 | 171.2 | 0 | 0 | 0 | 111 | I356 L404 R407 T411 | I356-L409 HydrophobicContact CG2-CD1 3.99Å; L404-L409 HydrophobicContact CB-CB 4.25Å; L404-L409 HydrophobicContact CD2-CB 3.94Å; L404-L409 HydrophobicContact CD2-CD1 3.87Å; L404-L409 PolarHBondContact O-N 3.1Å; R407-L409 VanDerWaalsContact C-N 3.26Å; R407-L409 HydrophobicContact CB-CD1 4.29Å; R407-L409 HydrophobicContact CB-CG 4.38Å; R407-L409 PolarHBondContact O-N 2.94Å; L409-T411 PolarHBondContact O-N 2.81Å |
| 410 | P | 75.3 | Confident | 81.5 | Confident | 110 Ų | 110 | 69.2 Ų | 69.2 | 71% | 0.714 | 39% | 0.39 | S | S | * | . | P | Polyproline II helix | trans | -64 | 134.9 | 176.8 | 26.5 | -33.4 | 0 | 0 | 0 | 110.8 | ||
| 411 | T | 78.9 | Confident | 81.6 | Confident | 73 Ų | 73 | 71 Ų | 71 | 45% | 0.448 | 40% | 0.399 | S | S | . | . | P | Polyproline II helix | trans | -65.9 | 159.6 | 173.2 | 54 | 0 | 0 | 0 | 0 | 111.2 | N401 M405 L409 S413 | N401-T411 HydrophobicContact CB-CG2 4.28Å; M405-T411 HydrophobicContact CG-CG2 3.61Å; M405-T411 HydrophobicContact SD-CG2 4.15Å; L409-T411 PolarHBondContact O-N 2.81Å; T411-S413 PolarHBondContact O-N 3.19Å |
| 412 | F | 78.7 | Confident | 81.6 | Confident | 18 Ų | 18 | 71.9 Ų | 71.9 | 8% | 0.079 | 41% | 0.414 | C | S | . | . | P | Polyproline II helix | trans | -58.8 | 136.7 | 175.4 | -71.9 | -9.4 | 0 | 0 | 0 | 112.6 | V353 V400 N401 L404 I416 Q417 | V353-F412 HydrophobicContact CB-CZ 4.21Å; V353-F412 HydrophobicContact CG1-CE1 4.16Å; V353-F412 HydrophobicContact CG1-CZ 3.68Å; V353-F412 HydrophobicContact CG2-CE1 4.4Å; V353-F412 HydrophobicContact CG2-CE2 4.06Å; V353-F412 HydrophobicContact CG2-CZ 3.42Å; V353-F412 VanDerWaalsContact CG2-CZ 3.42Å; V400-F412 HydrophobicContact CB-CE2 4.11Å; V400-F412 HydrophobicContact CB-CZ 4.29Å; V400-F412 HydrophobicContact CG1-CD2 4.42Å; V400-F412 HydrophobicContact CG1-CE1 3.94Å; V400-F412 HydrophobicContact CG1-CE2 3.6Å; V400-F412 HydrophobicContact CG1-CZ 3.31Å; N401-F412 WeakPolarHBondContact OD1-CB 3.19Å; N401-F412 PolarHBondContact OD1-N 3.06Å; L404-F412 HydrophobicContact CD1-CD1 3.84Å; L404-F412 HydrophobicContact CD1-CE1 3.76Å; F412-I416 HydrophobicContact CB-CB 4.38Å; F412-I416 HydrophobicContact CB-CG2 4.27Å; F412-I416 HydrophobicContact CD1-CG2 4.17Å; F412-I416 HydrophobicContact CD2-CG2 3.99Å; F412-I416 HydrophobicContact CE1-CG2 4.47Å; F412-I416 HydrophobicContact CE2-CG2 4.31Å; F412-I416 HydrophobicContact CG-CG2 3.9Å; F412-Q417 HydrophobicContact CB-CG 3.72Å; F412-Q417 HydrophobicContact CD2-CG 4.3Å; F412-Q417 PolarHBondContact O-NE2 2.88Å; F412-Q417 VanDerWaalsContact O-NE2 3.15Å |
| 413 | S | 80.4 | Confident | 81.6 | Confident | 54 Ų | 54 | 70.3 Ų | 70.3 | 38% | 0.378 | 41% | 0.407 | S | S | . | . | P | Polyproline II helix | trans | -65.4 | 156.3 | 167.2 | 68 | 0 | 0 | 0 | 0 | 110.6 | T411 E415 I416 Q417 | T411-S413 PolarHBondContact O-N 3.19Å; S413-E415 PolarHBondContact O-N 3.46Å; S413-I416 PolarHBondContact O-N 3.05Å; S413-I416 VanDerWaalsContact O-N 3.13Å; S413-I416 WeakPolarHBondContact OG-CG1 3.49Å; S413-I416 PolarHBondContact OG-N 3.32Å; S413-Q417 WeakPolarHBondContact O-CG 3.47Å; S413-Q417 PolarHBondContact O-N 3.37Å; S413-Q417 VanDerWaalsContact O-N 3.13Å |
| 414 | A | 82.1 | Confident | 81.8 | Confident | 80 Ų | 80 | 69.6 Ų | 69.6 | 66% | 0.661 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -57 | -31.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A418 | A414-A418 WeakPolarHBondContact O-CB 3.21Å; A414-A418 PolarHBondContact O-N 3Å |
| 415 | E | 83.7 | Confident | 82 | Confident | 163 Ų | 163 | 70.3 Ų | 70.3 | 76% | 0.762 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -67.8 | -42.7 | 176.5 | -65.5 | 176.2 | 178.6 | 0 | 0 | 112.6 | S413 Q417 A418 N419 | S413-E415 PolarHBondContact O-N 3.46Å; E415-Q417 VanDerWaalsContact C-N 3.34Å; E415-A418 PolarHBondContact O-N 3.22Å; E415-N419 VanDerWaalsContact O-CB 3.3Å; E415-N419 WeakPolarHBondContact O-CB 3.34Å; E415-N419 PolarHBondContact O-N 3.41Å |
| 416 | I | 81.6 | Confident | 82 | Confident | 72 Ų | 72 | 66 Ų | 66 | 37% | 0.369 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -66.7 | -39.3 | 178 | -67.1 | 168.1 | 0 | 0 | 0 | 110.2 | M352 F412 S413 N419 L420 | M352-I416 HydrophobicContact CE-CG2 4.11Å; F412-I416 HydrophobicContact CB-CB 4.38Å; F412-I416 HydrophobicContact CB-CG2 4.27Å; F412-I416 HydrophobicContact CD1-CG2 4.17Å; F412-I416 HydrophobicContact CD2-CG2 3.99Å; F412-I416 HydrophobicContact CE1-CG2 4.47Å; F412-I416 HydrophobicContact CE2-CG2 4.31Å; F412-I416 HydrophobicContact CG-CG2 3.9Å; S413-I416 PolarHBondContact O-N 3.05Å; S413-I416 VanDerWaalsContact O-N 3.13Å; S413-I416 WeakPolarHBondContact OG-CG1 3.49Å; S413-I416 PolarHBondContact OG-N 3.32Å; I416-N419 PolarHBondContact O-N 3.08Å; I416-L420 PolarHBondContact O-N 3.26Å |
| 417 | Q | 83.9 | Confident | 82.1 | Confident | 58 Ų | 58 | 60.1 Ų | 60.1 | 27% | 0.271 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -65.2 | -46.4 | 176 | -63.9 | 179.7 | 18.2 | 0 | 0 | 111.5 | C397 N401 F412 S413 E415 N419 L420 I421 | C397-Q417 HydrophobicContact CB-CG 4.08Å; N401-Q417 PolarHBondContact ND2-NE2 2.73Å; F412-Q417 HydrophobicContact CB-CG 3.72Å; F412-Q417 HydrophobicContact CD2-CG 4.3Å; F412-Q417 PolarHBondContact O-NE2 2.88Å; F412-Q417 VanDerWaalsContact O-NE2 3.15Å; S413-Q417 WeakPolarHBondContact O-CG 3.47Å; S413-Q417 PolarHBondContact O-N 3.37Å; S413-Q417 VanDerWaalsContact O-N 3.13Å; E415-Q417 VanDerWaalsContact C-N 3.34Å; Q417-N419 VanDerWaalsContact C-N 3.3Å; Q417-N419 PolarHBondContact O-N 3.34Å; Q417-L420 PolarHBondContact O-N 3.46Å; Q417-I421 WeakPolarHBondContact O-CD1 3.36Å; Q417-I421 VanDerWaalsContact O-CG1 3.27Å; Q417-I421 WeakPolarHBondContact O-CG1 3.49Å; Q417-I421 PolarHBondContact O-N 2.81Å |
| 418 | A | 85.7 | Confident | 82.1 | Confident | 63 Ų | 63 | 57.9 Ų | 57.9 | 52% | 0.521 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -62 | -38.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | A414 E415 G422 | A414-A418 WeakPolarHBondContact O-CB 3.21Å; A414-A418 PolarHBondContact O-N 3Å; E415-A418 PolarHBondContact O-N 3.22Å; A418-G422 PolarHBondContact O-N 3.35Å |
| 419 | N | 86.8 | Confident | 82.4 | Confident | 84 Ų | 84 | 60.4 Ų | 60.4 | 45% | 0.449 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -65.4 | -45.5 | 176 | -169.7 | -19.6 | 0 | 0 | 0 | 111.6 | M352 E415 I416 Q417 I421 G422 Q423 | M352-N419 HydrophobicContact CE-CB 4.04Å; E415-N419 VanDerWaalsContact O-CB 3.3Å; E415-N419 WeakPolarHBondContact O-CB 3.34Å; E415-N419 PolarHBondContact O-N 3.41Å; I416-N419 PolarHBondContact O-N 3.08Å; Q417-N419 VanDerWaalsContact C-N 3.3Å; Q417-N419 PolarHBondContact O-N 3.34Å; N419-I421 PolarHBondContact O-N 3.18Å; N419-G422 PolarHBondContact O-N 3.2Å; N419-Q423 WeakPolarHBondContact O-CG 3.4Å; N419-Q423 PolarHBondContact O-N 2.83Å; N419-Q423 PolarHBondContact OD1-NE2 3.33Å |
| 420 | L | 85 | Confident | 81.8 | Confident | 1 Ų | 1 | 66 Ų | 66 | 1% | 0.005 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -60.2 | -47.2 | 177.5 | -173 | 75.3 | 0 | 0 | 0 | 111.6 | I348 M352 T396 C397 I416 Q417 G422 Q423 F424 | I348-L420 HydrophobicContact CG2-CD1 3.89Å; M352-L420 HydrophobicContact CE-CB 4.15Å; M352-L420 HydrophobicContact CE-CD1 4.49Å; M352-L420 HydrophobicContact CG-CD1 4.45Å; M352-L420 HydrophobicContact SD-CB 3.96Å; M352-L420 HydrophobicContact SD-CD1 3.4Å; M352-L420 WeakPolarHBondContact SD-CD1 3.38Å; M352-L420 HydrophobicContact SD-CG 4.3Å; T396-L420 HydrophobicContact CG2-CD2 3.89Å; C397-L420 VanDerWaalsContact SG-CD2 3.6Å; I416-L420 PolarHBondContact O-N 3.26Å; Q417-L420 PolarHBondContact O-N 3.46Å; L420-G422 VanDerWaalsContact C-N 3.31Å; L420-G422 PolarHBondContact O-N 3.35Å; L420-Q423 PolarHBondContact O-N 3.11Å; L420-F424 HydrophobicContact CD1-CD1 4.42Å; L420-F424 HydrophobicContact CD1-CE1 3.75Å; L420-F424 HydrophobicContact CD1-CZ 4.01Å; L420-F424 HydrophobicContact CD2-CZ 4.33Å; L420-F424 HydrophobicContact CG-CD1 4.5Å; L420-F424 HydrophobicContact CG-CE1 4.09Å; L420-F424 HydrophobicContact CG-CE2 4.49Å; L420-F424 HydrophobicContact CG-CZ 4.09Å; L420-F424 WeakPolarHBondContact O-CD1 3.45Å; L420-F424 WeakPolarHBondContact O-CG 3.5Å; L420-F424 PolarHBondContact O-N 3.13Å |
| 421 | I | 86.9 | Confident | 81.6 | Confident | 38 Ų | 38 | 68.2 Ų | 68.2 | 20% | 0.195 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -63 | -39.8 | 178.7 | -66.3 | 166.4 | 0 | 0 | 0 | 110.9 | N390 V394 Q417 N419 F424 S425 | N390-I421 WeakPolarHBondContact OD1-CG2 3.43Å; V394-I421 HydrophobicContact CG2-CD1 3.83Å; Q417-I421 WeakPolarHBondContact O-CD1 3.36Å; Q417-I421 VanDerWaalsContact O-CG1 3.27Å; Q417-I421 WeakPolarHBondContact O-CG1 3.49Å; Q417-I421 PolarHBondContact O-N 2.81Å; N419-I421 PolarHBondContact O-N 3.18Å; I421-F424 PolarHBondContact O-N 3.1Å; I421-S425 PolarHBondContact O-N 2.94Å; I421-S425 PolarHBondContact O-OG 2.98Å; I421-S425 VanDerWaalsContact O-OG 3.06Å |
| 422 | G | 85.6 | Confident | 81.7 | Confident | 40 Ų | 40 | 65.1 Ų | 65.1 | 41% | 0.412 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -62.3 | -45.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | A418 N419 L420 F424 S425 S426 | A418-G422 PolarHBondContact O-N 3.35Å; N419-G422 PolarHBondContact O-N 3.2Å; L420-G422 VanDerWaalsContact C-N 3.31Å; L420-G422 PolarHBondContact O-N 3.35Å; G422-F424 VanDerWaalsContact C-N 3.33Å; G422-F424 PolarHBondContact O-N 3.09Å; G422-S425 PolarHBondContact O-N 3.01Å; G422-S426 PolarHBondContact O-N 3.28Å |
