| 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 | 43.3 | Very low | 42.6 | Very low | 226 Ų | 226 | 159.9 Ų | 159.9 | 100% | 1.113 | 82% | 0.824 | S | S | * | * | 0 | 97 | 0 | -59.7 | -171.3 | -163.4 | 0 | 0 | 106.1 | |||||
| 2 | E | 39.3 | Very low | 42.7 | Very low | 174 Ų | 174 | 157.5 Ų | 157.5 | 81% | 0.813 | 83% | 0.832 | S | S | * | * | 76.1 | 139.6 | 112.2 | -79.8 | -175.5 | 124.8 | 0 | 0 | 113.4 | |||||
| 3 | R | 39 | Very low | 42.4 | Very low | 203 Ų | 203 | 157.9 Ų | 157.9 | 77% | 0.766 | 84% | 0.835 | S | S | * | * | cis | 177.5 | 136.9 | -25.3 | -123.2 | -175.4 | 178 | 174.8 | 10.7 | 104.6 | ||||
| 4 | H | 42.8 | Very low | 42.3 | Very low | 150 Ų | 150 | 159.9 Ų | 159.9 | 69% | 0.694 | 83% | 0.833 | S | S | * | * | trans | 56.1 | 131 | 149.6 | -61.8 | -66.2 | 0 | 0 | 0 | 121.3 | ||||
| 5 | R | 52.5 | Low | 42.4 | Very low | 247 Ų | 247 | 160.6 Ų | 160.6 | 93% | 0.932 | 84% | 0.837 | S | S | * | * | -162.7 | 124.6 | 91.1 | -150.7 | 173 | -97.5 | 173.9 | -7.4 | 111.9 | |||||
| 6 | S | 41.6 | Very low | 42.5 | Very low | 107 Ų | 107 | 160.8 Ų | 160.8 | 75% | 0.748 | 83% | 0.832 | S | S | * | * | trans | -102.6 | 152.2 | 169.7 | -39.1 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 7 | A | 45.8 | Very low | 42.5 | Very low | 106 Ų | 106 | 157.3 Ų | 157.3 | 88% | 0.876 | 83% | 0.832 | S | S | * | * | trans | -156.8 | 121.6 | 154.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 8 | S | 39.8 | Very low | 42.6 | Very low | 113 Ų | 113 | 160.1 Ų | 160.1 | 79% | 0.79 | 84% | 0.836 | S | S | * | * | trans | -91.5 | 158.1 | 177.5 | -59 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 9 | Y | 39.6 | Very low | 42.4 | Very low | 223 Ų | 223 | 162.3 Ų | 162.3 | 88% | 0.875 | 84% | 0.838 | S | S | * | * | trans | -152 | 144.6 | 156.6 | -97.9 | -92.9 | 0 | 0 | 0 | 107.6 | ||||
| 10 | V | 45.9 | Very low | 42.6 | Very low | 126 Ų | 126 | 159.2 Ų | 159.2 | 76% | 0.764 | 84% | 0.838 | S | S | * | * | cis | -165.1 | 149.4 | -19.1 | 138.3 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 11 | A | 39.2 | Very low | 42.4 | Very low | 84 Ų | 84 | 157.4 Ų | 157.4 | 69% | 0.694 | 84% | 0.836 | S | S | * | * | trans | -85.7 | 164.3 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 12 | S | 44.1 | Very low | 42.1 | Very low | 131 Ų | 131 | 151.1 Ų | 151.1 | 92% | 0.916 | 82% | 0.819 | S | S | * | * | 176 | 121.2 | 125.7 | -83.5 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 13 | D | 37.9 | Very low | 42.1 | Very low | 163 Ų | 163 | 152.4 Ų | 152.4 | 87% | 0.872 | 82% | 0.822 | S | S | * | * | trans | -100.9 | 146.5 | 165.8 | -115.7 | -31 | 0 | 0 | 0 | 109.3 | ||||
| 14 | K | 41.9 | Very low | 41.8 | Very low | 186 Ų | 186 | 151.3 Ų | 151.3 | 81% | 0.809 | 83% | 0.826 | S | S | * | * | trans | 149.3 | 119.8 | 147.2 | -84.9 | -175.1 | -169.9 | -164.5 | 0 | 112.2 | ||||
| 15 | L | 43.7 | Very low | 41.5 | Very low | 170 Ų | 170 | 148.9 Ų | 148.9 | 89% | 0.89 | 83% | 0.832 | S | S | * | * | -161.5 | 143.2 | 128.7 | -148 | 66.8 | 0 | 0 | 0 | 113.2 | |||||
| 16 | H | 43 | Very low | 40.6 | Very low | 164 Ų | 164 | 143.4 Ų | 143.4 | 76% | 0.759 | 82% | 0.821 | S | S | * | * | trans | -78.9 | 157 | -169.8 | -69.1 | -106.1 | 0 | 0 | 0 | 116 | ||||
| 17 | A | 43.4 | Very low | 40.5 | Very low | 101 Ų | 101 | 146 Ų | 146 | 84% | 0.835 | 83% | 0.826 | S | S | * | * | trans | 153.2 | 142.6 | 137.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 18 | K | 44.1 | Very low | 40.3 | Very low | 208 Ų | 208 | 145.8 Ų | 145.8 | 90% | 0.904 | 83% | 0.825 | S | S | * | * | cis | -170.1 | 147.4 | -6.2 | -170 | 178.3 | -179 | -166.8 | 0 | 105.9 | ||||
| 19 | K | 39.5 | Very low | 40 | Very low | 202 Ų | 202 | 144.1 Ų | 144.1 | 88% | 0.878 | 83% | 0.825 | S | S | * | * | trans | -47.9 | 148.8 | -178.7 | -103.4 | 170.2 | 169.4 | 178.9 | 0 | 117.6 | ||||
| 20 | A | 45.2 | Very low | 40 | Very low | 100 Ų | 100 | 142.1 Ų | 142.1 | 83% | 0.826 | 83% | 0.829 | S | S | * | * | trans | -166.3 | 135 | 130.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 21 | P | 39 | Very low | 39.7 | Very low | 122 Ų | 122 | 143.6 Ų | 143.6 | 79% | 0.792 | 83% | 0.831 | S | S | * | * | trans | -117.6 | 163.4 | 178.5 | 39.1 | -27.6 | 0 | 0 | 0 | 115.2 | ||||
| 22 | A | 37.7 | Very low | 39.9 | Very low | 93 Ų | 93 | 144.9 Ų | 144.9 | 77% | 0.769 | 83% | 0.833 | S | S | * | * | trans | 106.5 | 130.5 | 140 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 23 | K | 38.3 | Very low | 39.9 | Very low | 201 Ų | 201 | 143 Ų | 143 | 87% | 0.874 | 83% | 0.825 | S | S | * | * | trans | 91.7 | 93.1 | 149.3 | -71 | -176.9 | 177.7 | -174.5 | 0 | 121.1 | ||||
| 24 | Q | 32.2 | Very low | 39.9 | Very low | 180 Ų | 180 | 139.3 Ų | 139.3 | 84% | 0.841 | 82% | 0.818 | S | S | * | * | 13.8 | 125.1 | 122.9 | -149.2 | 124.2 | -1.7 | 0 | 0 | 120.1 | |||||
| 25 | A | 37.1 | Very low | 39.8 | Very low | 99 Ų | 99 | 137.7 Ų | 137.7 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | trans | -157.8 | 126.9 | 145.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 26 | N | 33.1 | Very low | 39.7 | Very low | 133 Ų | 133 | 136.3 Ų | 136.3 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | trans | -77.2 | 149.8 | 169.6 | -71.5 | -20.8 | 0 | 0 | 0 | 109.8 | ||||
| 27 | D | 39.8 | Very low | 39 | Very low | 160 Ų | 160 | 139 Ų | 139 | 86% | 0.856 | 81% | 0.814 | S | S | * | * | 163.6 | 144.1 | 122.9 | -81.6 | -18.5 | 0 | 0 | 0 | 114.2 | |||||
| 28 | A | 41.5 | Very low | 38.6 | Very low | 102 Ų | 102 | 139.6 Ų | 139.6 | 84% | 0.843 | 81% | 0.809 | S | S | * | * | trans | 68.4 | 93.2 | 147.8 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 29 | G | 33.5 | Very low | 38 | Very low | 78 Ų | 78 | 141.5 Ų | 141.5 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | 30 | 125.5 | 128.1 | 0 | 0 | 0 | 0 | 0 | 123.3 | |||||
| 30 | L | 39.7 | Very low | 37.6 | Very low | 181 Ų | 181 | 137.1 Ų | 137.1 | 95% | 0.948 | 81% | 0.805 | S | S | * | * | -162.6 | 129.2 | 127.8 | -150.5 | 63.2 | 0 | 0 | 0 | 111.2 | |||||
| 31 | L | 39.8 | Very low | 37.4 | Very low | 157 Ų | 157 | 137.3 Ų | 137.3 | 82% | 0.822 | 80% | 0.801 | S | S | * | * | trans | -67.8 | -178.1 | 176.2 | -87.1 | 167 | 0 | 0 | 0 | 113.4 | ||||
| 32 | P | 43.5 | Very low | 37.2 | Very low | 111 Ų | 111 | 136.7 Ų | 136.7 | 72% | 0.721 | 80% | 0.799 | S | S | * | * | cis | -142.1 | 175.8 | -0.8 | 20 | 7.6 | 0 | 0 | 0 | 117.6 | ||||
| 33 | A | 43.9 | Very low | 37.6 | Very low | 92 Ų | 92 | 139.2 Ų | 139.2 | 76% | 0.76 | 81% | 0.805 | S | S | * | * | trans | 76.9 | 123.5 | 135 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 34 | A | 38.9 | Very low | 37.8 | Very low | 86 Ų | 86 | 134 Ų | 134 | 71% | 0.711 | 80% | 0.799 | S | S | * | * | trans | 82.3 | 102.5 | 134.3 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 35 | L | 38.9 | Very low | 38.7 | Very low | 152 Ų | 152 | 132 Ų | 132 | 80% | 0.796 | 80% | 0.799 | S | S | * | * | 170.1 | 113.6 | 97.5 | -81.8 | 169.8 | 0 | 0 | 0 | 111.4 | |||||
| 36 | I | 40.8 | Very low | 39.2 | Very low | 141 Ų | 141 | 132.2 Ų | 132.2 | 72% | 0.723 | 80% | 0.801 | S | S | * | * | 66.5 | 102.2 | 127.8 | -55.2 | -179.9 | 0 | 0 | 0 | 120.1 | |||||
| 37 | Y | 30.1 | Very low | 39.7 | Very low | 221 Ų | 221 | 135.1 Ų | 135.1 | 87% | 0.867 | 81% | 0.807 | S | S | * | * | trans | 66.9 | 131.2 | 131.1 | -99.7 | -95.1 | 0 | 0 | 0 | 124.2 | ||||
| 38 | P | 34.9 | Very low | 40.1 | Very low | 112 Ų | 112 | 134 Ų | 134 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | trans | -104.2 | 166.8 | 173.1 | 39.9 | -31.5 | 0 | 0 | 0 | 114.7 | ||||
| 39 | R | 31 | Very low | 40.4 | Very low | 249 Ų | 249 | 133.3 Ų | 133.3 | 94% | 0.94 | 80% | 0.795 | S | S | * | * | trans | 88.2 | 144.3 | 147.9 | -150.1 | 174.5 | -168.6 | 169.2 | 2.8 | 119.6 | ||||