| 423 | Q | 84.9 | Confident | 82 | Confident | 56 Ų | 56 | 68.7 Ų | 68.7 | 26% | 0.262 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -67.3 | -31 | 177.3 | -71.2 | -172 | 21.8 | 0 | 0 | 113.2 | I348 N419 L420 S426 | I348-Q423 HydrophobicContact CD1-CB 4.46Å; I348-Q423 HydrophobicContact CG2-CB 3.92Å; N419-Q423 WeakPolarHBondContact O-CG 3.4Å; N419-Q423 PolarHBondContact O-N 2.83Å; N419-Q423 PolarHBondContact OD1-NE2 3.33Å; L420-Q423 PolarHBondContact O-N 3.11Å; Q423-S426 PolarHBondContact O-OG 2.87Å |
| 424 | F | 86.7 | Confident | 82.2 | Confident | 0 Ų | 0 | 68.1 Ų | 68.1 | 0% | 0 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -69.8 | -42.4 | 173.2 | -76.7 | 11 | 0 | 0 | 0 | 111 | L345 I348 T349 L389 I392 T396 L420 I421 G422 S426 I427 | L345-F424 HydrophobicContact CB-CE1 4.42Å; L345-F424 HydrophobicContact CB-CZ 4.27Å; L345-F424 HydrophobicContact CD2-CB 3.98Å; L345-F424 HydrophobicContact CD2-CD1 3.57Å; L345-F424 HydrophobicContact CD2-CD2 3.39Å; L345-F424 HydrophobicContact CD2-CE1 3.78Å; L345-F424 HydrophobicContact CD2-CE2 3.63Å; L345-F424 HydrophobicContact CD2-CG 3.36Å; L345-F424 HydrophobicContact CD2-CZ 3.82Å; I348-F424 HydrophobicContact CB-CD1 4.23Å; I348-F424 HydrophobicContact CB-CE1 3.81Å; I348-F424 HydrophobicContact CD1-CD1 3.96Å; I348-F424 HydrophobicContact CD1-CE1 4.33Å; I348-F424 HydrophobicContact CG2-CD1 3.82Å; I348-F424 HydrophobicContact CG2-CE1 3.54Å; T349-F424 WeakPolarHBondContact OG1-CZ 3.35Å; L389-F424 WeakPolarHBondContact CD1-O 3.2Å; I392-F424 HydrophobicContact CG2-CD2 4.25Å; I392-F424 HydrophobicContact CG2-CE2 4Å; T396-F424 HydrophobicContact CG2-CE2 4.41Å; T396-F424 HydrophobicContact CG2-CZ 4.3Å; L420-F424 HydrophobicContact CD1-CD1 4.42Å; L420-F424 HydrophobicContact CD1-CE1 3.75Å; L420-F424 HydrophobicContact CD1-CZ 4.01Å; L420-F424 HydrophobicContact CD2-CZ 4.33Å; L420-F424 HydrophobicContact CG-CD1 4.5Å; L420-F424 HydrophobicContact CG-CE1 4.09Å; L420-F424 HydrophobicContact CG-CE2 4.49Å; L420-F424 HydrophobicContact CG-CZ 4.09Å; L420-F424 WeakPolarHBondContact O-CD1 3.45Å; L420-F424 WeakPolarHBondContact O-CG 3.5Å; L420-F424 PolarHBondContact O-N 3.13Å; I421-F424 PolarHBondContact O-N 3.1Å; G422-F424 VanDerWaalsContact C-N 3.33Å; G422-F424 PolarHBondContact O-N 3.09Å; F424-S426 VanDerWaalsContact C-N 3.26Å; F424-S426 PolarHBondContact O-N 2.74Å; F424-I427 WeakPolarHBondContact O-CB 3.07Å; F424-I427 VanDerWaalsContact O-CG1 3.31Å; F424-I427 WeakPolarHBondContact O-CG1 3.16Å; F424-I427 PolarHBondContact O-N 2.84Å |
| 425 | S | 84.4 | Confident | 82.3 | Confident | 22 Ų | 22 | 67.6 Ų | 67.6 | 15% | 0.154 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -65.2 | -29 | 177.9 | -63.3 | 0 | 0 | 0 | 0 | 113.1 | N390 I421 G422 I427 | N390-S425 PolarHBondContact ND2-OG 3.23Å; N390-S425 PolarHBondContact OD1-OG 3.49Å; I421-S425 PolarHBondContact O-N 2.94Å; I421-S425 PolarHBondContact O-OG 2.98Å; I421-S425 VanDerWaalsContact O-OG 3.06Å; G422-S425 PolarHBondContact O-N 3.01Å; S425-I427 PolarHBondContact O-N 2.69Å |
| 426 | S | 83.9 | Confident | 82.4 | Confident | 29 Ų | 29 | 62 Ų | 62 | 20% | 0.203 | 34% | 0.339 | C | S | . | . | G | 310 helix | trans | -75.8 | -4.1 | 178.3 | 69 | 0 | 0 | 0 | 0 | 114.1 | G422 Q423 F424 E428 E429 N432 | G422-S426 PolarHBondContact O-N 3.28Å; Q423-S426 PolarHBondContact O-OG 2.87Å; F424-S426 VanDerWaalsContact C-N 3.26Å; F424-S426 PolarHBondContact O-N 2.74Å; S426-E428 PolarHBondContact O-N 2.97Å; S426-E429 WeakPolarHBondContact O-CB 3.23Å; S426-E429 PolarHBondContact O-N 3.26Å; S426-N432 VanDerWaalsContact C-ND2 3.34Å; S426-N432 PolarHBondContact O-ND2 3.49Å |
| 427 | I | 83.3 | Confident | 82.7 | Confident | 9 Ų | 9 | 61.8 Ų | 61.8 | 5% | 0.046 | 34% | 0.338 | C | S | . | . | G | 310 helix | trans | -64.1 | -28.6 | 175.5 | -63.8 | 171.5 | 0 | 0 | 0 | 111.5 | C344 L345 I348 L389 F424 S425 E429 W435 | C344-I427 HydrophobicContact CB-CD1 3.92Å; C344-I427 HydrophobicContact CB-CG1 4.41Å; C344-I427 HydrophobicContact CB-CG2 4.46Å; L345-I427 HydrophobicContact CD2-CD1 3.6Å; L345-I427 HydrophobicContact CG-CD1 4.04Å; I348-I427 HydrophobicContact CD1-CD1 3.81Å; I348-I427 HydrophobicContact CD1-CG1 4Å; L389-I427 HydrophobicContact CD1-CB 4.36Å; L389-I427 HydrophobicContact CD2-CD1 4.37Å; F424-I427 WeakPolarHBondContact O-CB 3.07Å; F424-I427 VanDerWaalsContact O-CG1 3.31Å; F424-I427 WeakPolarHBondContact O-CG1 3.16Å; F424-I427 PolarHBondContact O-N 2.84Å; S425-I427 PolarHBondContact O-N 2.69Å; I427-E429 PolarHBondContact O-N 3.43Å; I427-W435 HydrophobicContact CG2-CE3 4.13Å |
| 428 | E | 77.6 | Confident | 82.8 | Confident | 95 Ų | 95 | 59 Ų | 59 | 44% | 0.444 | 33% | 0.325 | S | S | . | . | G | 310 helix | trans | -71.4 | -17.8 | 178.3 | -172.3 | 175.3 | -158.7 | 0 | 0 | 113 | L385 K386 S426 | L385-E428 HydrophobicContact CD2-CB 4.43Å; L385-E428 HydrophobicContact CD2-CG 4.29Å; K386-E428 WeakPolarHBondContact CB-OE2 3.43Å; S426-E428 PolarHBondContact O-N 2.97Å |
| 429 | E | 79.3 | Confident | 82.9 | Confident | 127 Ų | 127 | 57 Ų | 57 | 59% | 0.593 | 31% | 0.305 | S | S | * | . | S | Bend | trans | -71.3 | 130.6 | -179.1 | -61.5 | 176.1 | -178.8 | 0 | 0 | 111.1 | S426 I427 D431 N432 | S426-E429 WeakPolarHBondContact O-CB 3.23Å; S426-E429 PolarHBondContact O-N 3.26Å; I427-E429 PolarHBondContact O-N 3.43Å; E429-D431 PolarHBondContact O-N 2.86Å; E429-N432 WeakPolarHBondContact O-CB 3.37Å; E429-N432 PolarHBondContact O-N 3.2Å; E429-N432 VanDerWaalsContact O-N 3.09Å |
| 430 | E | 63.3 | Low | 82.9 | Confident | 195 Ų | 195 | 59.4 Ų | 59.4 | 91% | 0.911 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57 | -27.4 | -174.7 | -68.1 | -174.8 | 164.3 | 0 | 0 | 113.7 | ||
| 431 | D | 70.1 | Confident | 83 | Confident | 156 Ų | 156 | 62.8 Ų | 62.8 | 83% | 0.834 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.4 | 18.3 | -178 | -76.2 | -38 | 0 | 0 | 0 | 114.2 | E429 P433 | E429-D431 PolarHBondContact O-N 2.86Å; D431-P433 WeakPolarHBondContact O-CD 3.23Å |
| 432 | N | 82.8 | Confident | 83 | Confident | 8 Ų | 8 | 61.1 Ų | 61.1 | 4% | 0.043 | 32% | 0.316 | C | S | . | . | trans | -65.7 | 120.6 | -177.3 | -170.8 | -61 | 0 | 0 | 0 | 111.9 | S426 E429 I434 W435 S436 | S426-N432 VanDerWaalsContact C-ND2 3.34Å; S426-N432 PolarHBondContact O-ND2 3.49Å; E429-N432 WeakPolarHBondContact O-CB 3.37Å; E429-N432 PolarHBondContact O-N 3.2Å; E429-N432 VanDerWaalsContact O-N 3.09Å; N432-I434 VanDerWaalsContact C-N 3.29Å; N432-I434 PolarHBondContact O-N 3.48Å; N432-I434 WeakPolarHBondContact OD1-CA 3.37Å; N432-I434 VanDerWaalsContact OD1-CB 3.25Å; N432-I434 WeakPolarHBondContact OD1-CB 3.18Å; N432-I434 PolarHBondContact OD1-N 2.99Å; N432-W435 HydrophobicContact CB-CB 3.94Å; N432-W435 PolarHBondContact O-N 3.41Å; N432-W435 PolarHBondContact OD1-N 2.91Å; N432-W435 VanDerWaalsContact OD1-N 3.08Å; N432-S436 PolarHBondContact O-N 2.99Å; N432-S436 PolarHBondContact O-OG 3.01Å | ||
| 433 | P | 83.5 | Confident | 83 | Confident | 93 Ų | 93 | 62.3 Ų | 62.3 | 60% | 0.604 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -68.6 | -27.5 | -177.2 | 27.3 | -34.7 | 0 | 0 | 0 | 112.7 | D431 S436 L437 | D431-P433 WeakPolarHBondContact O-CD 3.23Å; P433-S436 WeakPolarHBondContact CA-OG 3.18Å; P433-S436 PolarHBondContact O-OG 3.34Å; P433-S436 VanDerWaalsContact O-OG 3.12Å; P433-L437 WeakPolarHBondContact O-CB 3.44Å; P433-L437 PolarHBondContact O-N 3.1Å; P433-L437 VanDerWaalsContact O-N 3.09Å |
| 434 | I | 84.6 | Confident | 83 | Confident | 42 Ų | 42 | 65.2 Ų | 65.2 | 22% | 0.215 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -73.4 | -45.2 | 177.2 | -63.2 | 169.9 | 0 | 0 | 0 | 109.7 | C344 L347 I348 N432 L437 I438 | C344-I434 HydrophobicContact CB-CG2 4.04Å; L347-I434 HydrophobicContact CD2-CG2 3.89Å; I348-I434 HydrophobicContact CD1-CD1 4.13Å; I348-I434 HydrophobicContact CG1-CD1 3.57Å; N432-I434 VanDerWaalsContact C-N 3.29Å; N432-I434 PolarHBondContact O-N 3.48Å; N432-I434 WeakPolarHBondContact OD1-CA 3.37Å; N432-I434 VanDerWaalsContact OD1-CB 3.25Å; N432-I434 WeakPolarHBondContact OD1-CB 3.18Å; N432-I434 PolarHBondContact OD1-N 2.99Å; I434-L437 PolarHBondContact O-N 3.47Å; I434-I438 HydrophobicContact CG2-CG1 4.44Å; I434-I438 WeakPolarHBondContact O-CG1 3.44Å; I434-I438 PolarHBondContact O-N 2.6Å |
| 435 | W | 85.4 | Confident | 83 | Confident | 68 Ų | 68 | 65.3 Ų | 65.3 | 26% | 0.258 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -58.2 | -52.9 | 175 | 178.6 | -101.7 | 0 | 0 | 0 | 111.4 | K340 I341 I427 N432 L437 I438 D439 | K340-W435 HydrophobicContact CB-CE3 4.39Å; K340-W435 HydrophobicContact CB-CH2 3.66Å; K340-W435 HydrophobicContact CB-CZ3 3.55Å; K340-W435 HydrophobicContact CD-CH2 3.77Å; K340-W435 HydrophobicContact CD-CZ2 3.96Å; K340-W435 HydrophobicContact CD-CZ3 4.41Å; K340-W435 HydrophobicContact CG-CH2 4.37Å; I341-W435 HydrophobicContact CG1-CH2 4.41Å; I341-W435 HydrophobicContact CG1-CZ3 3.8Å; I427-W435 HydrophobicContact CG2-CE3 4.13Å; N432-W435 HydrophobicContact CB-CB 3.94Å; N432-W435 PolarHBondContact O-N 3.41Å; N432-W435 PolarHBondContact OD1-N 2.91Å; N432-W435 VanDerWaalsContact OD1-N 3.08Å; W435-L437 VanDerWaalsContact C-N 3.27Å; W435-L437 PolarHBondContact O-N 2.85Å; W435-I438 PolarHBondContact O-N 3.27Å; W435-D439 VanDerWaalsContact O-CB 3.26Å; W435-D439 WeakPolarHBondContact O-CB 3.49Å; W435-D439 PolarHBondContact O-N 2.73Å |
| 436 | S | 86.1 | Confident | 83.1 | Confident | 47 Ų | 47 | 64.4 Ų | 64.4 | 33% | 0.329 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -61.7 | -34.2 | -179.6 | 66 | 0 | 0 | 0 | 0 | 113 | N432 P433 K440 | N432-S436 PolarHBondContact O-N 2.99Å; N432-S436 PolarHBondContact O-OG 3.01Å; P433-S436 WeakPolarHBondContact CA-OG 3.18Å; P433-S436 PolarHBondContact O-OG 3.34Å; P433-S436 VanDerWaalsContact O-OG 3.12Å; S436-K440 WeakPolarHBondContact O-CB 3.36Å; S436-K440 WeakPolarHBondContact O-CG 3.48Å; S436-K440 PolarHBondContact O-N 3.08Å |
| 437 | L | 86.5 | Confident | 83.2 | Confident | 67 Ų | 67 | 66.3 Ų | 66.3 | 35% | 0.351 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -66.8 | -48.1 | 174.8 | 179.8 | 68 | 0 | 0 | 0 | 112 | L347 P433 I434 W435 K440 R441 | L347-L437 HydrophobicContact CD2-CD2 4.5Å; P433-L437 WeakPolarHBondContact O-CB 3.44Å; P433-L437 PolarHBondContact O-N 3.1Å; P433-L437 VanDerWaalsContact O-N 3.09Å; I434-L437 PolarHBondContact O-N 3.47Å; W435-L437 VanDerWaalsContact C-N 3.27Å; W435-L437 PolarHBondContact O-N 2.85Å; L437-K440 PolarHBondContact O-N 3.03Å; L437-R441 WeakPolarHBondContact O-CG 3.46Å; L437-R441 PolarHBondContact O-N 2.79Å |
| 438 | I | 86.6 | Confident | 83.2 | Confident | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -64.5 | -44.7 | 179.2 | -70.1 | -64.1 | 0 | 0 | 0 | 110.4 | A343 L347 I434 W435 K440 R441 I442 L466 | A343-I438 HydrophobicContact CB-CD1 4.24Å; A343-I438 HydrophobicContact CB-CG2 4Å; L347-I438 HydrophobicContact CD2-CD1 4.38Å; I434-I438 HydrophobicContact CG2-CG1 4.44Å; I434-I438 WeakPolarHBondContact O-CG1 3.44Å; I434-I438 PolarHBondContact O-N 2.6Å; W435-I438 PolarHBondContact O-N 3.27Å; I438-K440 PolarHBondContact O-N 3.27Å; I438-R441 PolarHBondContact O-N 2.91Å; I438-I442 HydrophobicContact CG2-CD1 3.66Å; I438-I442 HydrophobicContact CG2-CG1 4.48Å; I438-I442 WeakPolarHBondContact O-CB 3.25Å; I438-I442 WeakPolarHBondContact O-CG1 3.26Å; I438-I442 PolarHBondContact O-N 3.05Å; I438-L466 HydrophobicContact CD1-CD2 3.79Å; I438-L466 HydrophobicContact CG2-CD2 4.19Å |
| 439 | D | 87.2 | Confident | 83.5 | Confident | 20 Ų | 20 | 63.6 Ų | 63.6 | 11% | 0.107 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -60.6 | -45.5 | 177.6 | -174.2 | 57.3 | 0 | 0 | 0 | 111.7 | K340 W435 R441 I442 K443 | K340-D439 WeakPolarHBondContact CE-OD1 3.23Å; K340-D439 IonicContact NZ-OD1 3.21Å; K340-D439 PolarHBondContact NZ-OD1 3.13Å; W435-D439 VanDerWaalsContact O-CB 3.26Å; W435-D439 WeakPolarHBondContact O-CB 3.49Å; W435-D439 PolarHBondContact O-N 2.73Å; D439-R441 PolarHBondContact O-N 3.16Å; D439-I442 PolarHBondContact O-N 3.24Å; D439-K443 WeakPolarHBondContact O-CG 3.45Å; D439-K443 PolarHBondContact O-N 2.75Å; D439-K443 WeakPolarHBondContact OD1-CE 3.17Å; D439-K443 IonicContact OD1-NZ 3.71Å; D439-K443 WeakPolarHBondContact OD2-CE 3.4Å; D439-K443 IonicContact OD2-NZ 3.62Å; D439-K443 PolarHBondContact OD2-NZ 3.03Å |
| 440 | K | 86.5 | Confident | 83.6 | Confident | 135 Ų | 135 | 57.9 Ų | 57.9 | 59% | 0.587 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -60 | -45 | 173.3 | -77.1 | 172 | -177.1 | 174.5 | 0 | 112.5 | S436 L437 I438 K443 L444 | S436-K440 WeakPolarHBondContact O-CB 3.36Å; S436-K440 WeakPolarHBondContact O-CG 3.48Å; S436-K440 PolarHBondContact O-N 3.08Å; L437-K440 PolarHBondContact O-N 3.03Å; I438-K440 PolarHBondContact O-N 3.27Å; K440-K443 PolarHBondContact O-N 3.39Å; K440-L444 WeakPolarHBondContact O-CG 3.44Å; K440-L444 PolarHBondContact O-N 2.92Å |
| 441 | R | 87.9 | Confident | 84.2 | Confident | 72 Ų | 72 | 52.2 Ų | 52.2 | 27% | 0.272 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -63.1 | -43.3 | 179.1 | -75.5 | 176.4 | 179.8 | 167.8 | 5.7 | 111.8 | L437 I438 D439 L444 Y445 P463 G464 L466 | L437-R441 WeakPolarHBondContact O-CG 3.46Å; L437-R441 PolarHBondContact O-N 2.79Å; I438-R441 PolarHBondContact O-N 2.91Å; D439-R441 PolarHBondContact O-N 3.16Å; R441-L444 PolarHBondContact O-N 3.45Å; R441-Y445 WeakPolarHBondContact O-CB 3.19Å; R441-Y445 PolarHBondContact O-N 3.49Å; R441-P463 HydrophobicContact CB-CB 3.98Å; R441-P463 HydrophobicContact CB-CG 4.38Å; R441-P463 HydrophobicContact CG-CB 4.06Å; R441-G464 WeakPolarHBondContact CD-O 3.5Å; R441-G464 PolarHBondContact NH1-O 3.36Å; R441-L466 HydrophobicContact CB-CD1 4.02Å |
| 442 | I | 86.9 | Confident | 84.3 | Confident | 2 Ų | 2 | 47.1 Ų | 47.1 | 1% | 0.01 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -66.1 | -43.3 | 177.4 | -73.2 | 168.2 | 0 | 0 | 0 | 110.9 | L336 K340 I438 D439 L444 Y445 M446 L466 I469 L473 | L336-I442 HydrophobicContact CD1-CG2 3.87Å; L336-I442 HydrophobicContact CD2-CG2 4.43Å; K340-I442 HydrophobicContact CG-CD1 3.62Å; I438-I442 HydrophobicContact CG2-CD1 3.66Å; I438-I442 HydrophobicContact CG2-CG1 4.48Å; I438-I442 WeakPolarHBondContact O-CB 3.25Å; I438-I442 WeakPolarHBondContact O-CG1 3.26Å; I438-I442 PolarHBondContact O-N 3.05Å; D439-I442 PolarHBondContact O-N 3.24Å; I442-L444 VanDerWaalsContact C-N 3.34Å; I442-L444 PolarHBondContact O-N 2.87Å; I442-Y445 WeakPolarHBondContact O-CB 3.38Å; I442-Y445 PolarHBondContact O-N 3.46Å; I442-M446 HydrophobicContact CG2-CG 4.29Å; I442-M446 WeakPolarHBondContact O-CB 3.19Å; I442-M446 WeakPolarHBondContact O-CG 3.34Å; I442-M446 PolarHBondContact O-N 3.12Å; I442-L466 HydrophobicContact CD1-CD2 4.21Å; I442-L466 HydrophobicContact CG1-CD1 3.85Å; I442-L466 HydrophobicContact CG1-CD2 4.07Å; I442-I469 HydrophobicContact CD1-CD1 4.47Å; I442-L473 HydrophobicContact CG1-CD2 4.25Å; I442-L473 HydrophobicContact CG2-CD1 4.4Å |
| 443 | K | 85.9 | Confident | 83.2 | Confident | 66 Ų | 66 | 52.8 Ų | 52.8 | 29% | 0.287 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -60.1 | -43.5 | 175.1 | -73.6 | -179.4 | -152.9 | 177.1 | 0 | 112.1 | Q310 D439 K440 Y445 M446 K447 | Q310-K443 VanDerWaalsContact CD-NZ 3.26Å; D439-K443 WeakPolarHBondContact O-CG 3.45Å; D439-K443 PolarHBondContact O-N 2.75Å; D439-K443 WeakPolarHBondContact OD1-CE 3.17Å; D439-K443 IonicContact OD1-NZ 3.71Å; D439-K443 WeakPolarHBondContact OD2-CE 3.4Å; D439-K443 IonicContact OD2-NZ 3.62Å; D439-K443 PolarHBondContact OD2-NZ 3.03Å; K440-K443 PolarHBondContact O-N 3.39Å; K443-Y445 VanDerWaalsContact C-N 3.34Å; K443-Y445 PolarHBondContact O-N 3.05Å; K443-M446 PolarHBondContact O-N 3.04Å; K443-K447 VanDerWaalsContact O-CB 3.24Å; K443-K447 WeakPolarHBondContact O-CB 3.42Å; K443-K447 PolarHBondContact O-N 3.16Å |
| 444 | L | 85.4 | Confident | 82.1 | Confident | 117 Ų | 117 | 50.6 Ų | 50.6 | 61% | 0.613 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -61.4 | -43.5 | 176.1 | -74.1 | 170.8 | 0 | 0 | 0 | 111.7 | K440 R441 I442 K447 S448 | K440-L444 WeakPolarHBondContact O-CG 3.44Å; K440-L444 PolarHBondContact O-N 2.92Å; R441-L444 PolarHBondContact O-N 3.45Å; I442-L444 VanDerWaalsContact C-N 3.34Å; I442-L444 PolarHBondContact O-N 2.87Å; L444-K447 PolarHBondContact O-N 3.34Å; L444-S448 PolarHBondContact O-N 2.93Å; L444-S448 PolarHBondContact O-OG 3.31Å |
| 445 | Y | 86.6 | Confident | 80.8 | Confident | 2 Ų | 2 | 48.8 Ų | 48.8 | 1% | 0.008 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.6 | -51.1 | 175.9 | 180 | -100.2 | 0 | 0 | 0 | 111.7 | R441 I442 K443 K447 S448 L449 M459 P460 M462 L473 E474 | R441-Y445 WeakPolarHBondContact O-CB 3.19Å; R441-Y445 PolarHBondContact O-N 3.49Å; I442-Y445 WeakPolarHBondContact O-CB 3.38Å; I442-Y445 PolarHBondContact O-N 3.46Å; K443-Y445 VanDerWaalsContact C-N 3.34Å; K443-Y445 PolarHBondContact O-N 3.05Å; Y445-K447 VanDerWaalsContact C-N 3.32Å; Y445-K447 PolarHBondContact O-N 3.41Å; Y445-S448 PolarHBondContact O-N 2.96Å; Y445-S448 VanDerWaalsContact O-N 3.16Å; Y445-S448 PolarHBondContact O-OG 3.41Å; Y445-L449 PolarHBondContact O-N 3.29Å; Y445-M459 VanDerWaalsContact OH-CE 3.24Å; Y445-M459 WeakPolarHBondContact OH-CE 3.49Å; Y445-P460 HydrophobicContact CD2-CG 4.03Å; Y445-P460 HydrophobicContact CE2-CB 4.42Å; Y445-P460 HydrophobicContact CE2-CG 3.64Å; Y445-M462 HydrophobicContact CD2-CE 4.32Å; Y445-M462 HydrophobicContact CD2-SD 4.15Å; Y445-M462 HydrophobicContact CE1-CE 4.21Å; Y445-M462 HydrophobicContact CE2-CE 3.68Å; Y445-M462 HydrophobicContact CE2-SD 4.09Å; Y445-L473 HydrophobicContact CD1-CD2 3.84Å; Y445-L473 HydrophobicContact CD1-CG 4.08Å; Y445-L473 HydrophobicContact CE1-CD2 4.08Å; Y445-L473 HydrophobicContact CE1-CG 3.97Å; Y445-L473 HydrophobicContact CG-CD2 4.47Å; Y445-E474 VanDerWaalsContact OH-CG 3.29Å; Y445-E474 WeakPolarHBondContact OH-CG 3.44Å |
| 446 | M | 86.5 | Confident | 79.5 | Confident | 2 Ų | 2 | 52.7 Ų | 52.7 | 1% | 0.01 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.7 | -40.4 | 177.4 | -69 | -62.6 | 168.7 | 0 | 0 | 112 | L306 L309 L336 I442 K443 S448 L449 L450 L473 L476 | L306-M446 HydrophobicContact CD2-CB 3.65Å; L309-M446 HydrophobicContact CD1-CB 4.24Å; L309-M446 HydrophobicContact CD1-CG 4.03Å; L336-M446 HydrophobicContact CD1-CE 4.17Å; I442-M446 HydrophobicContact CG2-CG 4.29Å; I442-M446 WeakPolarHBondContact O-CB 3.19Å; I442-M446 WeakPolarHBondContact O-CG 3.34Å; I442-M446 PolarHBondContact O-N 3.12Å; K443-M446 PolarHBondContact O-N 3.04Å; M446-S448 PolarHBondContact O-N 3.46Å; M446-L449 WeakPolarHBondContact O-CB 3.32Å; M446-L449 PolarHBondContact O-N 3.35Å; M446-L449 HydrophobicContact SD-CD2 4.48Å; M446-L450 WeakPolarHBondContact O-CG 2.84Å; M446-L450 PolarHBondContact O-N 3.01Å; M446-L473 HydrophobicContact CE-CD1 3.34Å; M446-L473 HydrophobicContact CE-CG 3.95Å; M446-L476 HydrophobicContact CE-CD2 3.98Å |