| 40 | S | 31.2 | Very low | 41.2 | Very low | 109 Ų | 109 | 135.1 Ų | 135.1 | 76% | 0.762 | 79% | 0.79 | S | S | * | * | trans | 95.4 | 113.5 | 172.6 | -158.1 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 41 | S | 40.9 | Very low | 41.9 | Very low | 105 Ų | 105 | 132 Ų | 132 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | -175.5 | 128 | 60.5 | 26.5 | 0 | 0 | 0 | 0 | 111 | |||||
| 42 | S | 35 | Very low | 42.9 | Very low | 109 Ų | 109 | 128.2 Ų | 128.2 | 76% | 0.762 | 76% | 0.755 | S | S | * | * | trans | -51.9 | 147.4 | 147.6 | 46.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 43 | V | 45.3 | Very low | 44.3 | Very low | 145 Ų | 145 | 128.9 Ų | 128.9 | 88% | 0.879 | 75% | 0.753 | S | S | * | * | trans | 121 | 77.4 | 172.3 | -178.8 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 44 | A | 43.7 | Very low | 46 | Very low | 91 Ų | 91 | 132.9 Ų | 132.9 | 75% | 0.752 | 75% | 0.748 | S | S | * | * | trans | -151.8 | 8.7 | 168.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 45 | T | 50.9 | Low | 48 | Very low | 138 Ų | 138 | 131.8 Ų | 131.8 | 85% | 0.847 | 73% | 0.727 | S | S | * | * | trans | -105.4 | 18.9 | -166.6 | 34.1 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 46 | A | 45.9 | Very low | 50.2 | Low | 104 Ų | 104 | 127.3 Ų | 127.3 | 86% | 0.86 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -104.6 | 1.9 | -176.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 47 | K | 44.7 | Very low | 52.5 | Low | 194 Ų | 194 | 125.8 Ų | 125.8 | 84% | 0.843 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -103.7 | 7.5 | -174.4 | -72.8 | -171.7 | 178.7 | 178.8 | 0 | 116.5 | ||
| 48 | I | 48.9 | Very low | 55.2 | Low | 136 Ų | 136 | 116.7 Ų | 116.7 | 70% | 0.697 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -103.9 | -13.6 | -163.2 | -60.7 | 177.3 | 0 | 0 | 0 | 114.8 | ||
| 49 | A | 46.1 | Very low | 57.8 | Low | 89 Ų | 89 | 114.3 Ų | 114.3 | 74% | 0.736 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -90.1 | -13.3 | -172.5 | 0 | 0 | 0 | 0 | 0 | 117 | P52 | A49-P52 WeakPolarHBondContact O-CD 3.49Š|
| 50 | V | 51.1 | Low | 60.5 | Low | 115 Ų | 115 | 110 Ų | 110 | 70% | 0.697 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -94.4 | -18 | -173.8 | -177.9 | 0 | 0 | 0 | 0 | 113.5 | P52 | V50-P52 VanDerWaalsContact C-CD 3.41Š|
| 51 | Q | 54.1 | Low | 63.3 | Low | 115 Ų | 115 | 107.6 Ų | 107.6 | 54% | 0.537 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -67.2 | -31.4 | -175.8 | -73.2 | -117.2 | 7.5 | 0 | 0 | 117.4 | N53 | Q51-N53 PolarHBondContact O-N 3.48Å |
| 52 | P | 60.9 | Low | 65.6 | Low | 78 Ų | 78 | 103 Ų | 103 | 51% | 0.506 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -70.1 | -34.8 | -173.5 | 25.1 | -31.2 | 0 | 0 | 0 | 113 | A49 V50 R54 A56 | A49-P52 WeakPolarHBondContact O-CD 3.49Å; V50-P52 VanDerWaalsContact C-CD 3.41Å; P52-R54 PolarHBondContact O-N 2.93Å; P52-A56 PolarHBondContact O-N 3.4Å |
| 53 | N | 73.2 | Confident | 68.3 | Low | 125 Ų | 125 | 100.9 Ų | 100.9 | 67% | 0.668 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -69.9 | -37.5 | -172.7 | -67.4 | -0.3 | 0 | 0 | 0 | 113 | Q51 A56 L57 | Q51-N53 PolarHBondContact O-N 3.48Å; N53-A56 PolarHBondContact O-N 3.02Å; N53-L57 WeakPolarHBondContact O-CB 3.5Å; N53-L57 PolarHBondContact O-N 2.88Å |
| 54 | R | 80.5 | Confident | 70.6 | Confident | 177 Ų | 177 | 95.6 Ų | 95.6 | 67% | 0.668 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -65.9 | -42.4 | -178.9 | -77.2 | -176.4 | 153.8 | -168.1 | -6.5 | 112.8 | P52 L57 I58 | P52-R54 PolarHBondContact O-N 2.93Å; R54-L57 PolarHBondContact O-N 3.31Å; R54-I58 WeakPolarHBondContact O-CG1 3.43Å; R54-I58 PolarHBondContact O-N 3.4Å; R54-I58 VanDerWaalsContact O-N 3.09Å |
| 55 | K | 80.9 | Confident | 72.8 | Confident | 62 Ų | 62 | 95.2 Ų | 95.2 | 27% | 0.27 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.9 | -40.7 | 179.5 | -63.7 | -173 | -175.4 | -174.8 | 0 | 111.3 | L57 I58 K59 H269 | K55-L57 VanDerWaalsContact C-N 3.34Å; K55-I58 PolarHBondContact O-N 3.49Å; K55-K59 WeakPolarHBondContact O-CG 3.37Å; K55-K59 PolarHBondContact O-N 2.93Å; K55-H269 PolarHBondContact NZ-O 3.33Å |
| 56 | A | 84.6 | Confident | 74.9 | Confident | 59 Ų | 59 | 88.7 Ų | 88.7 | 49% | 0.488 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61 | -43.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | P52 N53 K59 Y60 | P52-A56 PolarHBondContact O-N 3.4Å; N53-A56 PolarHBondContact O-N 3.02Å; A56-K59 PolarHBondContact O-N 3.09Å; A56-Y60 WeakPolarHBondContact O-CB 3.23Å; A56-Y60 PolarHBondContact O-N 3.49Å |
| 57 | L | 88.1 | Confident | 77.2 | Confident | 109 Ų | 109 | 87.3 Ų | 87.3 | 57% | 0.571 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -59.9 | -49 | 176.5 | -179.1 | 64.7 | 0 | 0 | 0 | 112.1 | N53 R54 K55 K59 Y60 C61 | N53-L57 WeakPolarHBondContact O-CB 3.5Å; N53-L57 PolarHBondContact O-N 2.88Å; R54-L57 PolarHBondContact O-N 3.31Å; K55-L57 VanDerWaalsContact C-N 3.34Å; L57-K59 VanDerWaalsContact C-N 3.34Å; L57-K59 PolarHBondContact O-N 3.36Å; L57-Y60 WeakPolarHBondContact O-CB 3.42Å; L57-Y60 PolarHBondContact O-N 3.12Å; L57-C61 PolarHBondContact O-N 3.31Å; L57-C61 PolarHBondContact O-SG 3.49Å |
| 58 | I | 87.1 | Confident | 79.6 | Confident | 29 Ų | 29 | 82.8 Ų | 82.8 | 15% | 0.149 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -61.8 | -44 | -179.7 | -65.6 | 166.6 | 0 | 0 | 0 | 110.9 | R54 K55 Y60 C61 I62 L262 Y265 L266 | R54-I58 WeakPolarHBondContact O-CG1 3.43Å; R54-I58 PolarHBondContact O-N 3.4Å; R54-I58 VanDerWaalsContact O-N 3.09Å; K55-I58 PolarHBondContact O-N 3.49Å; I58-Y60 VanDerWaalsContact C-N 3.32Å; I58-Y60 PolarHBondContact O-N 2.72Å; I58-C61 PolarHBondContact O-N 2.85Å; I58-I62 HydrophobicContact CG2-CD1 3.96Å; I58-I62 HydrophobicContact CG2-CG1 4.42Å; I58-I62 WeakPolarHBondContact O-CG1 3.48Å; I58-I62 PolarHBondContact O-N 2.9Å; I58-L262 HydrophobicContact CD1-CD2 4.47Å; I58-L262 HydrophobicContact CG1-CD2 4.31Å; I58-L262 HydrophobicContact CG2-CB 4.08Å; I58-L262 HydrophobicContact CG2-CD1 4.29Å; I58-L262 HydrophobicContact CG2-CD2 3.95Å; I58-L262 HydrophobicContact CG2-CG 4.34Å; I58-Y265 HydrophobicContact CD1-CD1 3.56Å; I58-Y265 HydrophobicContact CD1-CE1 3.43Å; I58-Y265 VanDerWaalsContact CD1-CE1 3.43Å; I58-L266 HydrophobicContact CB-CD2 4.32Å; I58-L266 HydrophobicContact CG2-CD1 3.9Å; I58-L266 HydrophobicContact CG2-CD2 3.99Å; I58-L266 HydrophobicContact CG2-CG 3.76Å |
| 59 | K | 88.9 | Confident | 81.8 | Confident | 63 Ų | 63 | 79.8 Ų | 79.8 | 27% | 0.274 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -58.2 | -45.6 | 175.2 | -75.4 | -177.3 | 171.8 | -151.4 | 0 | 111.7 | K55 A56 L57 I62 F63 S132 L266 | K55-K59 WeakPolarHBondContact O-CG 3.37Å; K55-K59 PolarHBondContact O-N 2.93Å; A56-K59 PolarHBondContact O-N 3.09Å; L57-K59 VanDerWaalsContact C-N 3.34Å; L57-K59 PolarHBondContact O-N 3.36Å; K59-I62 PolarHBondContact O-N 2.78Å; K59-F63 VanDerWaalsContact O-CB 3.25Å; K59-F63 WeakPolarHBondContact O-CB 3.47Å; K59-F63 PolarHBondContact O-N 3.45Å; K59-S132 VanDerWaalsContact C-OG 3.31Å; K59-S132 VanDerWaalsContact CA-OG 3.27Å; K59-S132 WeakPolarHBondContact CA-OG 3.37Å; K59-S132 WeakPolarHBondContact CB-OG 3.45Å; K59-S132 PolarHBondContact O-OG 2.88Å; K59-L266 HydrophobicContact CG-CD1 3.98Å; K59-L266 HydrophobicContact CG-CD2 4.22Å |
| 60 | Y | 88.9 | Confident | 84.2 | Confident | 159 Ų | 159 | 77.4 Ų | 77.4 | 62% | 0.624 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -61.7 | -45.9 | 177.2 | -178.8 | -98 | 0 | 0 | 0 | 111.9 | A56 L57 I58 I62 F63 A64 | A56-Y60 WeakPolarHBondContact O-CB 3.23Å; A56-Y60 PolarHBondContact O-N 3.49Å; L57-Y60 WeakPolarHBondContact O-CB 3.42Å; L57-Y60 PolarHBondContact O-N 3.12Å; I58-Y60 VanDerWaalsContact C-N 3.32Å; I58-Y60 PolarHBondContact O-N 2.72Å; Y60-I62 PolarHBondContact O-N 2.79Å; Y60-F63 PolarHBondContact O-N 3.29Å; Y60-A64 WeakPolarHBondContact O-CB 3.24Å; Y60-A64 PolarHBondContact O-N 3.2Å |