| 447 | K | 85.1 | Confident | 78.1 | Confident | 70 Ų | 70 | 59.4 Ų | 59.4 | 30% | 0.304 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -60.1 | -46.2 | 174.6 | -174.3 | 168.2 | -178 | 165 | 0 | 111.6 | N303 L306 K443 L444 Y445 L449 L450 C451 | N303-K447 PolarHBondContact OD1-NZ 3.49Å; L306-K447 HydrophobicContact CD1-CB 3.62Å; L306-K447 HydrophobicContact CD1-CD 4.14Å; L306-K447 HydrophobicContact CD1-CG 3.86Å; K443-K447 VanDerWaalsContact O-CB 3.24Å; K443-K447 WeakPolarHBondContact O-CB 3.42Å; K443-K447 PolarHBondContact O-N 3.16Å; L444-K447 PolarHBondContact O-N 3.34Å; Y445-K447 VanDerWaalsContact C-N 3.32Å; Y445-K447 PolarHBondContact O-N 3.41Å; K447-L449 VanDerWaalsContact C-N 3.26Å; K447-L449 PolarHBondContact O-N 3.15Å; K447-L450 PolarHBondContact O-N 3.4Å; K447-C451 PolarHBondContact O-N 3.01Å; K447-C451 PolarHBondContact O-SG 3.18Å; K447-C451 VanDerWaalsContact O-SG 3.37Å |
| 448 | S | 83.4 | Confident | 76.8 | Confident | 45 Ų | 45 | 60.4 Ų | 60.4 | 32% | 0.315 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62.4 | -36.4 | 177.3 | 72.4 | 0 | 0 | 0 | 0 | 111.9 | L444 Y445 M446 C451 L452 P460 | L444-S448 PolarHBondContact O-N 2.93Å; L444-S448 PolarHBondContact O-OG 3.31Å; Y445-S448 PolarHBondContact O-N 2.96Å; Y445-S448 VanDerWaalsContact O-N 3.16Å; Y445-S448 PolarHBondContact O-OG 3.41Å; M446-S448 PolarHBondContact O-N 3.46Å; S448-C451 PolarHBondContact O-N 2.91Å; S448-L452 WeakPolarHBondContact O-CG 3.49Å; S448-P460 VanDerWaalsContact OG-CB 3.31Å; S448-P460 WeakPolarHBondContact OG-CB 3.28Å; S448-P460 VanDerWaalsContact OG-CG 3.27Å; S448-P460 WeakPolarHBondContact OG-CG 3.27Å |
| 449 | L | 83.8 | Confident | 76.1 | Confident | 2 Ų | 2 | 63.1 Ų | 63.1 | 1% | 0.01 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -67.6 | -43.3 | 178.2 | -163.6 | 72.9 | 0 | 0 | 0 | 112.6 | Y445 M446 K447 C451 L452 P455 M459 P460 G477 A481 | Y445-L449 PolarHBondContact O-N 3.29Å; M446-L449 WeakPolarHBondContact O-CB 3.32Å; M446-L449 PolarHBondContact O-N 3.35Å; M446-L449 HydrophobicContact SD-CD2 4.48Å; K447-L449 VanDerWaalsContact C-N 3.26Å; K447-L449 PolarHBondContact O-N 3.15Å; L449-C451 PolarHBondContact O-N 3.43Å; L449-L452 HydrophobicContact CD1-CD1 4.45Å; L449-L452 WeakPolarHBondContact O-CB 3.33Å; L449-L452 PolarHBondContact O-N 3.07Å; L449-L452 VanDerWaalsContact O-N 3.13Å; L449-P455 HydrophobicContact CD1-CB 3.73Å; L449-P455 HydrophobicContact CG-CB 4.13Å; L449-M459 HydrophobicContact CD1-CE 3.86Å; L449-M459 HydrophobicContact CD1-SD 4.02Å; L449-P460 HydrophobicContact CD1-CG 4.18Å; L449-G477 VanDerWaalsContact CD2-CA 3.4Å; L449-G477 WeakPolarHBondContact CD2-O 3.32Å; L449-A481 HydrophobicContact CD2-CB 4.33Å; L449-A481 HydrophobicContact CG-CB 4.46Å |
| 450 | L | 81.8 | Confident | 75.4 | Confident | 7 Ų | 7 | 63 Ų | 63 | 4% | 0.037 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -69.3 | -20.2 | 178.6 | -68.2 | 177.5 | 0 | 0 | 0 | 113.8 | L306 M446 K447 L452 Y480 A481 V484 | L306-L450 HydrophobicContact CD2-CD1 3.59Å; L306-L450 HydrophobicContact CG-CD1 3.78Å; M446-L450 WeakPolarHBondContact O-CG 2.84Å; M446-L450 PolarHBondContact O-N 3.01Å; K447-L450 PolarHBondContact O-N 3.4Å; L450-L452 VanDerWaalsContact C-N 3.35Å; L450-Y480 HydrophobicContact CD1-CE1 4.1Å; L450-Y480 HydrophobicContact CD2-CD1 4.04Å; L450-Y480 HydrophobicContact CD2-CE1 3.98Å; L450-A481 HydrophobicContact CD2-CB 4.33Å; L450-V484 HydrophobicContact CD2-CB 4.06Å; L450-V484 HydrophobicContact CD2-CG1 4.02Å; L450-V484 HydrophobicContact CD2-CG2 4.09Å |
| 451 | C | 75 | Confident | 74.9 | Confident | 76 Ų | 76 | 62.4 Ų | 62.4 | 51% | 0.514 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.1 | -11.2 | 173.6 | -70 | 0 | 0 | 0 | 0 | 113.1 | K447 S448 L449 | K447-C451 PolarHBondContact O-N 3.01Å; K447-C451 PolarHBondContact O-SG 3.18Å; K447-C451 VanDerWaalsContact O-SG 3.37Å; S448-C451 PolarHBondContact O-N 2.91Å; L449-C451 PolarHBondContact O-N 3.43Å |
| 452 | L | 72.9 | Confident | 74.3 | Confident | 49 Ų | 49 | 60.9 Ų | 60.9 | 26% | 0.257 | 34% | 0.335 | S | S | . | . | S | Bend | trans | -83.5 | 133.3 | 178.9 | -70.9 | 165.9 | 0 | 0 | 0 | 110.9 | S448 L449 L450 S454 C458 P460 | S448-L452 WeakPolarHBondContact O-CG 3.49Å; L449-L452 HydrophobicContact CD1-CD1 4.45Å; L449-L452 WeakPolarHBondContact O-CB 3.33Å; L449-L452 PolarHBondContact O-N 3.07Å; L449-L452 VanDerWaalsContact O-N 3.13Å; L450-L452 VanDerWaalsContact C-N 3.35Å; L452-S454 PolarHBondContact O-N 3.09Å; L452-C458 WeakPolarHBondContact CD1-O 3.34Å; L452-P460 HydrophobicContact CD1-CG 4.32Å |
| 453 | P | 59.9 | Low | 73.9 | Confident | 126 Ų | 126 | 62.3 Ų | 62.3 | 82% | 0.818 | 35% | 0.345 | S | S | * | . | S | Bend | trans | -67.9 | -21.5 | 178.4 | 25.3 | -32.3 | 0 | 0 | 0 | 113.1 | ||
| 454 | S | 60.3 | Low | 73.1 | Confident | 47 Ų | 47 | 61.8 Ų | 61.8 | 33% | 0.329 | 36% | 0.358 | S | S | . | . | trans | -150.3 | 102.8 | 173.8 | 62.7 | 0 | 0 | 0 | 0 | 110.7 | L452 Q456 K457 | L452-S454 PolarHBondContact O-N 3.09Å; S454-Q456 VanDerWaalsContact C-N 3.26Å; S454-Q456 PolarHBondContact O-N 3.32Å; S454-K457 PolarHBondContact O-N 3.03Å | ||
| 455 | P | 58.1 | Low | 72.4 | Confident | 4 Ų | 4 | 57.8 Ų | 57.8 | 3% | 0.026 | 35% | 0.345 | C | S | . | . | G | 310 helix | trans | -62 | -34.6 | -177.5 | 2.4 | -1.4 | 0 | 0 | 0 | 112.3 | L449 K457 A481 | L449-P455 HydrophobicContact CD1-CB 3.73Å; L449-P455 HydrophobicContact CG-CB 4.13Å; P455-K457 PolarHBondContact O-N 3.21Å; P455-K457 VanDerWaalsContact O-N 3.12Å; P455-A481 HydrophobicContact CB-CB 4.47Å; P455-A481 HydrophobicContact CG-CB 3.65Å |
| 456 | Q | 57.7 | Low | 72 | Confident | 150 Ų | 150 | 57.7 Ų | 57.7 | 70% | 0.701 | 35% | 0.345 | S | S | * | . | G | 310 helix | trans | -65.6 | -15.8 | -175 | -65.8 | 175.8 | -11.1 | 0 | 0 | 115.6 | S454 | S454-Q456 VanDerWaalsContact C-N 3.26Å; S454-Q456 PolarHBondContact O-N 3.32Å |
| 457 | K | 56.2 | Low | 71.7 | Confident | 189 Ų | 189 | 61 Ų | 61 | 82% | 0.822 | 37% | 0.372 | S | S | * | . | G | 310 helix | trans | -102 | -23 | -174.3 | -70.1 | -176.2 | 179.2 | 176.8 | 0 | 114.4 | S454 P455 | S454-K457 PolarHBondContact O-N 3.03Å; P455-K457 PolarHBondContact O-N 3.21Å; P455-K457 VanDerWaalsContact O-N 3.12Å |
| 458 | C | 59.3 | Low | 71.5 | Confident | 87 Ų | 87 | 59 Ų | 59 | 59% | 0.588 | 37% | 0.365 | S | S | * | . | trans | -155.8 | 98.2 | -178.4 | -170.2 | 0 | 0 | 0 | 0 | 108.8 | L452 | L452-C458 WeakPolarHBondContact CD1-O 3.34Š| ||
| 459 | M | 70.8 | Confident | 71.5 | Confident | 58 Ų | 58 | 56.9 Ų | 56.9 | 29% | 0.286 | 35% | 0.351 | S | S | . | . | P | Polyproline II helix | trans | -77.2 | 137.7 | 178.3 | -65.5 | -58.9 | -77.9 | 0 | 0 | 110 | Y445 L449 E474 | Y445-M459 VanDerWaalsContact OH-CE 3.24Å; Y445-M459 WeakPolarHBondContact OH-CE 3.49Å; L449-M459 HydrophobicContact CD1-CE 3.86Å; L449-M459 HydrophobicContact CD1-SD 4.02Å; M459-E474 HydrophobicContact CE-CB 3.8Å; M459-E474 HydrophobicContact CE-CG 3.62Å |
| 460 | P | 73.6 | Confident | 71.6 | Confident | 18 Ų | 18 | 60.5 Ų | 60.5 | 12% | 0.117 | 37% | 0.368 | C | S | . | . | P | Polyproline II helix | trans | -65.5 | 150.9 | 176.9 | 23.4 | -26.2 | 0 | 0 | 0 | 110.6 | Y445 S448 L449 L452 M462 | Y445-P460 HydrophobicContact CD2-CG 4.03Å; Y445-P460 HydrophobicContact CE2-CB 4.42Å; Y445-P460 HydrophobicContact CE2-CG 3.64Å; S448-P460 VanDerWaalsContact OG-CB 3.31Å; S448-P460 WeakPolarHBondContact OG-CB 3.28Å; S448-P460 VanDerWaalsContact OG-CG 3.27Å; S448-P460 WeakPolarHBondContact OG-CG 3.27Å; L449-P460 HydrophobicContact CD1-CG 4.18Å; L452-P460 HydrophobicContact CD1-CG 4.32Å; P460-M462 PolarHBondContact O-N 3.12Å |
| 461 | P | 75 | Confident | 71.8 | Confident | 122 Ų | 122 | 67.2 Ų | 67.2 | 79% | 0.792 | 40% | 0.399 | S | S | * | . | P | Polyproline II helix | trans | -61.6 | 130.5 | 179.2 | 25.5 | -33.3 | 0 | 0 | 0 | 110.5 | P463 | P461-P463 WeakPolarHBondContact O-CD 3.17Š|
| 462 | M | 77 | Confident | 72.5 | Confident | 39 Ų | 39 | 66.6 Ų | 66.6 | 19% | 0.192 | 39% | 0.388 | C | S | . | . | P | Polyproline II helix | trans | -67.2 | 128.2 | -178.1 | -170.4 | 59.5 | 65.3 | 0 | 0 | 110.9 | Y445 P460 L466 Q470 L473 E474 | Y445-M462 HydrophobicContact CD2-CE 4.32Å; Y445-M462 HydrophobicContact CD2-SD 4.15Å; Y445-M462 HydrophobicContact CE1-CE 4.21Å; Y445-M462 HydrophobicContact CE2-CE 3.68Å; Y445-M462 HydrophobicContact CE2-SD 4.09Å; P460-M462 PolarHBondContact O-N 3.12Å; M462-L466 HydrophobicContact CG-CB 3.94Å; M462-L466 HydrophobicContact SD-CB 3.77Å; M462-L466 HydrophobicContact SD-CD1 4.1Å; M462-Q470 HydrophobicContact CE-CB 4.11Å; M462-Q470 HydrophobicContact CE-CG 3.81Å; M462-L473 HydrophobicContact CE-CD2 4.17Å; M462-L473 HydrophobicContact SD-CD2 3.94Å; M462-E474 HydrophobicContact CE-CG 4.18Å |