| 61 | C | 88.8 | Confident | 86.4 | Confident | 57 Ų | 57 | 76.9 Ų | 76.9 | 39% | 0.385 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -60.5 | -47.1 | 177.9 | -66.6 | 0 | 0 | 0 | 0 | 112.2 | L57 I58 F63 F65 | L57-C61 PolarHBondContact O-N 3.31Å; L57-C61 PolarHBondContact O-SG 3.49Å; I58-C61 PolarHBondContact O-N 2.85Å; C61-F63 VanDerWaalsContact C-N 3.35Å; C61-F63 PolarHBondContact O-N 3.28Å; C61-F65 VanDerWaalsContact O-CB 3.31Å; C61-F65 WeakPolarHBondContact O-CB 3.25Å; C61-F65 PolarHBondContact O-N 2.9Å |
| 62 | I | 90.4 | Very high | 88.5 | Confident | 8 Ų | 8 | 74.8 Ų | 74.8 | 4% | 0.041 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -62 | -45.3 | 177 | -66.4 | 174.3 | 0 | 0 | 0 | 110 | I58 K59 Y60 F65 N66 L262 L266 | I58-I62 HydrophobicContact CG2-CD1 3.96Å; I58-I62 HydrophobicContact CG2-CG1 4.42Å; I58-I62 WeakPolarHBondContact O-CG1 3.48Å; I58-I62 PolarHBondContact O-N 2.9Å; K59-I62 PolarHBondContact O-N 2.78Å; Y60-I62 PolarHBondContact O-N 2.79Å; I62-F65 PolarHBondContact O-N 3.47Å; I62-N66 VanDerWaalsContact CG2-ND2 3.32Å; I62-N66 WeakPolarHBondContact CG2-ND2 3.27Å; I62-N66 WeakPolarHBondContact O-CB 3.25Å; I62-N66 PolarHBondContact O-N 3.43Å; I62-N66 PolarHBondContact O-ND2 3.3Å; I62-L262 HydrophobicContact CD1-CB 3.92Å; I62-L262 HydrophobicContact CG1-CB 4.3Å; I62-L262 HydrophobicContact CG1-CD1 4.18Å; I62-L266 HydrophobicContact CD1-CD1 3.47Å; I62-L266 VanDerWaalsContact CD1-CD1 3.47Å; I62-L266 HydrophobicContact CD1-CG 4.38Å |
| 63 | F | 92.3 | Very high | 90.2 | Very high | 66 Ų | 66 | 71 Ų | 71 | 29% | 0.289 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -62.8 | -48 | -179 | 179.9 | -104.8 | 0 | 0 | 0 | 111.9 | K59 Y60 C61 F65 N66 L67 C129 I133 | K59-F63 VanDerWaalsContact O-CB 3.25Å; K59-F63 WeakPolarHBondContact O-CB 3.47Å; K59-F63 PolarHBondContact O-N 3.45Å; Y60-F63 PolarHBondContact O-N 3.29Å; C61-F63 VanDerWaalsContact C-N 3.35Å; C61-F63 PolarHBondContact O-N 3.28Å; F63-F65 PolarHBondContact O-N 2.88Å; F63-N66 PolarHBondContact O-N 3.45Å; F63-L67 HydrophobicContact CE1-CD1 4.16Å; F63-L67 HydrophobicContact CZ-CD1 4.1Å; F63-L67 WeakPolarHBondContact O-CB 3.44Å; F63-L67 PolarHBondContact O-N 2.78Å; F63-C129 HydrophobicContact CD2-CB 4.22Å; F63-C129 HydrophobicContact CE2-CB 4.26Å; F63-I133 HydrophobicContact CD2-CD1 4.03Å; F63-I133 HydrophobicContact CD2-CG1 4.07Å; F63-I133 HydrophobicContact CE2-CD1 3.59Å; F63-I133 HydrophobicContact CE2-CG1 4.12Å; F63-I133 HydrophobicContact CZ-CD1 4.38Å |
| 64 | A | 91.8 | Very high | 91.4 | Very high | 33 Ų | 33 | 69 Ų | 69 | 27% | 0.273 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -61.4 | -45.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112 | Y60 L67 I68 | Y60-A64 WeakPolarHBondContact O-CB 3.24Å; Y60-A64 PolarHBondContact O-N 3.2Å; A64-L67 PolarHBondContact O-N 2.81Å; A64-I68 WeakPolarHBondContact O-CG1 3.08Å; A64-I68 PolarHBondContact O-N 3.3Å; A64-I68 VanDerWaalsContact O-N 3.12Å |
| 65 | F | 91.4 | Very high | 92.2 | Very high | 84 Ų | 84 | 62.5 Ų | 62.5 | 37% | 0.368 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -65.7 | -43.4 | 179.8 | -175.3 | -119.2 | 0 | 0 | 0 | 112.6 | C61 I62 F63 L67 I68 F69 | C61-F65 VanDerWaalsContact O-CB 3.31Å; C61-F65 WeakPolarHBondContact O-CB 3.25Å; C61-F65 PolarHBondContact O-N 2.9Å; I62-F65 PolarHBondContact O-N 3.47Å; F63-F65 PolarHBondContact O-N 2.88Å; F65-L67 VanDerWaalsContact C-N 3.31Å; F65-L67 PolarHBondContact O-N 3.27Å; F65-I68 PolarHBondContact O-N 3.48Å; F65-F69 HydrophobicContact CD1-CD2 4.03Å; F65-F69 AromaticContact CD1-CE2 3.67Å; F65-F69 HydrophobicContact CD1-CE2 3.67Å; F65-F69 HydrophobicContact CD2-CE2 4.28Å; F65-F69 AromaticContact CE1-CD2 3.91Å; F65-F69 HydrophobicContact CE1-CD2 3.91Å; F65-F69 AromaticContact CE1-CE2 3.09Å; F65-F69 HydrophobicContact CE1-CE2 3.09Å; F65-F69 AromaticContact CE1-CZ 3.86Å; F65-F69 HydrophobicContact CE1-CZ 3.86Å; F65-F69 HydrophobicContact CE2-CD2 4.46Å; F65-F69 AromaticContact CE2-CE2 3.73Å; F65-F69 HydrophobicContact CE2-CE2 3.73Å; F65-F69 AromaticContact CE2-CZ 3.9Å; F65-F69 HydrophobicContact CE2-CZ 3.9Å; F65-F69 HydrophobicContact CG-CD2 4.43Å; F65-F69 HydrophobicContact CG-CE2 4.25Å; F65-F69 HydrophobicContact CZ-CD2 4.12Å; F65-F69 AromaticContact CZ-CE2 3.1Å; F65-F69 HydrophobicContact CZ-CE2 3.1Å; F65-F69 AromaticContact CZ-CZ 3.37Å; F65-F69 HydrophobicContact CZ-CZ 3.37Å; F65-F69 PolarHBondContact O-N 2.89Å; F65-F69 VanDerWaalsContact O-N 3.15Å |
| 66 | N | 93.8 | Very high | 93 | Very high | 1 Ų | 1 | 61.8 Ų | 61.8 | 1% | 0.005 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -67.1 | -32.2 | 175.9 | -77.7 | -81.4 | 0 | 0 | 0 | 112.1 | I62 F63 F69 I70 S125 C129 Y143 | I62-N66 VanDerWaalsContact CG2-ND2 3.32Å; I62-N66 WeakPolarHBondContact CG2-ND2 3.27Å; I62-N66 WeakPolarHBondContact O-CB 3.25Å; I62-N66 PolarHBondContact O-N 3.43Å; I62-N66 PolarHBondContact O-ND2 3.3Å; F63-N66 PolarHBondContact O-N 3.45Å; N66-F69 PolarHBondContact O-N 3.04Å; N66-I70 WeakPolarHBondContact O-CG1 3.37Å; N66-I70 PolarHBondContact O-N 2.97Å; N66-S125 WeakPolarHBondContact OD1-CA 3.36Å; N66-C129 WeakPolarHBondContact CB-SG 3.3Å; N66-Y143 PolarHBondContact ND2-OH 3.43Å; N66-Y143 WeakPolarHBondContact OD1-CE2 3.42Å |
| 67 | L | 94.8 | Very high | 93.7 | Very high | 75 Ų | 75 | 60.7 Ų | 60.7 | 39% | 0.393 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64.6 | -40.4 | 173.9 | -172.9 | 145.5 | 0 | 0 | 0 | 111.8 | F63 A64 F65 F69 I70 I71 | F63-L67 HydrophobicContact CE1-CD1 4.16Å; F63-L67 HydrophobicContact CZ-CD1 4.1Å; F63-L67 WeakPolarHBondContact O-CB 3.44Å; F63-L67 PolarHBondContact O-N 2.78Å; A64-L67 PolarHBondContact O-N 2.81Å; F65-L67 VanDerWaalsContact C-N 3.31Å; F65-L67 PolarHBondContact O-N 3.27Å; L67-F69 VanDerWaalsContact C-N 3.34Å; L67-F69 PolarHBondContact O-N 3.36Å; L67-I70 PolarHBondContact O-N 2.83Å; L67-I71 HydrophobicContact CD2-CD1 3.62Å; L67-I71 HydrophobicContact CD2-CG1 4.44Å; L67-I71 WeakPolarHBondContact O-CG1 3.35Å; L67-I71 PolarHBondContact O-N 3.42Å; L67-I71 VanDerWaalsContact O-N 3.09Å |
| 68 | I | 95 | Very high | 94.1 | Very high | 98 Ų | 98 | 59.2 Ų | 59.2 | 50% | 0.503 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.1 | -45.9 | 173.7 | -65.7 | 165.2 | 0 | 0 | 0 | 110.3 | A64 F65 I70 I71 V72 | A64-I68 WeakPolarHBondContact O-CG1 3.08Å; A64-I68 PolarHBondContact O-N 3.3Å; A64-I68 VanDerWaalsContact O-N 3.12Å; F65-I68 PolarHBondContact O-N 3.48Å; I68-I70 VanDerWaalsContact C-N 3.35Å; I68-I70 PolarHBondContact O-N 3.43Å; I68-I71 PolarHBondContact O-N 3.16Å; I68-V72 HydrophobicContact CG2-CG2 4.43Å; I68-V72 WeakPolarHBondContact O-CG2 3.1Å; I68-V72 PolarHBondContact O-N 3.43Å |
| 69 | F | 95.1 | Very high | 94.4 | Very high | 73 Ų | 73 | 61.8 Ų | 61.8 | 32% | 0.32 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -66.2 | -33.4 | 178.6 | -78 | -52.2 | 0 | 0 | 0 | 114.2 | F65 N66 L67 I71 V72 G73 M121 S125 | F65-F69 HydrophobicContact CD1-CD2 4.03Å; F65-F69 AromaticContact CD1-CE2 3.67Å; F65-F69 HydrophobicContact CD1-CE2 3.67Å; F65-F69 HydrophobicContact CD2-CE2 4.28Å; F65-F69 AromaticContact CE1-CD2 3.91Å; F65-F69 HydrophobicContact CE1-CD2 3.91Å; F65-F69 AromaticContact CE1-CE2 3.09Å; F65-F69 HydrophobicContact CE1-CE2 3.09Å; F65-F69 AromaticContact CE1-CZ 3.86Å; F65-F69 HydrophobicContact CE1-CZ 3.86Å; F65-F69 HydrophobicContact CE2-CD2 4.46Å; F65-F69 AromaticContact CE2-CE2 3.73Å; F65-F69 HydrophobicContact CE2-CE2 3.73Å; F65-F69 AromaticContact CE2-CZ 3.9Å; F65-F69 HydrophobicContact CE2-CZ 3.9Å; F65-F69 HydrophobicContact CG-CD2 4.43Å; F65-F69 HydrophobicContact CG-CE2 4.25Å; F65-F69 HydrophobicContact CZ-CD2 4.12Å; F65-F69 AromaticContact CZ-CE2 3.1Å; F65-F69 HydrophobicContact CZ-CE2 3.1Å; F65-F69 AromaticContact CZ-CZ 3.37Å; F65-F69 HydrophobicContact CZ-CZ 3.37Å; F65-F69 PolarHBondContact O-N 2.89Å; F65-F69 VanDerWaalsContact O-N 3.15Å; N66-F69 PolarHBondContact O-N 3.04Å; L67-F69 VanDerWaalsContact C-N 3.34Å; L67-F69 PolarHBondContact O-N 3.36Å; F69-I71 VanDerWaalsContact C-N 3.34Å; F69-V72 PolarHBondContact O-N 3.37Å; F69-G73 PolarHBondContact O-N 2.88Å; F69-M121 HydrophobicContact CB-CE 4.47Å; F69-M121 HydrophobicContact CD1-CE 3.65Å; F69-M121 HydrophobicContact CE1-CE 4.35Å; F69-M121 HydrophobicContact CG-CE 4.48Å; F69-S125 WeakPolarHBondContact CB-OG 3.34Å |
| 70 | I | 97 | Very high | 94.7 | Very high | 39 Ų | 39 | 58.8 Ų | 58.8 | 20% | 0.2 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -61.2 | -46.6 | 171.4 | -71.7 | 171.3 | 0 | 0 | 0 | 109.9 | N66 L67 I68 V72 G73 I74 S125 | N66-I70 WeakPolarHBondContact O-CG1 3.37Å; N66-I70 PolarHBondContact O-N 2.97Å; L67-I70 PolarHBondContact O-N 2.83Å; I68-I70 VanDerWaalsContact C-N 3.35Å; I68-I70 PolarHBondContact O-N 3.43Å; I70-V72 PolarHBondContact O-N 3.34Å; I70-G73 PolarHBondContact O-N 3.45Å; I70-I74 HydrophobicContact CG2-CD1 3.7Å; I70-I74 HydrophobicContact CG2-CG1 4.33Å; I70-I74 WeakPolarHBondContact O-CB 3.38Å; I70-I74 VanDerWaalsContact O-CG1 3.27Å; I70-I74 WeakPolarHBondContact O-CG1 3.38Å; I70-I74 PolarHBondContact O-N 3.26Å; I70-S125 VanDerWaalsContact CG1-CB 3.49Å |
| 71 | I | 97.2 | Very high | 94.9 | Very high | 105 Ų | 105 | 54.5 Ų | 54.5 | 54% | 0.538 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -61.4 | -47.4 | 179.5 | -66.2 | 169.4 | 0 | 0 | 0 | 110.6 | L67 I68 F69 G73 I74 G75 | L67-I71 HydrophobicContact CD2-CD1 3.62Å; L67-I71 HydrophobicContact CD2-CG1 4.44Å; L67-I71 WeakPolarHBondContact O-CG1 3.35Å; L67-I71 PolarHBondContact O-N 3.42Å; L67-I71 VanDerWaalsContact O-N 3.09Å; I68-I71 PolarHBondContact O-N 3.16Å; F69-I71 VanDerWaalsContact C-N 3.34Å; I71-G73 PolarHBondContact O-N 3.07Å; I71-I74 PolarHBondContact O-N 3.48Å; I71-G75 PolarHBondContact O-N 3.44Å |
| 72 | V | 97.2 | Very high | 95.1 | Very high | 70 Ų | 70 | 56.2 Ų | 56.2 | 42% | 0.424 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.6 | -45.3 | 177.1 | 176.7 | 0 | 0 | 0 | 0 | 110.7 | I68 F69 I70 I74 G75 L76 M121 | I68-V72 HydrophobicContact CG2-CG2 4.43Å; I68-V72 WeakPolarHBondContact O-CG2 3.1Å; I68-V72 PolarHBondContact O-N 3.43Å; F69-V72 PolarHBondContact O-N 3.37Å; I70-V72 PolarHBondContact O-N 3.34Å; V72-I74 PolarHBondContact O-N 2.83Å; V72-G75 WeakPolarHBondContact O-CA 3.41Å; V72-G75 PolarHBondContact O-N 3.17Å; V72-G75 VanDerWaalsContact O-N 3.15Å; V72-L76 HydrophobicContact CG1-CD1 4.35Å; V72-L76 HydrophobicContact CG1-CG 4.46Å; V72-L76 WeakPolarHBondContact O-CG 3.45Å; V72-L76 PolarHBondContact O-N 3.25Å; V72-M121 HydrophobicContact CB-CE 4.08Å; V72-M121 HydrophobicContact CG1-CE 3.79Å |
| 73 | G | 97.8 | Very high | 95 | Very high | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -60.9 | -43.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | F69 I70 I71 G75 L76 V77 | F69-G73 PolarHBondContact O-N 2.88Å; I70-G73 PolarHBondContact O-N 3.45Å; I71-G73 PolarHBondContact O-N 3.07Å; G73-G75 VanDerWaalsContact C-N 3.33Å; G73-G75 PolarHBondContact O-N 3.13Å; G73-L76 PolarHBondContact O-N 3.04Å; G73-V77 WeakPolarHBondContact O-CG2 3.36Å; G73-V77 PolarHBondContact O-N 2.93Å |
| 74 | I | 98.2 | Very high | 94.8 | Very high | 82 Ų | 82 | 57.8 Ų | 57.8 | 42% | 0.421 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -60.5 | -44.9 | 173.5 | -69.1 | 167.5 | 0 | 0 | 0 | 110 | I70 I71 V72 L76 V77 C78 I122 | I70-I74 HydrophobicContact CG2-CD1 3.7Å; I70-I74 HydrophobicContact CG2-CG1 4.33Å; I70-I74 WeakPolarHBondContact O-CB 3.38Å; I70-I74 VanDerWaalsContact O-CG1 3.27Å; I70-I74 WeakPolarHBondContact O-CG1 3.38Å; I70-I74 PolarHBondContact O-N 3.26Å; I71-I74 PolarHBondContact O-N 3.48Å; V72-I74 PolarHBondContact O-N 2.83Å; I74-L76 VanDerWaalsContact C-N 3.35Å; I74-L76 PolarHBondContact O-N 3.4Å; I74-V77 PolarHBondContact O-N 3.27Å; I74-C78 WeakPolarHBondContact O-CB 3.4Å; I74-C78 PolarHBondContact O-N 3.49Å; I74-C78 PolarHBondContact O-SG 3.45Å; I74-I122 HydrophobicContact CG1-CD1 3.81Å; I74-I122 HydrophobicContact CG1-CG1 4.24Å |
| 75 | G | 97.8 | Very high | 94.6 | Very high | 41 Ų | 41 | 59.7 Ų | 59.7 | 42% | 0.423 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -57.2 | -44.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113 | I71 V72 G73 C78 L79 | I71-G75 PolarHBondContact O-N 3.44Å; V72-G75 WeakPolarHBondContact O-CA 3.41Å; V72-G75 PolarHBondContact O-N 3.17Å; V72-G75 VanDerWaalsContact O-N 3.15Å; G73-G75 VanDerWaalsContact C-N 3.33Å; G73-G75 PolarHBondContact O-N 3.13Å; G75-C78 PolarHBondContact O-N 3.07Å; G75-L79 VanDerWaalsContact O-CB 3.3Å; G75-L79 WeakPolarHBondContact O-CB 3.41Å; G75-L79 PolarHBondContact O-N 3.32Å |
| 76 | L | 97.9 | Very high | 94.4 | Very high | 46 Ų | 46 | 58.5 Ų | 58.5 | 24% | 0.241 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -65 | -42.8 | 176.9 | -67.2 | 177.6 | 0 | 0 | 0 | 112.5 | V72 G73 I74 L79 G80 L114 V117 M121 | V72-L76 HydrophobicContact CG1-CD1 4.35Å; V72-L76 HydrophobicContact CG1-CG 4.46Å; V72-L76 WeakPolarHBondContact O-CG 3.45Å; V72-L76 PolarHBondContact O-N 3.25Å; G73-L76 PolarHBondContact O-N 3.04Å; I74-L76 VanDerWaalsContact C-N 3.35Å; I74-L76 PolarHBondContact O-N 3.4Å; L76-L79 PolarHBondContact O-N 2.94Å; L76-G80 PolarHBondContact O-N 3.3Å; L76-L114 HydrophobicContact CD2-CD2 3.93Å; L76-V117 HydrophobicContact CD1-CG1 4.43Å; L76-M121 HydrophobicContact CD1-SD 3.67Å |
| 77 | V | 97.9 | Very high | 93.6 | Very high | 36 Ų | 36 | 64 Ų | 64 | 22% | 0.218 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -64.5 | -47.3 | 176.1 | 173.5 | 0 | 0 | 0 | 0 | 110.6 | G73 I74 L79 G80 V81 I122 | G73-V77 WeakPolarHBondContact O-CG2 3.36Å; G73-V77 PolarHBondContact O-N 2.93Å; I74-V77 PolarHBondContact O-N 3.27Å; V77-L79 VanDerWaalsContact C-N 3.32Å; V77-L79 PolarHBondContact O-N 3.12Å; V77-G80 PolarHBondContact O-N 3.09Å; V77-V81 HydrophobicContact CG1-CG2 4.15Å; V77-V81 WeakPolarHBondContact O-CB 3.33Å; V77-V81 VanDerWaalsContact O-CG2 3.27Å; V77-V81 WeakPolarHBondContact O-CG2 3.49Å; V77-V81 PolarHBondContact O-N 3.32Å; V77-I122 HydrophobicContact CG2-CD1 4.04Å |
| 78 | C | 96.6 | Very high | 92.9 | Very high | 78 Ų | 78 | 70.5 Ų | 70.5 | 53% | 0.527 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -58.6 | -44.7 | 176.8 | -72.7 | 0 | 0 | 0 | 0 | 111.3 | I74 G75 V81 F82 | I74-C78 WeakPolarHBondContact O-CB 3.4Å; I74-C78 PolarHBondContact O-N 3.49Å; I74-C78 PolarHBondContact O-SG 3.45Å; G75-C78 PolarHBondContact O-N 3.07Å; C78-V81 PolarHBondContact O-N 3.47Å; C78-F82 WeakPolarHBondContact O-CB 3.46Å; C78-F82 PolarHBondContact O-N 2.94Å |
| 79 | L | 94.5 | Very high | 92 | Very high | 83 Ų | 83 | 69 Ų | 69 | 44% | 0.435 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.5 | -46.7 | 176.1 | -179.5 | 61.7 | 0 | 0 | 0 | 111.6 | G75 L76 V77 F82 L83 L114 | G75-L79 VanDerWaalsContact O-CB 3.3Å; G75-L79 WeakPolarHBondContact O-CB 3.41Å; G75-L79 PolarHBondContact O-N 3.32Å; L76-L79 PolarHBondContact O-N 2.94Å; V77-L79 VanDerWaalsContact C-N 3.32Å; V77-L79 PolarHBondContact O-N 3.12Å; L79-F82 PolarHBondContact O-N 2.87Å; L79-L83 HydrophobicContact CD1-CD1 4.43Å; L79-L83 HydrophobicContact CD1-CG 4.38Å; L79-L83 HydrophobicContact CG-CD1 4.22Å; L79-L83 WeakPolarHBondContact O-CB 3.38Å; L79-L83 VanDerWaalsContact O-CG 3.26Å; L79-L83 WeakPolarHBondContact O-CG 3.4Å; L79-L83 PolarHBondContact O-N 2.98Å; L79-L114 HydrophobicContact CD2-CD1 4.26Å; L79-L114 HydrophobicContact CG-CD1 4.33Å |
| 80 | G | 93.9 | Very high | 90.9 | Very high | 0 Ų | 0 | 66.1 Ų | 66.1 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64.9 | -40.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | L76 V77 K84 | L76-G80 PolarHBondContact O-N 3.3Å; V77-G80 PolarHBondContact O-N 3.09Å; G80-K84 WeakPolarHBondContact O-CB 3.39Å; G80-K84 PolarHBondContact O-N 3.45Å; G80-K84 VanDerWaalsContact O-N 3.08Å |