| 463 | P | 77.3 | Confident | 73.3 | Confident | 33 Ų | 33 | 64.2 Ų | 64.2 | 21% | 0.214 | 38% | 0.376 | C | S | . | . | P | Polyproline II helix | trans | -59.4 | 144.9 | 172.7 | -24 | 33.4 | 0 | 0 | 0 | 112 | R441 P461 L466 | R441-P463 HydrophobicContact CB-CB 3.98Å; R441-P463 HydrophobicContact CB-CG 4.38Å; R441-P463 HydrophobicContact CG-CB 4.06Å; P461-P463 WeakPolarHBondContact O-CD 3.17Å; P463-L466 HydrophobicContact CB-CD1 4.15Å; P463-L466 HydrophobicContact CG-CD1 4.23Å; P463-L466 PolarHBondContact O-N 3.2Å |
| 464 | G | 70.4 | Confident | 74.7 | Confident | 54 Ų | 54 | 60.6 Ų | 60.6 | 56% | 0.557 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54 | 144.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | R441 L466 | R441-G464 WeakPolarHBondContact CD-O 3.5Å; R441-G464 PolarHBondContact NH1-O 3.36Å; G464-L466 VanDerWaalsContact C-N 3.34Å |
| 465 | G | 69.9 | Low | 76 | Confident | 34 Ų | 34 | 60.7 Ų | 60.7 | 35% | 0.351 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 85.7 | -7.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 466 | L | 78.4 | Confident | 77.6 | Confident | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 35% | 0.353 | C | S | . | . | trans | -102 | 2.4 | 177.1 | -58.9 | 177.1 | 0 | 0 | 0 | 113.8 | A343 I438 R441 I442 M462 P463 G464 V468 I469 Q470 L473 | A343-L466 HydrophobicContact CB-CD2 3.98Å; I438-L466 HydrophobicContact CD1-CD2 3.79Å; I438-L466 HydrophobicContact CG2-CD2 4.19Å; R441-L466 HydrophobicContact CB-CD1 4.02Å; I442-L466 HydrophobicContact CD1-CD2 4.21Å; I442-L466 HydrophobicContact CG1-CD1 3.85Å; I442-L466 HydrophobicContact CG1-CD2 4.07Å; M462-L466 HydrophobicContact CG-CB 3.94Å; M462-L466 HydrophobicContact SD-CB 3.77Å; M462-L466 HydrophobicContact SD-CD1 4.1Å; P463-L466 HydrophobicContact CB-CD1 4.15Å; P463-L466 HydrophobicContact CG-CD1 4.23Å; P463-L466 PolarHBondContact O-N 3.2Å; G464-L466 VanDerWaalsContact C-N 3.34Å; L466-V468 PolarHBondContact O-N 2.84Å; L466-V468 VanDerWaalsContact O-N 3.11Å; L466-I469 HydrophobicContact CB-CG1 4.27Å; L466-I469 HydrophobicContact CD2-CD1 4.09Å; L466-I469 HydrophobicContact CD2-CG1 4.41Å; L466-I469 CarbonylContact O-C 3.59Å; L466-I469 VanDerWaalsContact O-CG1 3.3Å; L466-I469 WeakPolarHBondContact O-CG1 3.24Å; L466-I469 PolarHBondContact O-N 2.71Å; L466-Q470 PolarHBondContact O-N 2.95Å; L466-L473 HydrophobicContact CD1-CD2 4.21Å | ||
| 467 | A | 78.9 | Confident | 79.1 | Confident | 71 Ų | 71 | 53.8 Ų | 53.8 | 59% | 0.587 | 32% | 0.319 | S | S | * | . | G | 310 helix | trans | -56.6 | -31.3 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | I469 Q470 | A467-I469 VanDerWaalsContact C-N 3.28Å; A467-I469 PolarHBondContact O-N 2.93Å; A467-Q470 WeakPolarHBondContact O-CB 3.4Å; A467-Q470 PolarHBondContact O-N 3.35Å |
| 468 | V | 80.9 | Confident | 80.6 | Confident | 27 Ų | 27 | 46 Ų | 46 | 16% | 0.164 | 29% | 0.288 | C | S | . | . | G | 310 helix | trans | -67.2 | -30.2 | -179.9 | 179.9 | 0 | 0 | 0 | 0 | 112.4 | K368 L466 | K368-V468 HydrophobicContact CB-CG1 4.36Å; K368-V468 HydrophobicContact CD-CG1 4.15Å; K368-V468 WeakPolarHBondContact CD-O 3.36Å; K368-V468 PolarHBondContact NZ-O 2.97Å; L466-V468 PolarHBondContact O-N 2.84Å; L466-V468 VanDerWaalsContact O-N 3.11Å |
| 469 | I | 84.5 | Confident | 82 | Confident | 1 Ų | 1 | 46.7 Ų | 46.7 | 1% | 0.005 | 28% | 0.283 | C | S | . | . | G | 310 helix | trans | -109 | 12.7 | -178 | 64.7 | 155.8 | 0 | 0 | 0 | 112.6 | L339 I342 A343 I442 L466 A467 Q471 E472 L473 | L339-I469 HydrophobicContact CB-CD1 4.1Å; L339-I469 HydrophobicContact CD2-CB 4.31Å; L339-I469 HydrophobicContact CD2-CG2 4.24Å; I342-I469 HydrophobicContact CB-CG2 4.32Å; I342-I469 HydrophobicContact CG2-CG2 3.77Å; A343-I469 HydrophobicContact CB-CD1 3.9Å; A343-I469 HydrophobicContact CB-CG1 4.27Å; A343-I469 HydrophobicContact CB-CG2 4.43Å; I442-I469 HydrophobicContact CD1-CD1 4.47Å; L466-I469 HydrophobicContact CB-CG1 4.27Å; L466-I469 HydrophobicContact CD2-CD1 4.09Å; L466-I469 HydrophobicContact CD2-CG1 4.41Å; L466-I469 CarbonylContact O-C 3.59Å; L466-I469 VanDerWaalsContact O-CG1 3.3Å; L466-I469 WeakPolarHBondContact O-CG1 3.24Å; L466-I469 PolarHBondContact O-N 2.71Å; A467-I469 VanDerWaalsContact C-N 3.28Å; A467-I469 PolarHBondContact O-N 2.93Å; I469-Q471 PolarHBondContact O-N 3.08Å; I469-E472 WeakPolarHBondContact CA-OE2 3.38Å; I469-E472 PolarHBondContact O-N 3.11Å; I469-L473 HydrophobicContact CD1-CB 4.41Å; I469-L473 HydrophobicContact CD1-CD2 4.3Å; I469-L473 VanDerWaalsContact O-CB 3.24Å; I469-L473 WeakPolarHBondContact O-CB 3.18Å; I469-L473 PolarHBondContact O-N 3.46Å |
| 470 | Q | 86.2 | Confident | 83 | Confident | 79 Ų | 79 | 44 Ų | 44 | 37% | 0.369 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -57.6 | -50.2 | -170.8 | 168.3 | 170.8 | 9.8 | 0 | 0 | 112.1 | M462 L466 A467 E472 L473 E474 | M462-Q470 HydrophobicContact CE-CB 4.11Å; M462-Q470 HydrophobicContact CE-CG 3.81Å; L466-Q470 PolarHBondContact O-N 2.95Å; A467-Q470 WeakPolarHBondContact O-CB 3.4Å; A467-Q470 PolarHBondContact O-N 3.35Å; Q470-E472 PolarHBondContact O-N 3.04Å; Q470-L473 PolarHBondContact O-N 3.5Å; Q470-E474 HydrophobicContact CG-CG 4.31Å; Q470-E474 WeakPolarHBondContact CG-OE1 3.26Å; Q470-E474 PolarHBondContact NE2-OE1 3.24Å; Q470-E474 VanDerWaalsContact O-CB 3.32Å; Q470-E474 WeakPolarHBondContact O-CB 3.41Å; Q470-E474 WeakPolarHBondContact O-CG 3.4Å; Q470-E474 PolarHBondContact O-N 3.42Å |
| 471 | Q | 86.3 | Confident | 83.7 | Confident | 148 Ų | 148 | 43.1 Ų | 43.1 | 69% | 0.692 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -62.3 | -43.2 | -176.6 | -174.9 | -179.9 | 3.6 | 0 | 0 | 111.8 | I469 A475 | I469-Q471 PolarHBondContact O-N 3.08Å; Q471-A475 WeakPolarHBondContact O-CB 3.5Å; Q471-A475 PolarHBondContact O-N 3.03Å; Q471-A475 VanDerWaalsContact O-N 3.08Å |
| 472 | E | 89 | Confident | 84.4 | Confident | 62 Ų | 62 | 40.8 Ų | 40.8 | 29% | 0.29 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -69.9 | -40 | 179.7 | -62 | 86.6 | 167.3 | 0 | 0 | 111.7 | L339 K368 I469 Q470 A475 L476 | L339-E472 HydrophobicContact CD1-CB 3.87Å; L339-E472 HydrophobicContact CD2-CB 3.67Å; L339-E472 HydrophobicContact CD2-CG 4.22Å; L339-E472 HydrophobicContact CG-CB 4.44Å; K368-E472 WeakPolarHBondContact CE-OE1 3.28Å; K368-E472 IonicContact NZ-OE1 3.16Å; K368-E472 PolarHBondContact NZ-OE1 3.42Å; K368-E472 IonicContact NZ-OE2 3.65Å; K368-E472 PolarHBondContact NZ-OE2 3.44Å; I469-E472 WeakPolarHBondContact CA-OE2 3.38Å; I469-E472 PolarHBondContact O-N 3.11Å; Q470-E472 PolarHBondContact O-N 3.04Å; E472-A475 PolarHBondContact O-N 3Å; E472-L476 VanDerWaalsContact O-CB 3.26Å; E472-L476 WeakPolarHBondContact O-CB 3.42Å; E472-L476 PolarHBondContact O-N 2.94Å |
| 473 | L | 88.8 | Confident | 85 | Confident | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -70.3 | -36.5 | 178.5 | -169.5 | 66.2 | 0 | 0 | 0 | 112.2 | L336 I442 Y445 M446 M462 L466 I469 Q470 G477 | L336-L473 HydrophobicContact CD1-CD1 3.66Å; I442-L473 HydrophobicContact CG1-CD2 4.25Å; I442-L473 HydrophobicContact CG2-CD1 4.4Å; Y445-L473 HydrophobicContact CD1-CD2 3.84Å; Y445-L473 HydrophobicContact CD1-CG 4.08Å; Y445-L473 HydrophobicContact CE1-CD2 4.08Å; Y445-L473 HydrophobicContact CE1-CG 3.97Å; Y445-L473 HydrophobicContact CG-CD2 4.47Å; M446-L473 HydrophobicContact CE-CD1 3.34Å; M446-L473 HydrophobicContact CE-CG 3.95Å; M462-L473 HydrophobicContact CE-CD2 4.17Å; M462-L473 HydrophobicContact SD-CD2 3.94Å; L466-L473 HydrophobicContact CD1-CD2 4.21Å; I469-L473 HydrophobicContact CD1-CB 4.41Å; I469-L473 HydrophobicContact CD1-CD2 4.3Å; I469-L473 VanDerWaalsContact O-CB 3.24Å; I469-L473 WeakPolarHBondContact O-CB 3.18Å; I469-L473 PolarHBondContact O-N 3.46Å; Q470-L473 PolarHBondContact O-N 3.5Å; L473-G477 PolarHBondContact O-N 2.73Å |
| 474 | E | 89.1 | Confident | 85.7 | Confident | 50 Ų | 50 | 38.1 Ų | 38.1 | 23% | 0.234 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.8 | -49.3 | 172.4 | -76.8 | 176.1 | -173.7 | 0 | 0 | 111 | Y445 M459 M462 Q470 G477 C478 | Y445-E474 VanDerWaalsContact OH-CG 3.29Å; Y445-E474 WeakPolarHBondContact OH-CG 3.44Å; M459-E474 HydrophobicContact CE-CB 3.8Å; M459-E474 HydrophobicContact CE-CG 3.62Å; M462-E474 HydrophobicContact CE-CG 4.18Å; Q470-E474 HydrophobicContact CG-CG 4.31Å; Q470-E474 WeakPolarHBondContact CG-OE1 3.26Å; Q470-E474 PolarHBondContact NE2-OE1 3.24Å; Q470-E474 VanDerWaalsContact O-CB 3.32Å; Q470-E474 WeakPolarHBondContact O-CB 3.41Å; Q470-E474 WeakPolarHBondContact O-CG 3.4Å; Q470-E474 PolarHBondContact O-N 3.42Å; E474-G477 PolarHBondContact O-N 2.93Å; E474-C478 WeakPolarHBondContact O-CB 3.39Å; E474-C478 PolarHBondContact O-N 2.99Å; E474-C478 PolarHBondContact O-SG 3.08Å |
| 475 | A | 89.4 | Confident | 86.6 | Confident | 49 Ų | 49 | 37.3 Ų | 37.3 | 41% | 0.405 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -61 | -47.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q471 E472 C478 Q479 | Q471-A475 WeakPolarHBondContact O-CB 3.5Å; Q471-A475 PolarHBondContact O-N 3.03Å; Q471-A475 VanDerWaalsContact O-N 3.08Å; E472-A475 PolarHBondContact O-N 3Å; A475-C478 PolarHBondContact O-N 3.48Å; A475-Q479 WeakPolarHBondContact O-CG 3.47Å; A475-Q479 PolarHBondContact O-N 3.49Å |