| 81 | V | 94.5 | Very high | 89.7 | Confident | 70 Ų | 70 | 67.8 Ų | 67.8 | 42% | 0.424 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -66.6 | -41.3 | 174.1 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | V77 C78 K84 A85 I115 | V77-V81 HydrophobicContact CG1-CG2 4.15Å; V77-V81 WeakPolarHBondContact O-CB 3.33Å; V77-V81 VanDerWaalsContact O-CG2 3.27Å; V77-V81 WeakPolarHBondContact O-CG2 3.49Å; V77-V81 PolarHBondContact O-N 3.32Å; C78-V81 PolarHBondContact O-N 3.47Å; V81-K84 WeakPolarHBondContact O-CB 3.36Å; V81-K84 PolarHBondContact O-N 3.48Å; V81-K84 VanDerWaalsContact O-N 3.17Å; V81-A85 VanDerWaalsContact O-CB 3.27Å; V81-A85 WeakPolarHBondContact O-CB 3.22Å; V81-A85 PolarHBondContact O-N 3.04Å; V81-I115 HydrophobicContact CG2-CD1 4.02Å; V81-I115 HydrophobicContact CG2-CG1 4.19Å |
| 82 | F | 92.3 | Very high | 88.6 | Confident | 93 Ų | 93 | 68 Ų | 68 | 41% | 0.408 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -60.8 | -47.4 | 176.1 | -179.7 | -103.9 | 0 | 0 | 0 | 111.6 | C78 L79 K84 A85 D86 F89 | C78-F82 WeakPolarHBondContact O-CB 3.46Å; C78-F82 PolarHBondContact O-N 2.94Å; L79-F82 PolarHBondContact O-N 2.87Å; F82-K84 PolarHBondContact O-N 3.01Å; F82-A85 PolarHBondContact O-N 2.77Å; F82-D86 HydrophobicContact CE2-CB 4.19Å; F82-D86 HydrophobicContact CZ-CB 4.39Å; F82-D86 PolarHBondContact O-N 3.44Å; F82-F89 AromaticContact CD1-CD1 3.98Å; F82-F89 HydrophobicContact CD1-CD1 3.98Å; F82-F89 HydrophobicContact CD1-CE1 4.09Å; F82-F89 HydrophobicContact CE1-CB 4.23Å; F82-F89 AromaticContact CE1-CD1 3.38Å; F82-F89 HydrophobicContact CE1-CD1 3.38Å; F82-F89 HydrophobicContact CE1-CD2 4.07Å; F82-F89 AromaticContact CE1-CE1 3.58Å; F82-F89 HydrophobicContact CE1-CE1 3.58Å; F82-F89 HydrophobicContact CE1-CE2 4.27Å; F82-F89 AromaticContact CE1-CG 3.63Å; F82-F89 HydrophobicContact CE1-CG 3.63Å; F82-F89 HydrophobicContact CE1-CZ 4.05Å; F82-F89 HydrophobicContact CZ-CB 4.25Å; F82-F89 HydrophobicContact CZ-CD1 4.22Å; F82-F89 HydrophobicContact CZ-CD2 4.35Å; F82-F89 HydrophobicContact CZ-CG 4.02Å |
| 83 | L | 88.4 | Confident | 87.4 | Confident | 18 Ų | 18 | 66 Ų | 66 | 9% | 0.094 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60 | -30.9 | 174.7 | -71.1 | 172.2 | 0 | 0 | 0 | 113 | L79 F89 L93 A111 L114 | L79-L83 HydrophobicContact CD1-CD1 4.43Å; L79-L83 HydrophobicContact CD1-CG 4.38Å; L79-L83 HydrophobicContact CG-CD1 4.22Å; L79-L83 WeakPolarHBondContact O-CB 3.38Å; L79-L83 VanDerWaalsContact O-CG 3.26Å; L79-L83 WeakPolarHBondContact O-CG 3.4Å; L79-L83 PolarHBondContact O-N 2.98Å; L83-F89 HydrophobicContact CD2-CD1 4.03Å; L83-F89 HydrophobicContact CD2-CE1 3.73Å; L83-L93 HydrophobicContact CD2-CD1 3.42Å; L83-L93 VanDerWaalsContact CD2-CD1 3.42Å; L83-A111 HydrophobicContact CB-CB 3.98Å; L83-L114 HydrophobicContact CD1-CD1 3.67Å |
| 84 | K | 87.4 | Confident | 85.9 | Confident | 88 Ų | 88 | 66.8 Ų | 66.8 | 38% | 0.383 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -78.5 | -41.1 | 176.5 | 178.9 | -178.2 | 168 | 67.1 | 0 | 112.6 | G80 V81 F82 Y112 | G80-K84 WeakPolarHBondContact O-CB 3.39Å; G80-K84 PolarHBondContact O-N 3.45Å; G80-K84 VanDerWaalsContact O-N 3.08Å; V81-K84 WeakPolarHBondContact O-CB 3.36Å; V81-K84 PolarHBondContact O-N 3.48Å; V81-K84 VanDerWaalsContact O-N 3.17Å; F82-K84 PolarHBondContact O-N 3.01Å; K84-Y112 HydrophobicContact CD-CE1 4.47Å; K84-Y112 PolarHBondContact NZ-OH 3.5Å |
| 85 | A | 88.5 | Confident | 84.4 | Confident | 74 Ų | 74 | 69.3 Ų | 69.3 | 61% | 0.612 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -85.5 | -37.6 | -168.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | V81 F82 E87 | V81-A85 VanDerWaalsContact O-CB 3.27Å; V81-A85 WeakPolarHBondContact O-CB 3.22Å; V81-A85 PolarHBondContact O-N 3.04Å; F82-A85 PolarHBondContact O-N 2.77Å; A85-E87 PolarHBondContact O-N 3.5Å |
| 86 | D | 86.2 | Confident | 82.7 | Confident | 59 Ų | 59 | 74.2 Ų | 74.2 | 32% | 0.316 | 37% | 0.368 | S | S | . | . | trans | -90.4 | 93.6 | -177 | -166.3 | -26.1 | 0 | 0 | 0 | 110.2 | F82 R88 F89 R90 | F82-D86 HydrophobicContact CE2-CB 4.19Å; F82-D86 HydrophobicContact CZ-CB 4.39Å; F82-D86 PolarHBondContact O-N 3.44Å; D86-R88 PolarHBondContact O-N 3.46Å; D86-R88 WeakPolarHBondContact OD1-CB 3.27Å; D86-R88 PolarHBondContact OD1-N 3.21Å; D86-F89 HydrophobicContact CB-CB 3.79Å; D86-F89 VanDerWaalsContact CG-CB 3.49Å; D86-F89 PolarHBondContact O-N 3.39Å; D86-F89 PolarHBondContact OD1-N 2.84Å; D86-R90 WeakPolarHBondContact O-CB 3.31Å; D86-R90 PolarHBondContact O-N 2.92Å | ||
| 87 | E | 77.7 | Confident | 81 | Confident | 116 Ų | 116 | 78 Ų | 78 | 54% | 0.542 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61.9 | -34.6 | 177.4 | -52.5 | -156.3 | 125.6 | 0 | 0 | 111.7 | A85 R90 D91 | A85-E87 PolarHBondContact O-N 3.5Å; E87-R90 CarbonylContact O-C 3.3Å; E87-R90 WeakPolarHBondContact O-CB 3.32Å; E87-R90 PolarHBondContact O-N 2.92Å; E87-R90 IonicContact OE1-CZ 2.68Å; E87-R90 IonicContact OE1-NH1 3.9Å; E87-R90 IonicContact OE1-NH2 2.88Å; E87-R90 PolarHBondContact OE1-NH2 3.45Å; E87-D91 VanDerWaalsContact O-CB 3.31Å; E87-D91 WeakPolarHBondContact O-CB 3.32Å; E87-D91 PolarHBondContact O-N 3.38Å |
| 88 | R | 79.2 | Confident | 78.9 | Confident | 211 Ų | 211 | 82.7 Ų | 82.7 | 80% | 0.796 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -70.1 | -38.7 | 178.8 | -173.5 | -178.6 | -176.4 | -175.2 | 2.2 | 111.3 | D86 D91 F92 | D86-R88 PolarHBondContact O-N 3.46Å; D86-R88 WeakPolarHBondContact OD1-CB 3.27Å; D86-R88 PolarHBondContact OD1-N 3.21Å; R88-D91 PolarHBondContact O-N 2.93Å; R88-F92 VanDerWaalsContact O-CB 3.32Å; R88-F92 WeakPolarHBondContact O-CB 3.41Å; R88-F92 PolarHBondContact O-N 3.16Å |
| 89 | F | 77.5 | Confident | 76.7 | Confident | 67 Ų | 67 | 81.2 Ų | 81.2 | 29% | 0.294 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -69.1 | -38.2 | 173.1 | -173.3 | -106.3 | 0 | 0 | 0 | 111.2 | F82 L83 D86 D91 F92 L93 | F82-F89 AromaticContact CD1-CD1 3.98Å; F82-F89 HydrophobicContact CD1-CD1 3.98Å; F82-F89 HydrophobicContact CD1-CE1 4.09Å; F82-F89 HydrophobicContact CE1-CB 4.23Å; F82-F89 AromaticContact CE1-CD1 3.38Å; F82-F89 HydrophobicContact CE1-CD1 3.38Å; F82-F89 HydrophobicContact CE1-CD2 4.07Å; F82-F89 AromaticContact CE1-CE1 3.58Å; F82-F89 HydrophobicContact CE1-CE1 3.58Å; F82-F89 HydrophobicContact CE1-CE2 4.27Å; F82-F89 AromaticContact CE1-CG 3.63Å; F82-F89 HydrophobicContact CE1-CG 3.63Å; F82-F89 HydrophobicContact CE1-CZ 4.05Å; F82-F89 HydrophobicContact CZ-CB 4.25Å; F82-F89 HydrophobicContact CZ-CD1 4.22Å; F82-F89 HydrophobicContact CZ-CD2 4.35Å; F82-F89 HydrophobicContact CZ-CG 4.02Å; L83-F89 HydrophobicContact CD2-CD1 4.03Å; L83-F89 HydrophobicContact CD2-CE1 3.73Å; D86-F89 HydrophobicContact CB-CB 3.79Å; D86-F89 VanDerWaalsContact CG-CB 3.49Å; D86-F89 PolarHBondContact O-N 3.39Å; D86-F89 PolarHBondContact OD1-N 2.84Å; F89-D91 VanDerWaalsContact C-N 3.28Å; F89-D91 PolarHBondContact O-N 3.29Å; F89-F92 PolarHBondContact O-N 2.92Å; F89-L93 HydrophobicContact CD1-CD1 3.68Å; F89-L93 HydrophobicContact CD1-CG 4.05Å; F89-L93 HydrophobicContact CE1-CD1 3.26Å; F89-L93 HydrophobicContact CE1-CD2 4.31Å; F89-L93 HydrophobicContact CE1-CG 3.72Å; F89-L93 HydrophobicContact CE2-CG 4.44Å; F89-L93 HydrophobicContact CZ-CD1 3.9Å; F89-L93 HydrophobicContact CZ-CD2 4.1Å; F89-L93 HydrophobicContact CZ-CG 3.93Å; F89-L93 VanDerWaalsContact O-CB 3.31Å; F89-L93 WeakPolarHBondContact O-CB 3.5Å; F89-L93 WeakPolarHBondContact O-CG 3.3Å; F89-L93 PolarHBondContact O-N 3.15Å |