| 476 | L | 90.5 | Very high | 87.5 | Confident | 8 Ų | 8 | 37.2 Ų | 37.2 | 4% | 0.042 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -61.6 | -47.1 | 177.1 | -171.9 | 161 | 0 | 0 | 0 | 111.1 | L332 K335 L336 L339 M446 E472 C478 Q479 Y480 | L332-L476 HydrophobicContact CD2-CD2 4.48Å; L332-L476 HydrophobicContact CD2-CG 3.95Å; K335-L476 HydrophobicContact CB-CD1 3.89Å; L336-L476 HydrophobicContact CB-CD1 3.92Å; L336-L476 HydrophobicContact CB-CD2 4.45Å; L336-L476 HydrophobicContact CD1-CD1 4.24Å; L336-L476 HydrophobicContact CD1-CD2 4.24Å; L339-L476 HydrophobicContact CD1-CD1 3.93Å; M446-L476 HydrophobicContact CE-CD2 3.98Å; E472-L476 VanDerWaalsContact O-CB 3.26Å; E472-L476 WeakPolarHBondContact O-CB 3.42Å; E472-L476 PolarHBondContact O-N 2.94Å; L476-C478 PolarHBondContact O-N 3.08Å; L476-Q479 PolarHBondContact O-N 3.35Å; L476-Y480 WeakPolarHBondContact O-CB 3.23Å; L476-Y480 PolarHBondContact O-N 3.16Å |
| 477 | G | 88.7 | Confident | 88.2 | Confident | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -60.2 | -43.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L449 L473 E474 Y480 A481 | L449-G477 VanDerWaalsContact CD2-CA 3.4Å; L449-G477 WeakPolarHBondContact CD2-O 3.32Å; L473-G477 PolarHBondContact O-N 2.73Å; E474-G477 PolarHBondContact O-N 2.93Å; G477-Y480 PolarHBondContact O-N 3.41Å; G477-A481 VanDerWaalsContact O-CB 3.25Å; G477-A481 WeakPolarHBondContact O-CB 3.34Å; G477-A481 PolarHBondContact O-N 3.42Å |
| 478 | C | 87.8 | Confident | 88.7 | Confident | 25 Ų | 25 | 35.9 Ų | 35.9 | 17% | 0.169 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -62.4 | -44.4 | 175.9 | -73.9 | 0 | 0 | 0 | 0 | 112.1 | E474 A475 L476 A481 N482 | E474-C478 WeakPolarHBondContact O-CB 3.39Å; E474-C478 PolarHBondContact O-N 2.99Å; E474-C478 PolarHBondContact O-SG 3.08Å; A475-C478 PolarHBondContact O-N 3.48Å; L476-C478 PolarHBondContact O-N 3.08Å; C478-A481 PolarHBondContact O-N 2.9Å; C478-N482 WeakPolarHBondContact O-CB 3.39Å; C478-N482 PolarHBondContact O-N 3.42Å; C478-N482 PolarHBondContact O-ND2 3.4Å; C478-N482 PolarHBondContact O-OD1 2.66Å |
| 479 | Q | 89.3 | Confident | 89.2 | Confident | 102 Ų | 102 | 39.9 Ų | 39.9 | 48% | 0.477 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -60.3 | -48.2 | 176.2 | -71.8 | 174.1 | 13.9 | 0 | 0 | 111.1 | L332 A475 L476 A481 N482 I483 | L332-Q479 HydrophobicContact CD2-CB 4.07Å; A475-Q479 WeakPolarHBondContact O-CG 3.47Å; A475-Q479 PolarHBondContact O-N 3.49Å; L476-Q479 PolarHBondContact O-N 3.35Å; Q479-A481 PolarHBondContact O-N 2.84Å; Q479-N482 PolarHBondContact O-N 2.92Å; Q479-I483 WeakPolarHBondContact O-CG1 3.49Å; Q479-I483 PolarHBondContact O-N 3.29Å; Q479-I483 VanDerWaalsContact O-N 3.15Å |
| 480 | Y | 91 | Very high | 89.5 | Confident | 1 Ų | 1 | 39.9 Ų | 39.9 | 0% | 0.004 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61.5 | -45.6 | 178.2 | -174.2 | -99.3 | 0 | 0 | 0 | 112.3 | Y305 L309 L329 L332 L450 L476 G477 N482 I483 V484 | Y305-Y480 PolarHBondContact O-OH 3.3Å; L309-Y480 HydrophobicContact CD1-CD1 4.49Å; L309-Y480 HydrophobicContact CD1-CE1 4.2Å; L309-Y480 HydrophobicContact CD2-CD2 3.67Å; L309-Y480 HydrophobicContact CD2-CE1 4.39Å; L309-Y480 HydrophobicContact CD2-CE2 3.49Å; L309-Y480 VanDerWaalsContact CD2-CE2 3.49Å; L309-Y480 HydrophobicContact CD2-CG 4.2Å; L309-Y480 HydrophobicContact CG-CE1 4.29Å; L309-Y480 HydrophobicContact CG-CE2 4.01Å; L329-Y480 HydrophobicContact CD2-CD2 3.99Å; L329-Y480 HydrophobicContact CD2-CE2 3.62Å; L332-Y480 HydrophobicContact CD1-CD2 4.2Å; L450-Y480 HydrophobicContact CD1-CE1 4.1Å; L450-Y480 HydrophobicContact CD2-CD1 4.04Å; L450-Y480 HydrophobicContact CD2-CE1 3.98Å; L476-Y480 WeakPolarHBondContact O-CB 3.23Å; L476-Y480 PolarHBondContact O-N 3.16Å; G477-Y480 PolarHBondContact O-N 3.41Å; Y480-N482 VanDerWaalsContact C-N 3.31Å; Y480-N482 PolarHBondContact O-N 3.14Å; Y480-I483 PolarHBondContact O-N 2.87Å; Y480-V484 HydrophobicContact CD1-CG2 4.09Å; Y480-V484 HydrophobicContact CE1-CG2 3.61Å; Y480-V484 HydrophobicContact CE2-CG2 4.44Å; Y480-V484 WeakPolarHBondContact O-CG2 3.44Å; Y480-V484 PolarHBondContact O-N 2.77Å |
| 481 | A | 89.4 | Confident | 89.8 | Confident | 1 Ų | 1 | 36.3 Ų | 36.3 | 1% | 0.008 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.6 | -34.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L449 L450 P455 G477 C478 Q479 V484 N485 | L449-A481 HydrophobicContact CD2-CB 4.33Å; L449-A481 HydrophobicContact CG-CB 4.46Å; L450-A481 HydrophobicContact CD2-CB 4.33Å; P455-A481 HydrophobicContact CB-CB 4.47Å; P455-A481 HydrophobicContact CG-CB 3.65Å; G477-A481 VanDerWaalsContact O-CB 3.25Å; G477-A481 WeakPolarHBondContact O-CB 3.34Å; G477-A481 PolarHBondContact O-N 3.42Å; C478-A481 PolarHBondContact O-N 2.9Å; Q479-A481 PolarHBondContact O-N 2.84Å; A481-V484 PolarHBondContact O-N 3.47Å; A481-N485 VanDerWaalsContact O-CB 3.22Å; A481-N485 WeakPolarHBondContact O-CB 3.27Å; A481-N485 PolarHBondContact O-N 3.1Å; A481-N485 PolarHBondContact O-ND2 3.29Å |
| 482 | N | 88.8 | Confident | 89.9 | Confident | 73 Ų | 73 | 30.4 Ų | 30.4 | 39% | 0.39 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -64.4 | -44.5 | 174.8 | -72.7 | -13.2 | 0 | 0 | 0 | 111.7 | C478 Q479 Y480 N485 L486 | C478-N482 WeakPolarHBondContact O-CB 3.39Å; C478-N482 PolarHBondContact O-N 3.42Å; C478-N482 PolarHBondContact O-ND2 3.4Å; C478-N482 PolarHBondContact O-OD1 2.66Å; Q479-N482 PolarHBondContact O-N 2.92Å; Y480-N482 VanDerWaalsContact C-N 3.31Å; Y480-N482 PolarHBondContact O-N 3.14Å; N482-N485 PolarHBondContact O-N 2.77Å; N482-L486 WeakPolarHBondContact O-CB 3.49Å; N482-L486 PolarHBondContact O-N 3.34Å |
| 483 | I | 90.7 | Very high | 90 | Very high | 14 Ų | 14 | 30.3 Ų | 30.3 | 7% | 0.072 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.7 | -51.9 | 174.8 | -66.1 | 168.3 | 0 | 0 | 0 | 109.8 | D325 R328 L329 L332 Q479 Y480 N485 L486 N487 | D325-I483 HydrophobicContact CB-CG2 3.91Å; R328-I483 HydrophobicContact CB-CD1 4.31Å; L329-I483 HydrophobicContact CD2-CD1 4.44Å; L329-I483 HydrophobicContact CD2-CG2 4.1Å; L332-I483 HydrophobicContact CD1-CD1 3.62Å; Q479-I483 WeakPolarHBondContact O-CG1 3.49Å; Q479-I483 PolarHBondContact O-N 3.29Å; Q479-I483 VanDerWaalsContact O-N 3.15Å; Y480-I483 PolarHBondContact O-N 2.87Å; I483-N485 VanDerWaalsContact C-N 3.32Å; I483-N485 PolarHBondContact O-N 3.17Å; I483-L486 PolarHBondContact O-N 3.38Å; I483-N487 WeakPolarHBondContact O-CB 3.24Å; I483-N487 PolarHBondContact O-N 3.24Å |
| 484 | V | 90.7 | Very high | 90 | Very high | 1 Ų | 1 | 30.9 Ų | 30.9 | 1% | 0.006 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -60.4 | -41.6 | -179.8 | 172.2 | 0 | 0 | 0 | 0 | 111.8 | Y305 L450 Y480 A481 N487 K488 | Y305-V484 HydrophobicContact CD1-CB 4.44Å; Y305-V484 HydrophobicContact CD1-CG1 4.07Å; Y305-V484 HydrophobicContact CD1-CG2 3.72Å; Y305-V484 HydrophobicContact CD2-CG1 3.56Å; Y305-V484 HydrophobicContact CE1-CG1 4.2Å; Y305-V484 HydrophobicContact CE1-CG2 4.24Å; Y305-V484 HydrophobicContact CE2-CG1 3.69Å; Y305-V484 HydrophobicContact CG-CG1 3.78Å; Y305-V484 HydrophobicContact CG-CG2 3.91Å; L450-V484 HydrophobicContact CD2-CB 4.06Å; L450-V484 HydrophobicContact CD2-CG1 4.02Å; L450-V484 HydrophobicContact CD2-CG2 4.09Å; Y480-V484 HydrophobicContact CD1-CG2 4.09Å; Y480-V484 HydrophobicContact CE1-CG2 3.61Å; Y480-V484 HydrophobicContact CE2-CG2 4.44Å; Y480-V484 WeakPolarHBondContact O-CG2 3.44Å; Y480-V484 PolarHBondContact O-N 2.77Å; A481-V484 PolarHBondContact O-N 3.47Å; V484-N487 PolarHBondContact O-N 2.92Å; V484-K488 HydrophobicContact CG1-CD 3.95Å; V484-K488 VanDerWaalsContact CG1-CE 3.43Å; V484-K488 HydrophobicContact CG1-CG 4.39Å; V484-K488 WeakPolarHBondContact O-CB 3.29Å; V484-K488 WeakPolarHBondContact O-CG 2.95Å; V484-K488 PolarHBondContact O-N 3.4Å |
| 485 | N | 89.3 | Confident | 90.1 | Very high | 37 Ų | 37 | 28.6 Ų | 28.6 | 20% | 0.198 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -70.6 | -37.9 | -179.4 | -75.6 | -24.4 | 0 | 0 | 0 | 112.8 | A481 N482 I483 Q489 | A481-N485 VanDerWaalsContact O-CB 3.22Å; A481-N485 WeakPolarHBondContact O-CB 3.27Å; A481-N485 PolarHBondContact O-N 3.1Å; A481-N485 PolarHBondContact O-ND2 3.29Å; N482-N485 PolarHBondContact O-N 2.77Å; I483-N485 VanDerWaalsContact C-N 3.32Å; I483-N485 PolarHBondContact O-N 3.17Å; N485-Q489 VanDerWaalsContact O-CG 3.28Å; N485-Q489 WeakPolarHBondContact O-CG 3.11Å; N485-Q489 PolarHBondContact O-N 3.01Å; N485-Q489 VanDerWaalsContact O-N 3.13Å; N485-Q489 PolarHBondContact O-NE2 2.89Å |
| 486 | L | 90.3 | Very high | 90 | Very high | 32 Ų | 32 | 28.5 Ų | 28.5 | 17% | 0.168 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -64.6 | -48.3 | 173 | 177.7 | 62 | 0 | 0 | 0 | 110.1 | V83 L241 V242 N482 I483 K488 Q489 V490 | V83-L486 HydrophobicContact CG2-CD2 3.48Å; V83-L486 VanDerWaalsContact CG2-CD2 3.48Å; L241-L486 HydrophobicContact CD2-CD1 4.28Å; L241-L486 HydrophobicContact CD2-CD2 4.18Å; V242-L486 HydrophobicContact CG2-CD1 4.12Å; N482-L486 WeakPolarHBondContact O-CB 3.49Å; N482-L486 PolarHBondContact O-N 3.34Å; I483-L486 PolarHBondContact O-N 3.38Å; L486-K488 VanDerWaalsContact C-N 3.34Å; L486-K488 PolarHBondContact O-N 3.46Å; L486-Q489 WeakPolarHBondContact O-CA 3.48Å; L486-Q489 WeakPolarHBondContact O-CB 3.36Å; L486-Q489 PolarHBondContact O-N 2.95Å; L486-V490 HydrophobicContact CD1-CG2 4.24Å; L486-V490 HydrophobicContact CG-CG2 4.47Å; L486-V490 WeakPolarHBondContact O-CG2 3.46Å; L486-V490 PolarHBondContact O-N 3.22Å |