| 90 | R | 71.8 | Confident | 74.7 | Confident | 13 Ų | 13 | 81.3 Ų | 81.3 | 5% | 0.049 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -60.6 | -40.1 | 171.3 | -171.5 | 179.2 | 61.3 | -139.7 | 3 | 111.2 | D86 E87 S94 L107 Y108 | D86-R90 WeakPolarHBondContact O-CB 3.31Å; D86-R90 PolarHBondContact O-N 2.92Å; E87-R90 CarbonylContact O-C 3.3Å; E87-R90 WeakPolarHBondContact O-CB 3.32Å; E87-R90 PolarHBondContact O-N 2.92Å; E87-R90 IonicContact OE1-CZ 2.68Å; E87-R90 IonicContact OE1-NH1 3.9Å; E87-R90 IonicContact OE1-NH2 2.88Å; E87-R90 PolarHBondContact OE1-NH2 3.45Å; R90-S94 WeakPolarHBondContact O-CA 3.46Å; R90-S94 WeakPolarHBondContact O-CB 3.26Å; R90-S94 PolarHBondContact O-N 3.4Å; R90-S94 PolarHBondContact O-OG 2.92Å; R90-L107 HydrophobicContact CG-CD2 3.59Å; R90-L107 HydrophobicContact CG-CG 4.48Å; R90-Y108 VanDerWaalsContact CZ-OH 3.23Å; R90-Y108 PolarHBondContact NH1-OH 3.5Å |
| 91 | D | 71.5 | Confident | 72.7 | Confident | 73 Ų | 73 | 81.8 Ų | 81.8 | 39% | 0.39 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -72.6 | -36.4 | 177.9 | -67.7 | -17.4 | 0 | 0 | 0 | 111.8 | E87 R88 F89 S94 E95 | E87-D91 VanDerWaalsContact O-CB 3.31Å; E87-D91 WeakPolarHBondContact O-CB 3.32Å; E87-D91 PolarHBondContact O-N 3.38Å; R88-D91 PolarHBondContact O-N 2.93Å; F89-D91 VanDerWaalsContact C-N 3.28Å; F89-D91 PolarHBondContact O-N 3.29Å; D91-S94 VanDerWaalsContact CA-OG 3.27Å; D91-S94 WeakPolarHBondContact CA-OG 3.4Å; D91-S94 CarbonylContact O-C 3.55Å; D91-S94 PolarHBondContact O-N 2.96Å; D91-S94 PolarHBondContact O-OG 3.22Å; D91-E95 VanDerWaalsContact O-CB 3.25Å; D91-E95 WeakPolarHBondContact O-CB 3.27Å; D91-E95 PolarHBondContact O-N 3.17Å |
| 92 | F | 74.5 | Confident | 70.5 | Confident | 110 Ų | 110 | 80.3 Ų | 80.3 | 48% | 0.482 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -69.5 | -40.8 | 173.3 | 179.9 | -98.1 | 0 | 0 | 0 | 111.9 | R88 F89 S94 E95 K96 | R88-F92 VanDerWaalsContact O-CB 3.32Å; R88-F92 WeakPolarHBondContact O-CB 3.41Å; R88-F92 PolarHBondContact O-N 3.16Å; F89-F92 PolarHBondContact O-N 2.92Å; F92-S94 VanDerWaalsContact C-N 3.31Å; F92-E95 PolarHBondContact O-N 3.48Å; F92-K96 HydrophobicContact CE1-CD 4.3Å; F92-K96 VanDerWaalsContact O-CB 3.29Å; F92-K96 WeakPolarHBondContact O-CB 3.47Å; F92-K96 PolarHBondContact O-N 3.3Å |
| 93 | L | 71.3 | Confident | 68.6 | Low | 29 Ų | 29 | 79.4 Ų | 79.4 | 15% | 0.152 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.5 | -38.4 | 170.4 | -76.7 | -178.8 | 0 | 0 | 0 | 110.5 | L83 F89 E95 K96 Y97 L107 | L83-L93 HydrophobicContact CD2-CD1 3.42Å; L83-L93 VanDerWaalsContact CD2-CD1 3.42Å; F89-L93 HydrophobicContact CD1-CD1 3.68Å; F89-L93 HydrophobicContact CD1-CG 4.05Å; F89-L93 HydrophobicContact CE1-CD1 3.26Å; F89-L93 HydrophobicContact CE1-CD2 4.31Å; F89-L93 HydrophobicContact CE1-CG 3.72Å; F89-L93 HydrophobicContact CE2-CG 4.44Å; F89-L93 HydrophobicContact CZ-CD1 3.9Å; F89-L93 HydrophobicContact CZ-CD2 4.1Å; F89-L93 HydrophobicContact CZ-CG 3.93Å; F89-L93 VanDerWaalsContact O-CB 3.31Å; F89-L93 WeakPolarHBondContact O-CB 3.5Å; F89-L93 WeakPolarHBondContact O-CG 3.3Å; F89-L93 PolarHBondContact O-N 3.15Å; L93-E95 VanDerWaalsContact C-N 3.25Å; L93-E95 PolarHBondContact O-N 2.99Å; L93-K96 PolarHBondContact O-N 3.49Å; L93-Y97 HydrophobicContact CD2-CD2 3.9Å; L93-Y97 HydrophobicContact CD2-CE2 3.76Å; L93-Y97 VanDerWaalsContact O-CA 3.3Å; L93-Y97 WeakPolarHBondContact O-CA 3.5Å; L93-Y97 WeakPolarHBondContact O-CB 3.27Å; L93-Y97 WeakPolarHBondContact O-CD2 3.5Å; L93-Y97 PolarHBondContact O-N 3.47Å; L93-L107 HydrophobicContact CB-CD2 4.36Å |
| 94 | S | 65.8 | Low | 67 | Low | 16 Ų | 16 | 84.8 Ų | 84.8 | 11% | 0.112 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -72.7 | -18.5 | 174.7 | 82.7 | 0 | 0 | 0 | 0 | 112.6 | R90 D91 F92 R98 | R90-S94 WeakPolarHBondContact O-CA 3.46Å; R90-S94 WeakPolarHBondContact O-CB 3.26Å; R90-S94 PolarHBondContact O-N 3.4Å; R90-S94 PolarHBondContact O-OG 2.92Å; D91-S94 VanDerWaalsContact CA-OG 3.27Å; D91-S94 WeakPolarHBondContact CA-OG 3.4Å; D91-S94 CarbonylContact O-C 3.55Å; D91-S94 PolarHBondContact O-N 2.96Å; D91-S94 PolarHBondContact O-OG 3.22Å; F92-S94 VanDerWaalsContact C-N 3.31Å; S94-R98 WeakPolarHBondContact O-CA 3.49Å; S94-R98 WeakPolarHBondContact O-CB 3.36Å; S94-R98 WeakPolarHBondContact O-CG 3.32Å; S94-R98 PolarHBondContact O-N 2.85Å |
| 95 | E | 66.8 | Low | 65.9 | Low | 135 Ų | 135 | 85 Ų | 85 | 63% | 0.631 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -84.2 | -41.2 | 171.6 | -173.7 | 174.9 | -160.9 | 0 | 0 | 110.9 | D91 F92 L93 R98 | D91-E95 VanDerWaalsContact O-CB 3.25Å; D91-E95 WeakPolarHBondContact O-CB 3.27Å; D91-E95 PolarHBondContact O-N 3.17Å; F92-E95 PolarHBondContact O-N 3.48Å; L93-E95 VanDerWaalsContact C-N 3.25Å; L93-E95 PolarHBondContact O-N 2.99Å; E95-R98 WeakPolarHBondContact O-CB 3.47Å |
| 96 | K | 63.6 | Low | 65 | Low | 144 Ų | 144 | 85.2 Ų | 85.2 | 63% | 0.626 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -76.4 | -35.9 | 179.8 | -168.8 | 175.4 | -176.7 | -179.9 | 0 | 112.9 | F92 L93 | F92-K96 HydrophobicContact CE1-CD 4.3Å; F92-K96 VanDerWaalsContact O-CB 3.29Å; F92-K96 WeakPolarHBondContact O-CB 3.47Å; F92-K96 PolarHBondContact O-N 3.3Å; L93-K96 PolarHBondContact O-N 3.49Å |
| 97 | Y | 61.9 | Low | 64.3 | Low | 124 Ų | 124 | 84.1 Ų | 84.1 | 49% | 0.486 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.1 | 32.6 | 172.9 | -59.7 | -89 | 0 | 0 | 0 | 110.2 | L93 S99 V100 A101 | L93-Y97 HydrophobicContact CD2-CD2 3.9Å; L93-Y97 HydrophobicContact CD2-CE2 3.76Å; L93-Y97 VanDerWaalsContact O-CA 3.3Å; L93-Y97 WeakPolarHBondContact O-CA 3.5Å; L93-Y97 WeakPolarHBondContact O-CB 3.27Å; L93-Y97 WeakPolarHBondContact O-CD2 3.5Å; L93-Y97 PolarHBondContact O-N 3.47Å; Y97-S99 PolarHBondContact O-N 2.85Å; Y97-V100 CarbonylContact O-C 3.52Å; Y97-V100 WeakPolarHBondContact O-CA 3.34Å; Y97-V100 PolarHBondContact O-N 3.33Å; Y97-A101 WeakPolarHBondContact O-CB 3.42Å; Y97-A101 PolarHBondContact O-N 3.4Å |
| 98 | R | 52.1 | Low | 64.4 | Low | 136 Ų | 136 | 81.9 Ų | 81.9 | 51% | 0.513 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -50.4 | -29.7 | 177.4 | -163.5 | 170 | 177.5 | 93.7 | 10 | 113.8 | S94 E95 V100 N102 | S94-R98 WeakPolarHBondContact O-CA 3.49Å; S94-R98 WeakPolarHBondContact O-CB 3.36Å; S94-R98 WeakPolarHBondContact O-CG 3.32Å; S94-R98 PolarHBondContact O-N 2.85Å; E95-R98 WeakPolarHBondContact O-CB 3.47Å; R98-V100 PolarHBondContact O-N 3.45Å; R98-N102 WeakPolarHBondContact CG-ND2 3.43Å; R98-N102 PolarHBondContact O-ND2 3.28Å |
| 99 | S | 51.4 | Low | 64.7 | Low | 47 Ų | 47 | 75.8 Ų | 75.8 | 33% | 0.329 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -68 | -31 | 174.2 | 67.3 | 0 | 0 | 0 | 0 | 113.1 | Y97 E192 A193 A196 | Y97-S99 PolarHBondContact O-N 2.85Å; S99-E192 CarbonylContact O-C 3.37Å; S99-E192 VanDerWaalsContact O-C 3.3Å; S99-A193 WeakPolarHBondContact O-CA 3.4Å; S99-A196 VanDerWaalsContact C-CB 3.42Å; S99-A196 WeakPolarHBondContact O-CB 3.19Å; S99-A196 WeakPolarHBondContact OG-CB 3.19Å |
| 100 | V | 52 | Low | 65.1 | Low | 85 Ų | 85 | 73.9 Ų | 73.9 | 52% | 0.515 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -106.3 | -29.3 | -177.8 | -174.5 | 0 | 0 | 0 | 0 | 113.7 | Y97 R98 A196 | Y97-V100 CarbonylContact O-C 3.52Å; Y97-V100 WeakPolarHBondContact O-CA 3.34Å; Y97-V100 PolarHBondContact O-N 3.33Å; R98-V100 PolarHBondContact O-N 3.45Å; V100-A196 HydrophobicContact CG2-CB 3.99Å |
| 101 | A | 52.6 | Low | 66 | Low | 10 Ų | 10 | 73.4 Ų | 73.4 | 8% | 0.083 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -103.6 | 1.6 | -164.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | Y97 Q103 | Y97-A101 WeakPolarHBondContact O-CB 3.42Å; Y97-A101 PolarHBondContact O-N 3.4Å; A101-Q103 CarbonylContact O-C 3.43Å; A101-Q103 VanDerWaalsContact O-C 3.28Å; A101-Q103 PolarHBondContact O-N 3.3Å; A101-Q103 VanDerWaalsContact O-N 3.17Å |
| 102 | N | 48.4 | Very low | 67 | Low | 39 Ų | 39 | 75.8 Ų | 75.8 | 21% | 0.209 | 37% | 0.368 | C | S | . | . | S | Bend | trans | -70.4 | -6.4 | 179.3 | -99.1 | -42.1 | 0 | 0 | 0 | 114.8 | R98 E192 | R98-N102 WeakPolarHBondContact CG-ND2 3.43Å; R98-N102 PolarHBondContact O-ND2 3.28Å; N102-E192 HydrophobicContact CB-CB 4.32Å; N102-E192 WeakPolarHBondContact CB-OE2 3.38Å; N102-E192 PolarHBondContact ND2-OE1 2.84Å; N102-E192 PolarHBondContact ND2-OE2 3.4Å |
| 103 | Q | 51.6 | Low | 68 | Low | 73 Ų | 73 | 75.5 Ų | 75.5 | 34% | 0.341 | 37% | 0.371 | S | S | . | . | S | Bend | trans | -95.2 | 106.3 | 150.9 | -119.2 | 171.4 | 3.1 | 0 | 0 | 107.9 | A101 D105 V106 I189 | A101-Q103 CarbonylContact O-C 3.43Å; A101-Q103 VanDerWaalsContact O-C 3.28Å; A101-Q103 PolarHBondContact O-N 3.3Å; A101-Q103 VanDerWaalsContact O-N 3.17Å; Q103-D105 HydrophobicContact CB-CB 4.32Å; Q103-D105 HydrophobicContact CG-CB 4.27Å; Q103-D105 PolarHBondContact O-N 3.42Å; Q103-V106 HydrophobicContact CB-CG2 4.34Å; Q103-V106 PolarHBondContact O-N 3.33Å; Q103-I189 HydrophobicContact CB-CD1 4.18Å; Q103-I189 HydrophobicContact CB-CG1 3.82Å; Q103-I189 HydrophobicContact CG-CB 4.45Å; Q103-I189 HydrophobicContact CG-CD1 3.86Å; Q103-I189 HydrophobicContact CG-CG1 3.61Å |
| 104 | Y | 54.5 | Low | 69.1 | Low | 131 Ų | 131 | 76.4 Ų | 76.4 | 51% | 0.514 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -38 | -37.1 | 162.7 | -70.5 | -79 | 0 | 0 | 0 | 110.7 | V106 L107 Y108 | Y104-V106 PolarHBondContact O-N 2.81Å; Y104-L107 PolarHBondContact O-N 3.26Å; Y104-Y108 VanDerWaalsContact C-CD2 3.45Å; Y104-Y108 HydrophobicContact CD1-CE2 4.15Å; Y104-Y108 HydrophobicContact CG-CE2 4.37Å; Y104-Y108 WeakPolarHBondContact O-CB 3.34Å; Y104-Y108 WeakPolarHBondContact O-CD2 3.32Å; Y104-Y108 PolarHBondContact O-N 3.35Å |
| 105 | D | 66.1 | Low | 70.6 | Confident | 93 Ų | 93 | 77.8 Ų | 77.8 | 50% | 0.497 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -55.7 | -44.1 | 178.9 | -58.4 | -30.1 | 0 | 0 | 0 | 114.6 | Q103 Y108 V109 | Q103-D105 HydrophobicContact CB-CB 4.32Å; Q103-D105 HydrophobicContact CG-CB 4.27Å; Q103-D105 PolarHBondContact O-N 3.42Å; D105-Y108 PolarHBondContact O-N 3.4Å; D105-V109 VanDerWaalsContact O-CB 3.22Å; D105-V109 WeakPolarHBondContact O-CB 3.48Å; D105-V109 WeakPolarHBondContact O-CG2 3.28Å; D105-V109 PolarHBondContact O-N 2.8Å |
| 106 | V | 67.9 | Low | 72 | Confident | 78 Ų | 78 | 74.3 Ų | 74.3 | 47% | 0.473 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -69.8 | -44.4 | -175.5 | -179.7 | 0 | 0 | 0 | 0 | 110.8 | Q103 Y104 G110 | Q103-V106 HydrophobicContact CB-CG2 4.34Å; Q103-V106 PolarHBondContact O-N 3.33Å; Y104-V106 PolarHBondContact O-N 2.81Å; V106-G110 PolarHBondContact O-N 3.49Å |
| 107 | L | 72.6 | Confident | 73.6 | Confident | 36 Ų | 36 | 71.2 Ų | 71.2 | 19% | 0.188 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -71 | -35.9 | 178.2 | -170.4 | 58.4 | 0 | 0 | 0 | 111.2 | R90 L93 Y104 G110 A111 | R90-L107 HydrophobicContact CG-CD2 3.59Å; R90-L107 HydrophobicContact CG-CG 4.48Å; L93-L107 HydrophobicContact CB-CD2 4.36Å; Y104-L107 PolarHBondContact O-N 3.26Å; L107-G110 PolarHBondContact O-N 2.91Å; L107-A111 WeakPolarHBondContact O-CB 3.34Å; L107-A111 PolarHBondContact O-N 3.15Å |
| 108 | Y | 79.1 | Confident | 75.3 | Confident | 69 Ų | 69 | 65.3 Ų | 65.3 | 27% | 0.271 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -63.2 | -50.4 | 172.1 | -86.4 | -60.9 | 0 | 0 | 0 | 111.5 | R90 Y104 D105 G110 A111 Y112 | R90-Y108 VanDerWaalsContact CZ-OH 3.23Å; R90-Y108 PolarHBondContact NH1-OH 3.5Å; Y104-Y108 VanDerWaalsContact C-CD2 3.45Å; Y104-Y108 HydrophobicContact CD1-CE2 4.15Å; Y104-Y108 HydrophobicContact CG-CE2 4.37Å; Y104-Y108 WeakPolarHBondContact O-CB 3.34Å; Y104-Y108 WeakPolarHBondContact O-CD2 3.32Å; Y104-Y108 PolarHBondContact O-N 3.35Å; D105-Y108 PolarHBondContact O-N 3.4Å; Y108-G110 VanDerWaalsContact C-N 3.29Å; Y108-G110 PolarHBondContact O-N 2.96Å; Y108-A111 PolarHBondContact O-N 2.69Å; Y108-Y112 HydrophobicContact CD1-CE2 4.34Å; Y108-Y112 WeakPolarHBondContact O-CD2 3.35Å; Y108-Y112 PolarHBondContact O-N 2.98Å |
| 109 | V | 85.1 | Confident | 77.4 | Confident | 83 Ų | 83 | 59.9 Ų | 59.9 | 50% | 0.503 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -58.8 | -44.9 | 176.9 | 170.7 | 0 | 0 | 0 | 0 | 109.7 | D105 A111 Y112 L113 | D105-V109 VanDerWaalsContact O-CB 3.22Å; D105-V109 WeakPolarHBondContact O-CB 3.48Å; D105-V109 WeakPolarHBondContact O-CG2 3.28Å; D105-V109 PolarHBondContact O-N 2.8Å; V109-A111 PolarHBondContact O-N 3.19Å; V109-Y112 PolarHBondContact O-N 3.2Å; V109-L113 HydrophobicContact CG1-CD1 3.91Å; V109-L113 HydrophobicContact CG1-CG 4.23Å; V109-L113 WeakPolarHBondContact O-CB 3.45Å; V109-L113 VanDerWaalsContact O-CG 3.27Å; V109-L113 WeakPolarHBondContact O-CG 3.43Å; V109-L113 PolarHBondContact O-N 2.94Å |
| 110 | G | 87 | Confident | 79.5 | Confident | 28 Ų | 28 | 60 Ų | 60 | 29% | 0.289 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -57.6 | -46.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | V106 L107 Y108 L113 L114 | V106-G110 PolarHBondContact O-N 3.49Å; L107-G110 PolarHBondContact O-N 2.91Å; Y108-G110 VanDerWaalsContact C-N 3.29Å; Y108-G110 PolarHBondContact O-N 2.96Å; G110-L113 PolarHBondContact O-N 3.18Å; G110-L114 WeakPolarHBondContact O-CG 3.47Å; G110-L114 PolarHBondContact O-N 3.44Å |
| 111 | A | 90.5 | Very high | 81.7 | Confident | 3 Ų | 3 | 58 Ų | 58 | 3% | 0.025 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -62.2 | -44.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | L83 L107 Y108 V109 L113 L114 I115 | L83-A111 HydrophobicContact CB-CB 3.98Å; L107-A111 WeakPolarHBondContact O-CB 3.34Å; L107-A111 PolarHBondContact O-N 3.15Å; Y108-A111 PolarHBondContact O-N 2.69Å; V109-A111 PolarHBondContact O-N 3.19Å; A111-L113 PolarHBondContact O-N 3.48Å; A111-L114 PolarHBondContact O-N 3.3Å; A111-I115 VanDerWaalsContact O-CG1 3.3Å; A111-I115 WeakPolarHBondContact O-CG1 3.27Å; A111-I115 PolarHBondContact O-N 2.97Å |
| 112 | Y | 93 | Very high | 83.8 | Confident | 123 Ų | 123 | 59.9 Ų | 59.9 | 48% | 0.482 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -64.2 | -38.5 | 175.7 | -75.6 | -65.9 | 0 | 0 | 0 | 112.5 | K84 Y108 V109 I115 A116 | K84-Y112 HydrophobicContact CD-CE1 4.47Å; K84-Y112 PolarHBondContact NZ-OH 3.5Å; Y108-Y112 HydrophobicContact CD1-CE2 4.34Å; Y108-Y112 WeakPolarHBondContact O-CD2 3.35Å; Y108-Y112 PolarHBondContact O-N 2.98Å; V109-Y112 PolarHBondContact O-N 3.2Å; Y112-I115 PolarHBondContact O-N 3.36Å; Y112-A116 VanDerWaalsContact O-CB 3.28Å; Y112-A116 WeakPolarHBondContact O-CB 3.35Å; Y112-A116 PolarHBondContact O-N 3.36Å |
| 113 | L | 94.1 | Very high | 86.1 | Confident | 104 Ų | 104 | 62.9 Ų | 62.9 | 55% | 0.545 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -64 | -43.1 | 174.8 | -72.6 | 175.2 | 0 | 0 | 0 | 111.4 | V109 G110 A111 I115 A116 V117 | V109-L113 HydrophobicContact CG1-CD1 3.91Å; V109-L113 HydrophobicContact CG1-CG 4.23Å; V109-L113 WeakPolarHBondContact O-CB 3.45Å; V109-L113 VanDerWaalsContact O-CG 3.27Å; V109-L113 WeakPolarHBondContact O-CG 3.43Å; V109-L113 PolarHBondContact O-N 2.94Å; G110-L113 PolarHBondContact O-N 3.18Å; A111-L113 PolarHBondContact O-N 3.48Å; L113-I115 PolarHBondContact O-N 2.9Å; L113-A116 PolarHBondContact O-N 2.87Å; L113-V117 WeakPolarHBondContact O-CB 3.17Å; L113-V117 VanDerWaalsContact O-CG2 3.26Å; L113-V117 WeakPolarHBondContact O-CG2 3.35Å; L113-V117 PolarHBondContact O-N 2.78Å |
| 114 | L | 95.3 | Very high | 88.1 | Confident | 48 Ų | 48 | 60.4 Ų | 60.4 | 25% | 0.251 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -59.9 | -44.2 | 174.9 | -73.1 | 169.6 | 0 | 0 | 0 | 111.8 | L76 L79 L83 G110 A111 G118 | L76-L114 HydrophobicContact CD2-CD2 3.93Å; L79-L114 HydrophobicContact CD2-CD1 4.26Å; L79-L114 HydrophobicContact CG-CD1 4.33Å; L83-L114 HydrophobicContact CD1-CD1 3.67Å; G110-L114 WeakPolarHBondContact O-CG 3.47Å; G110-L114 PolarHBondContact O-N 3.44Å; A111-L114 PolarHBondContact O-N 3.3Å; L114-G118 PolarHBondContact O-N 3.02Å |