| 487 | N | 92.4 | Very high | 89.8 | Confident | 2 Ų | 2 | 31.5 Ų | 31.5 | 1% | 0.011 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -58.9 | -43.6 | 179.2 | -173.1 | -94.8 | 0 | 0 | 0 | 112 | Y305 T321 L322 I483 V484 Q489 V490 Y491 Y495 | Y305-N487 PolarHBondContact OH-OD1 3.28Å; T321-N487 PolarHBondContact O-ND2 3.24Å; L322-N487 HydrophobicContact CD2-CB 4.3Å; L322-N487 VanDerWaalsContact CD2-ND2 3.35Å; L322-N487 WeakPolarHBondContact CD2-ND2 3.27Å; I483-N487 WeakPolarHBondContact O-CB 3.24Å; I483-N487 PolarHBondContact O-N 3.24Å; V484-N487 PolarHBondContact O-N 2.92Å; N487-Q489 VanDerWaalsContact C-N 3.33Å; N487-Q489 PolarHBondContact O-N 2.95Å; N487-V490 PolarHBondContact O-N 3.14Å; N487-Y491 WeakPolarHBondContact ND2-CD2 3.28Å; N487-Y491 WeakPolarHBondContact ND2-CE2 3.48Å; N487-Y491 WeakPolarHBondContact O-CB 3.32Å; N487-Y491 WeakPolarHBondContact O-CD2 3.3Å; N487-Y491 PolarHBondContact O-N 3.19Å; N487-Y495 PolarHBondContact OD1-OH 3.38Å |
| 488 | K | 90.6 | Very high | 89.7 | Confident | 42 Ų | 42 | 32.1 Ų | 32.1 | 18% | 0.183 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -60.7 | -37.3 | 172.1 | -76.3 | 170.2 | 179 | 172.9 | 0 | 113.4 | L301 N302 Y305 V484 L486 G492 | L301-K488 HydrophobicContact CD2-CG 4.19Å; N302-K488 WeakPolarHBondContact OD1-CE 3.31Å; N302-K488 PolarHBondContact OD1-NZ 2.77Å; Y305-K488 HydrophobicContact CE2-CD 4.32Å; Y305-K488 HydrophobicContact CE2-CG 3.92Å; V484-K488 HydrophobicContact CG1-CD 3.95Å; V484-K488 VanDerWaalsContact CG1-CE 3.43Å; V484-K488 HydrophobicContact CG1-CG 4.39Å; V484-K488 WeakPolarHBondContact O-CB 3.29Å; V484-K488 WeakPolarHBondContact O-CG 2.95Å; V484-K488 PolarHBondContact O-N 3.4Å; L486-K488 VanDerWaalsContact C-N 3.34Å; L486-K488 PolarHBondContact O-N 3.46Å; K488-G492 WeakPolarHBondContact O-CA 3.3Å; K488-G492 PolarHBondContact O-N 2.97Å |
| 489 | Q | 90.4 | Very high | 89.6 | Confident | 111 Ų | 111 | 31.4 Ų | 31.4 | 52% | 0.519 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -68.5 | -42.4 | 177.9 | -76.5 | 170.2 | 68.2 | 0 | 0 | 111.5 | V242 R246 N485 L486 N487 | V242-Q489 HydrophobicContact CG1-CB 4.25Å; V242-Q489 HydrophobicContact CG2-CB 4.21Å; R246-Q489 PolarHBondContact NH2-O 3.47Å; N485-Q489 VanDerWaalsContact O-CG 3.28Å; N485-Q489 WeakPolarHBondContact O-CG 3.11Å; N485-Q489 PolarHBondContact O-N 3.01Å; N485-Q489 VanDerWaalsContact O-N 3.13Å; N485-Q489 PolarHBondContact O-NE2 2.89Å; L486-Q489 WeakPolarHBondContact O-CA 3.48Å; L486-Q489 WeakPolarHBondContact O-CB 3.36Å; L486-Q489 PolarHBondContact O-N 2.95Å; N487-Q489 VanDerWaalsContact C-N 3.33Å; N487-Q489 PolarHBondContact O-N 2.95Å |
| 490 | V | 91.1 | Very high | 89.4 | Confident | 1 Ų | 1 | 31.4 Ų | 31.4 | 1% | 0.006 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -69.9 | -57.6 | 179 | 178.3 | 0 | 0 | 0 | 0 | 110.1 | V242 E245 R246 L486 N487 | V242-V490 HydrophobicContact CB-CG2 4.47Å; V242-V490 HydrophobicContact CG1-CG2 4.37Å; V242-V490 HydrophobicContact CG2-CG2 4.32Å; E245-V490 HydrophobicContact CB-CG1 3.64Å; E245-V490 HydrophobicContact CB-CG2 4.34Å; E245-V490 WeakPolarHBondContact OE2-CG2 3.43Å; R246-V490 PolarHBondContact NE-O 3.33Å; L486-V490 HydrophobicContact CD1-CG2 4.24Å; L486-V490 HydrophobicContact CG-CG2 4.47Å; L486-V490 WeakPolarHBondContact O-CG2 3.46Å; L486-V490 PolarHBondContact O-N 3.22Å; N487-V490 PolarHBondContact O-N 3.14Å |
| 491 | Y | 91.9 | Very high | 89.1 | Confident | 4 Ų | 4 | 38.1 Ų | 38.1 | 2% | 0.016 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -98.8 | -0.2 | -165.9 | -56.4 | -76.6 | 0 | 0 | 0 | 115.2 | F249 T321 N487 P493 F494 Y495 | F249-Y491 HydrophobicContact CB-CE1 4.08Å; F249-Y491 AromaticContact CD1-CD1 3.88Å; F249-Y491 HydrophobicContact CD1-CD1 3.88Å; F249-Y491 AromaticContact CD1-CE1 3.72Å; F249-Y491 HydrophobicContact CD1-CE1 3.72Å; F249-Y491 AromaticContact CD2-CE1 3.75Å; F249-Y491 HydrophobicContact CD2-CE1 3.75Å; F249-Y491 AromaticContact CE1-CD1 3.98Å; F249-Y491 HydrophobicContact CE1-CD1 3.98Å; F249-Y491 AromaticContact CE1-CE1 3.98Å; F249-Y491 HydrophobicContact CE1-CE1 3.98Å; F249-Y491 HydrophobicContact CE2-CE1 4.03Å; F249-Y491 HydrophobicContact CG-CD1 4.22Å; F249-Y491 AromaticContact CG-CE1 3.58Å; F249-Y491 HydrophobicContact CG-CE1 3.58Å; F249-Y491 HydrophobicContact CZ-CD1 4.43Å; F249-Y491 HydrophobicContact CZ-CE1 4.14Å; T321-Y491 HydrophobicContact CG2-CD1 3.78Å; T321-Y491 HydrophobicContact CG2-CE1 4.3Å; T321-Y491 HydrophobicContact CG2-CG 3.97Å; T321-Y491 WeakPolarHBondContact O-CE2 3.44Å; N487-Y491 WeakPolarHBondContact ND2-CD2 3.28Å; N487-Y491 WeakPolarHBondContact ND2-CE2 3.48Å; N487-Y491 WeakPolarHBondContact O-CB 3.32Å; N487-Y491 WeakPolarHBondContact O-CD2 3.3Å; N487-Y491 PolarHBondContact O-N 3.19Å; Y491-P493 VanDerWaalsContact C-CD 3.46Å; Y491-P493 VanDerWaalsContact C-N 3.34Å; Y491-F494 AromaticContact CD1-CD2 3.9Å; Y491-F494 HydrophobicContact CD1-CD2 3.9Å; Y491-F494 HydrophobicContact CD1-CE2 4.13Å; Y491-F494 HydrophobicContact CG-CD2 4.5Å; Y491-F494 WeakPolarHBondContact O-CB 3.47Å; Y491-F494 PolarHBondContact O-N 2.89Å; Y491-Y495 PolarHBondContact O-N 3.19Å; Y491-Y495 VanDerWaalsContact O-N 3.1Å |
| 492 | G | 89.7 | Confident | 88.8 | Confident | 24 Ų | 24 | 40.4 Ų | 40.4 | 25% | 0.247 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -47.3 | -44.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | K488 F494 Y495 A496 | K488-G492 WeakPolarHBondContact O-CA 3.3Å; K488-G492 PolarHBondContact O-N 2.97Å; G492-F494 VanDerWaalsContact C-N 3.32Å; G492-F494 PolarHBondContact O-N 3.37Å; G492-Y495 PolarHBondContact O-N 3.22Å; G492-A496 WeakPolarHBondContact O-CB 3.4Å; G492-A496 PolarHBondContact O-N 3.49Å |
| 493 | P | 89.8 | Confident | 88.3 | Confident | 59 Ų | 59 | 39.3 Ų | 39.3 | 38% | 0.383 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -60.3 | -37.5 | 176 | -25.3 | 35.6 | 0 | 0 | 0 | 113.8 | Y491 A496 N497 | Y491-P493 VanDerWaalsContact C-CD 3.46Å; Y491-P493 VanDerWaalsContact C-N 3.34Å; P493-A496 PolarHBondContact O-N 3.07Å; P493-N497 PolarHBondContact O-N 3.03Å; P493-N497 VanDerWaalsContact O-N 3.15Å; P493-N497 PolarHBondContact O-ND2 3.11Å |
| 494 | F | 89.6 | Confident | 87.5 | Confident | 13 Ų | 13 | 45.8 Ų | 45.8 | 6% | 0.057 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -69.3 | -44.9 | 177.8 | -53.5 | -71.8 | 0 | 0 | 0 | 110.9 | R246 F249 Q250 L253 Y491 G492 A496 N497 I498 | R246-F494 HydrophobicContact CG-CE2 4.16Å; R246-F494 HydrophobicContact CG-CZ 4.33Å; F249-F494 HydrophobicContact CD1-CD2 4.07Å; F249-F494 HydrophobicContact CD1-CE1 4.29Å; F249-F494 AromaticContact CD1-CE2 3.68Å; F249-F494 HydrophobicContact CD1-CE2 3.68Å; F249-F494 AromaticContact CD1-CZ 3.8Å; F249-F494 HydrophobicContact CD1-CZ 3.8Å; F249-F494 HydrophobicContact CE1-CD2 4.27Å; F249-F494 HydrophobicContact CE1-CE2 4.33Å; F249-F494 HydrophobicContact CE1-CG 4.47Å; Q250-F494 HydrophobicContact CB-CZ 4.39Å; Q250-F494 VanDerWaalsContact OE1-CE1 3.25Å; L253-F494 HydrophobicContact CD1-CD1 3.57Å; L253-F494 HydrophobicContact CD1-CE1 3.35Å; L253-F494 HydrophobicContact CD1-CG 4.48Å; L253-F494 HydrophobicContact CD1-CZ 4.14Å; Y491-F494 AromaticContact CD1-CD2 3.9Å; Y491-F494 HydrophobicContact CD1-CD2 3.9Å; Y491-F494 HydrophobicContact CD1-CE2 4.13Å; Y491-F494 HydrophobicContact CG-CD2 4.5Å; Y491-F494 WeakPolarHBondContact O-CB 3.47Å; Y491-F494 PolarHBondContact O-N 2.89Å; G492-F494 VanDerWaalsContact C-N 3.32Å; G492-F494 PolarHBondContact O-N 3.37Å; F494-A496 VanDerWaalsContact C-N 3.31Å; F494-A496 PolarHBondContact O-N 2.65Å; F494-N497 WeakPolarHBondContact O-CB 3.34Å; F494-N497 PolarHBondContact O-N 3.33Å; F494-N497 VanDerWaalsContact O-N 3.16Å; F494-I498 WeakPolarHBondContact O-CG1 3.47Å; F494-I498 PolarHBondContact O-N 2.86Å |
| 495 | Y | 90.3 | Very high | 86.1 | Confident | 2 Ų | 2 | 51.5 Ų | 51.5 | 1% | 0.008 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.2 | -40.2 | 175.1 | -58.8 | -36 | 0 | 0 | 0 | 112.3 | T263 W266 I267 L301 Y305 T321 N487 Y491 G492 N497 I498 L499 | T263-Y495 HydrophobicContact CG2-CD1 4.07Å; T263-Y495 HydrophobicContact CG2-CE1 3.62Å; W266-Y495 HydrophobicContact CZ3-CE1 4.26Å; I267-Y495 HydrophobicContact CD1-CD1 3.72Å; I267-Y495 HydrophobicContact CD1-CE1 4.38Å; I267-Y495 HydrophobicContact CD1-CG 4.4Å; L301-Y495 HydrophobicContact CD1-CD2 4.13Å; L301-Y495 HydrophobicContact CD1-CE2 4.47Å; L301-Y495 HydrophobicContact CD1-CG 4.27Å; L301-Y495 HydrophobicContact CD2-CD2 4.06Å; Y305-Y495 VanDerWaalsContact OH-CE2 3.23Å; Y305-Y495 WeakPolarHBondContact OH-CE2 3.47Å; T321-Y495 WeakPolarHBondContact CB-OH 3.38Å; T321-Y495 HydrophobicContact CG2-CE1 3.91Å; T321-Y495 PolarHBondContact OG1-OH 3.11Å; N487-Y495 PolarHBondContact OD1-OH 3.38Å; Y491-Y495 PolarHBondContact O-N 3.19Å; Y491-Y495 VanDerWaalsContact O-N 3.1Å; G492-Y495 PolarHBondContact O-N 3.22Å; Y495-N497 VanDerWaalsContact C-N 3.29Å; Y495-N497 PolarHBondContact O-N 2.95Å; Y495-I498 PolarHBondContact O-N 3.44Å; Y495-L499 WeakPolarHBondContact O-CB 3.27Å; Y495-L499 VanDerWaalsContact O-CG 3.31Å; Y495-L499 WeakPolarHBondContact O-CG 3.21Å; Y495-L499 PolarHBondContact O-N 3Å |
| 496 | A | 87.9 | Confident | 84.2 | Confident | 46 Ų | 46 | 56.2 Ų | 56.2 | 38% | 0.38 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -61.4 | -38.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | G492 P493 F494 R500 | G492-A496 WeakPolarHBondContact O-CB 3.4Å; G492-A496 PolarHBondContact O-N 3.49Å; P493-A496 PolarHBondContact O-N 3.07Å; F494-A496 VanDerWaalsContact C-N 3.31Å; F494-A496 PolarHBondContact O-N 2.65Å; A496-R500 VanDerWaalsContact O-CB 3.28Å; A496-R500 WeakPolarHBondContact O-CB 3.35Å; A496-R500 PolarHBondContact O-N 3.36Å |
| 497 | N | 86.8 | Confident | 82 | Confident | 72 Ų | 72 | 64.3 Ų | 64.3 | 39% | 0.385 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -67.5 | -42.7 | 175.8 | -70.5 | -20.9 | 0 | 0 | 0 | 112.2 | P493 F494 Y495 R500 K501 | P493-N497 PolarHBondContact O-N 3.03Å; P493-N497 VanDerWaalsContact O-N 3.15Å; P493-N497 PolarHBondContact O-ND2 3.11Å; F494-N497 WeakPolarHBondContact O-CB 3.34Å; F494-N497 PolarHBondContact O-N 3.33Å; F494-N497 VanDerWaalsContact O-N 3.16Å; Y495-N497 VanDerWaalsContact C-N 3.29Å; Y495-N497 PolarHBondContact O-N 2.95Å; N497-R500 PolarHBondContact O-N 3Å; N497-R500 PolarHBondContact OD1-NH1 2.89Å; N497-R500 PolarHBondContact OD1-NH2 3.02Å; N497-K501 WeakPolarHBondContact O-CG 3.26Å; N497-K501 PolarHBondContact O-N 3.03Å; N497-K501 VanDerWaalsContact O-N 3.14Å |
| 498 | I | 86.1 | Confident | 79.3 | Confident | 12 Ų | 12 | 67.9 Ų | 67.9 | 6% | 0.062 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -62.9 | -51.1 | 176.2 | -66.3 | 168.5 | 0 | 0 | 0 | 110.4 | T263 T264 I267 F494 Y495 R500 K501 L502 | T263-I498 HydrophobicContact CG2-CD1 3.83Å; T264-I498 HydrophobicContact CG2-CG2 4.08Å; I267-I498 HydrophobicContact CB-CG2 4.39Å; I267-I498 HydrophobicContact CD1-CB 4.38Å; I267-I498 HydrophobicContact CD1-CD1 4.28Å; I267-I498 HydrophobicContact CD1-CG2 4.01Å; I267-I498 HydrophobicContact CG2-CG2 4.38Å; F494-I498 WeakPolarHBondContact O-CG1 3.47Å; F494-I498 PolarHBondContact O-N 2.86Å; Y495-I498 PolarHBondContact O-N 3.44Å; I498-R500 VanDerWaalsContact C-N 3.27Å; I498-R500 PolarHBondContact O-N 3.47Å; I498-K501 PolarHBondContact O-N 3.27Å; I498-K501 VanDerWaalsContact O-N 3.14Å; I498-L502 HydrophobicContact CG2-CD1 3.72Å; I498-L502 HydrophobicContact CG2-CG 4.27Å; I498-L502 WeakPolarHBondContact O-CG 3.48Å; I498-L502 PolarHBondContact O-N 3.4Å |
| 499 | L | 85.8 | Confident | 76.6 | Confident | 10 Ų | 10 | 74.4 Ų | 74.4 | 5% | 0.052 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -61.3 | -36.5 | 178.9 | -73.2 | 164.2 | 0 | 0 | 0 | 111.6 | I267 V271 P297 V300 Y495 L502 L503 | I267-L499 HydrophobicContact CG2-CD2 3.49Å; I267-L499 VanDerWaalsContact CG2-CD2 3.49Å; I267-L499 HydrophobicContact CG2-CG 4.1Å; V271-L499 HydrophobicContact CG2-CD2 4.35Å; P297-L499 HydrophobicContact CB-CD1 3.99Å; V300-L499 HydrophobicContact CB-CD2 4.46Å; V300-L499 HydrophobicContact CG1-CD2 3.98Å; Y495-L499 WeakPolarHBondContact O-CB 3.27Å; Y495-L499 VanDerWaalsContact O-CG 3.31Å; Y495-L499 WeakPolarHBondContact O-CG 3.21Å; Y495-L499 PolarHBondContact O-N 3Å; L499-L502 PolarHBondContact O-N 3.47Å; L499-L503 HydrophobicContact CB-CD1 4.39Å; L499-L503 HydrophobicContact CD2-CD1 4.41Å; L499-L503 WeakPolarHBondContact O-CB 3.36Å; L499-L503 VanDerWaalsContact O-CG 3.26Å; L499-L503 WeakPolarHBondContact O-CG 3.49Å; L499-L503 PolarHBondContact O-N 3.12Å |
| 500 | R | 85.5 | Confident | 74 | Confident | 103 Ų | 103 | 72.7 Ų | 72.7 | 39% | 0.389 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60.9 | -47.9 | 174.5 | -169.5 | -173.9 | -52.7 | 106 | 7.1 | 111.3 | A496 N497 I498 F504 | A496-R500 VanDerWaalsContact O-CB 3.28Å; A496-R500 WeakPolarHBondContact O-CB 3.35Å; A496-R500 PolarHBondContact O-N 3.36Å; N497-R500 PolarHBondContact O-N 3Å; N497-R500 PolarHBondContact OD1-NH1 2.89Å; N497-R500 PolarHBondContact OD1-NH2 3.02Å; I498-R500 VanDerWaalsContact C-N 3.27Å; I498-R500 PolarHBondContact O-N 3.47Å; R500-F504 HydrophobicContact CG-CD2 4.2Å; R500-F504 WeakPolarHBondContact O-CB 3.02Å; R500-F504 PolarHBondContact O-N 3.41Å |
| 501 | K | 85.1 | Confident | 71.5 | Confident | 142 Ų | 142 | 82.1 Ų | 82.1 | 62% | 0.617 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -61.8 | -46.1 | 178.3 | -70.2 | 177.9 | 179.8 | -176.4 | 0 | 111.9 | N497 I498 N505 | N497-K501 WeakPolarHBondContact O-CG 3.26Å; N497-K501 PolarHBondContact O-N 3.03Å; N497-K501 VanDerWaalsContact O-N 3.14Å; I498-K501 PolarHBondContact O-N 3.27Å; I498-K501 VanDerWaalsContact O-N 3.14Å; K501-N505 PolarHBondContact O-N 3.26Å |
| 502 | L | 82.9 | Confident | 68.7 | Low | 49 Ų | 49 | 88.1 Ų | 88.1 | 26% | 0.257 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -71 | -36.6 | -177.3 | -68 | 176.5 | 0 | 0 | 0 | 113.6 | I267 K268 I498 L499 | I267-L502 HydrophobicContact CB-CD1 4.44Å; I267-L502 HydrophobicContact CG2-CD1 3.93Å; K268-L502 HydrophobicContact CB-CD1 4.06Å; K268-L502 HydrophobicContact CB-CD2 4.38Å; K268-L502 HydrophobicContact CD-CD2 4.33Å; K268-L502 HydrophobicContact CG-CD2 4.35Å; I498-L502 HydrophobicContact CG2-CD1 3.72Å; I498-L502 HydrophobicContact CG2-CG 4.27Å; I498-L502 WeakPolarHBondContact O-CG 3.48Å; I498-L502 PolarHBondContact O-N 3.4Å; L499-L502 PolarHBondContact O-N 3.47Å |
| 503 | L | 77.3 | Confident | 66 | Low | 49 Ų | 49 | 93.9 Ų | 93.9 | 26% | 0.257 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -90.7 | -26.9 | -175.9 | -63.8 | 173.9 | 0 | 0 | 0 | 113.3 | V271 L295 P297 L499 | V271-L503 HydrophobicContact CG1-CD2 4.06Å; V271-L503 HydrophobicContact CG2-CD2 4.48Å; L295-L503 HydrophobicContact CB-CD2 4.28Å; L295-L503 HydrophobicContact CD2-CD2 4.39Å; P297-L503 HydrophobicContact CG-CD1 4.11Å; L499-L503 HydrophobicContact CB-CD1 4.39Å; L499-L503 HydrophobicContact CD2-CD1 4.41Å; L499-L503 WeakPolarHBondContact O-CB 3.36Å; L499-L503 VanDerWaalsContact O-CG 3.26Å; L499-L503 WeakPolarHBondContact O-CG 3.49Å; L499-L503 PolarHBondContact O-N 3.12Å |
| 504 | F | 74.9 | Confident | 63.4 | Low | 151 Ų | 151 | 96.2 Ų | 96.2 | 66% | 0.662 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -117.4 | 5.9 | -172.6 | -59.1 | -78.5 | 0 | 0 | 0 | 115 | R500 E506 | R500-F504 HydrophobicContact CG-CD2 4.2Å; R500-F504 WeakPolarHBondContact O-CB 3.02Å; R500-F504 PolarHBondContact O-N 3.41Å; F504-E506 PolarHBondContact O-N 3.43Å |
| 505 | N | 61.1 | Low | 60.8 | Low | 121 Ų | 121 | 100.2 Ų | 100.2 | 65% | 0.647 | 55% | 0.552 | S | S | * | * | trans | 40.7 | 67.9 | 175.1 | -79.4 | -7.9 | 0 | 0 | 0 | 113.4 | K501 E507 A508 | K501-N505 PolarHBondContact O-N 3.26Å; N505-E507 PolarHBondContact O-N 3.25Å; N505-A508 PolarHBondContact O-N 3.01Å | ||
| 506 | E | 48.3 | Very low | 58.3 | Low | 136 Ų | 136 | 105.1 Ų | 105.1 | 64% | 0.636 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.4 | 18.6 | 177.3 | -105 | -178.6 | -177 | 0 | 0 | 114.6 | F504 | F504-E506 PolarHBondContact O-N 3.43Š|
| 507 | E | 43.9 | Very low | 55.9 | Low | 202 Ų | 202 | 109.2 Ų | 109.2 | 94% | 0.944 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.9 | -7.7 | 167.7 | -75.2 | -172.4 | 159.2 | 0 | 0 | 113.5 | N505 | N505-E507 PolarHBondContact O-N 3.25Š|
| 508 | A | 36 | Very low | 53.6 | Low | 76 Ų | 76 | 111.9 Ų | 111.9 | 63% | 0.628 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -107.8 | 5.9 | -171.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | N505 | N505-A508 PolarHBondContact O-N 3.01Š|
| 509 | M | 35.3 | Very low | 51.2 | Low | 179 Ų | 179 | 122.3 Ų | 122.3 | 88% | 0.882 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -121.4 | 31.9 | -176.3 | -147.1 | 127.7 | 76.3 | 0 | 0 | 114.8 | ||
| 510 | G | 35.3 | Very low | 49.5 | Very low | 76 Ų | 76 | 127.9 Ų | 127.9 | 78% | 0.784 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -105.9 | -3 | 169.1 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 511 | K | 38.3 | Very low | 47.6 | Very low | 198 Ų | 198 | 129.2 Ų | 129.2 | 86% | 0.861 | 73% | 0.73 | S | S | * | * | trans | -146.2 | 83.6 | 178.6 | -72.3 | -172 | 179.7 | 178.8 | 0 | 110.6 | ||||
| 512 | V | 33.4 | Very low | 45.5 | Very low | 130 Ų | 130 | 128.5 Ų | 128.5 | 79% | 0.788 | 74% | 0.736 | S | S | * | * | trans | -126.3 | 121.2 | 155.1 | 178.6 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 513 | D | 33.6 | Very low | 43.3 | Very low | 146 Ų | 146 | 133.2 Ų | 133.2 | 78% | 0.781 | 76% | 0.764 | S | S | * | * | trans | -55.6 | 130.3 | -167.3 | -63.9 | -61.5 | 0 | 0 | 0 | 114.2 | ||||
| 514 | A | 34.6 | Very low | 41.2 | Very low | 107 Ų | 107 | 138.4 Ų | 138.4 | 88% | 0.884 | 80% | 0.796 | S | S | * | * | trans | -90.2 | 82.2 | 151.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 515 | S | 33.9 | Very low | 39 | Very low | 98 Ų | 98 | 137.6 Ų | 137.6 | 69% | 0.685 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -89.6 | 121.8 | 161.1 | 58.4 | 0 | 0 | 0 | 0 | 108.9 | ||
| 516 | P | 38.2 | Very low | 37.4 | Very low | 105 Ų | 105 | 138.8 Ų | 138.8 | 68% | 0.682 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 151.4 | 173.8 | 31.6 | -31 | 0 | 0 | 0 | 110.5 | ||
| 517 | P | 38.5 | Very low | 36.6 | Very low | 132 Ų | 132 | 139 Ų | 139 | 86% | 0.857 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -74 | 132.6 | 179.7 | 31.5 | -31.2 | 0 | 0 | 0 | 109.5 | ||
| 518 | T | 38.4 | Very low | 36 | Very low | 127 Ų | 127 | 133.8 Ų | 133.8 | 78% | 0.779 | 82% | 0.82 | S | S | * | * | trans | -111.9 | 95.6 | 170.1 | -36.3 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 519 | N | 36.1 | Very low | 36 | Very low | 231 Ų | 231 | 139 Ų | 139 | 100% | 1.235 | 84% | 0.838 | S | S | * | * | 177.1 | 0 | 128.5 | -92.4 | -10.3 | 0 | 0 | 0 | 110.6 |
Retrieved 519 of 519 residues in 1373.2 ms
(Link to these results)