| 115 | I | 96.6 | Very high | 90 | Very high | 45 Ų | 45 | 54.4 Ų | 54.4 | 23% | 0.231 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64 | -46.8 | 176.4 | -65.3 | 168.1 | 0 | 0 | 0 | 110.7 | V81 A111 Y112 L113 G119 | V81-I115 HydrophobicContact CG2-CD1 4.02Å; V81-I115 HydrophobicContact CG2-CG1 4.19Å; A111-I115 VanDerWaalsContact O-CG1 3.3Å; A111-I115 WeakPolarHBondContact O-CG1 3.27Å; A111-I115 PolarHBondContact O-N 2.97Å; Y112-I115 PolarHBondContact O-N 3.36Å; L113-I115 PolarHBondContact O-N 2.9Å; I115-G119 PolarHBondContact O-N 3.18Å |
| 116 | A | 96.6 | Very high | 91.4 | Very high | 62 Ų | 62 | 55.3 Ų | 55.3 | 51% | 0.512 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64.8 | -48.4 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y112 L113 G119 A120 | Y112-A116 VanDerWaalsContact O-CB 3.28Å; Y112-A116 WeakPolarHBondContact O-CB 3.35Å; Y112-A116 PolarHBondContact O-N 3.36Å; L113-A116 PolarHBondContact O-N 2.87Å; A116-G119 PolarHBondContact O-N 2.96Å; A116-A120 WeakPolarHBondContact O-CB 3.41Å; A116-A120 PolarHBondContact O-N 3.47Å |
| 117 | V | 96.3 | Very high | 92.5 | Very high | 79 Ų | 79 | 54.2 Ų | 54.2 | 48% | 0.479 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -64.7 | -47.8 | 178.2 | 173.4 | 0 | 0 | 0 | 0 | 110.5 | L76 L113 G119 A120 M121 | L76-V117 HydrophobicContact CD1-CG1 4.43Å; L113-V117 WeakPolarHBondContact O-CB 3.17Å; L113-V117 VanDerWaalsContact O-CG2 3.26Å; L113-V117 WeakPolarHBondContact O-CG2 3.35Å; L113-V117 PolarHBondContact O-N 2.78Å; V117-G119 VanDerWaalsContact C-N 3.35Å; V117-G119 PolarHBondContact O-N 3.23Å; V117-A120 PolarHBondContact O-N 3.5Å; V117-M121 HydrophobicContact CG1-SD 4.15Å; V117-M121 VanDerWaalsContact O-CG 3.3Å; V117-M121 WeakPolarHBondContact O-CG 3.39Å; V117-M121 PolarHBondContact O-N 3.4Å |
| 118 | G | 97.7 | Very high | 93.5 | Very high | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.8 | -42.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L114 M121 I122 | L114-G118 PolarHBondContact O-N 3.02Å; G118-M121 PolarHBondContact O-N 2.85Å; G118-I122 VanDerWaalsContact O-CG1 3.32Å; G118-I122 WeakPolarHBondContact O-CG1 3.32Å; G118-I122 PolarHBondContact O-N 2.93Å; G118-I122 VanDerWaalsContact O-N 3.08Å |
| 119 | G | 97.5 | Very high | 94.1 | Very high | 22 Ų | 22 | 49.9 Ų | 49.9 | 23% | 0.227 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.3 | -45.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | I115 A116 V117 M121 I122 I123 | I115-G119 PolarHBondContact O-N 3.18Å; A116-G119 PolarHBondContact O-N 2.96Å; V117-G119 VanDerWaalsContact C-N 3.35Å; V117-G119 PolarHBondContact O-N 3.23Å; G119-M121 VanDerWaalsContact C-N 3.34Å; G119-M121 PolarHBondContact O-N 3.45Å; G119-I122 PolarHBondContact O-N 2.73Å; G119-I123 WeakPolarHBondContact O-CG1 3.33Å; G119-I123 PolarHBondContact O-N 3.5Å |
| 120 | A | 96 | Very high | 94.3 | Very high | 50 Ų | 50 | 47 Ų | 47 | 41% | 0.413 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.3 | -43.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A116 V117 I122 I123 V124 | A116-A120 WeakPolarHBondContact O-CB 3.41Å; A116-A120 PolarHBondContact O-N 3.47Å; V117-A120 PolarHBondContact O-N 3.5Å; A120-I122 PolarHBondContact O-N 2.94Å; A120-I123 PolarHBondContact O-N 2.82Å; A120-V124 WeakPolarHBondContact O-CG2 3.3Å; A120-V124 PolarHBondContact O-N 3.43Å |
| 121 | M | 96.3 | Very high | 94.3 | Very high | 43 Ų | 43 | 45.9 Ų | 45.9 | 21% | 0.212 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -58.1 | -45.4 | 175.5 | -72.8 | 175.8 | 66.5 | 0 | 0 | 112.1 | F69 V72 L76 V117 G118 G119 S125 | F69-M121 HydrophobicContact CB-CE 4.47Å; F69-M121 HydrophobicContact CD1-CE 3.65Å; F69-M121 HydrophobicContact CE1-CE 4.35Å; F69-M121 HydrophobicContact CG-CE 4.48Å; V72-M121 HydrophobicContact CB-CE 4.08Å; V72-M121 HydrophobicContact CG1-CE 3.79Å; L76-M121 HydrophobicContact CD1-SD 3.67Å; V117-M121 HydrophobicContact CG1-SD 4.15Å; V117-M121 VanDerWaalsContact O-CG 3.3Å; V117-M121 WeakPolarHBondContact O-CG 3.39Å; V117-M121 PolarHBondContact O-N 3.4Å; G118-M121 PolarHBondContact O-N 2.85Å; G119-M121 VanDerWaalsContact C-N 3.34Å; G119-M121 PolarHBondContact O-N 3.45Å; M121-S125 WeakPolarHBondContact O-CB 3.17Å; M121-S125 PolarHBondContact O-N 2.89Å; M121-S125 PolarHBondContact O-OG 3.49Å |
| 122 | I | 97.3 | Very high | 94.1 | Very high | 49 Ų | 49 | 46 Ų | 46 | 25% | 0.251 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -62.3 | -46.8 | 178.3 | -66.1 | 164 | 0 | 0 | 0 | 110.6 | I74 V77 G118 G119 A120 S125 F126 | I74-I122 HydrophobicContact CG1-CD1 3.81Å; I74-I122 HydrophobicContact CG1-CG1 4.24Å; V77-I122 HydrophobicContact CG2-CD1 4.04Å; G118-I122 VanDerWaalsContact O-CG1 3.32Å; G118-I122 WeakPolarHBondContact O-CG1 3.32Å; G118-I122 PolarHBondContact O-N 2.93Å; G118-I122 VanDerWaalsContact O-N 3.08Å; G119-I122 PolarHBondContact O-N 2.73Å; A120-I122 PolarHBondContact O-N 2.94Å; I122-S125 PolarHBondContact O-N 2.85Å; I122-F126 VanDerWaalsContact O-CB 3.3Å; I122-F126 WeakPolarHBondContact O-CB 3.43Å; I122-F126 PolarHBondContact O-N 2.83Å |
| 123 | I | 95.9 | Very high | 93.7 | Very high | 102 Ų | 102 | 45.6 Ų | 45.6 | 52% | 0.523 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -62.4 | -50.2 | -177.9 | -68.5 | 166.6 | 0 | 0 | 0 | 110.9 | G119 A120 S125 F126 F127 | G119-I123 WeakPolarHBondContact O-CG1 3.33Å; G119-I123 PolarHBondContact O-N 3.5Å; A120-I123 PolarHBondContact O-N 2.82Å; I123-S125 VanDerWaalsContact C-N 3.32Å; I123-S125 PolarHBondContact O-N 3.26Å; I123-F126 WeakPolarHBondContact O-CB 3.3Å; I123-F126 PolarHBondContact O-N 3.28Å; I123-F127 HydrophobicContact CG2-CD2 4.22Å; I123-F127 HydrophobicContact CG2-CE2 3.61Å; I123-F127 HydrophobicContact CG2-CZ 4.45Å; I123-F127 WeakPolarHBondContact O-CD2 3.48Å; I123-F127 PolarHBondContact O-N 2.92Å |
| 124 | V | 95.2 | Very high | 92.8 | Very high | 21 Ų | 21 | 44.7 Ų | 44.7 | 13% | 0.127 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -62.1 | -43.7 | 179.5 | 174.6 | 0 | 0 | 0 | 0 | 110.4 | A120 F126 F127 G128 Y143 C146 L147 L150 | A120-V124 WeakPolarHBondContact O-CG2 3.3Å; A120-V124 PolarHBondContact O-N 3.43Å; V124-F126 VanDerWaalsContact C-N 3.34Å; V124-F126 PolarHBondContact O-N 2.94Å; V124-F127 PolarHBondContact O-N 3.08Å; V124-G128 PolarHBondContact O-N 3.44Å; V124-Y143 HydrophobicContact CG1-CD2 4.18Å; V124-Y143 HydrophobicContact CG1-CE2 4.09Å; V124-Y143 WeakPolarHBondContact O-CD2 3.48Å; V124-C146 HydrophobicContact CG1-CB 4.21Å; V124-C146 HydrophobicContact CG2-CB 4.06Å; V124-L147 HydrophobicContact CG1-CD2 4.21Å; V124-L150 HydrophobicContact CG1-CD1 4.44Å; V124-L150 HydrophobicContact CG2-CD1 4.37Å |
| 125 | S | 94.7 | Very high | 91.4 | Very high | 5 Ų | 5 | 47.1 Ų | 47.1 | 4% | 0.035 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -69.1 | -32.1 | -179.1 | -55.3 | 0 | 0 | 0 | 0 | 113.1 | N66 F69 I70 M121 I122 I123 G128 C129 | N66-S125 WeakPolarHBondContact OD1-CA 3.36Å; F69-S125 WeakPolarHBondContact CB-OG 3.34Å; I70-S125 VanDerWaalsContact CG1-CB 3.49Å; M121-S125 WeakPolarHBondContact O-CB 3.17Å; M121-S125 PolarHBondContact O-N 2.89Å; M121-S125 PolarHBondContact O-OG 3.49Å; I122-S125 PolarHBondContact O-N 2.85Å; I123-S125 VanDerWaalsContact C-N 3.32Å; I123-S125 PolarHBondContact O-N 3.26Å; S125-G128 PolarHBondContact O-N 3.44Å; S125-C129 PolarHBondContact O-N 3.38Å; S125-C129 PolarHBondContact O-SG 3.46Å |
| 126 | F | 93.4 | Very high | 90.4 | Very high | 112 Ų | 112 | 50.8 Ų | 50.8 | 49% | 0.491 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -60.2 | -45.4 | 173.3 | 178 | -99.3 | 0 | 0 | 0 | 111.3 | I122 I123 V124 G128 C129 C130 | I122-F126 VanDerWaalsContact O-CB 3.3Å; I122-F126 WeakPolarHBondContact O-CB 3.43Å; I122-F126 PolarHBondContact O-N 2.83Å; I123-F126 WeakPolarHBondContact O-CB 3.3Å; I123-F126 PolarHBondContact O-N 3.28Å; V124-F126 VanDerWaalsContact C-N 3.34Å; V124-F126 PolarHBondContact O-N 2.94Å; F126-G128 VanDerWaalsContact C-N 3.3Å; F126-G128 PolarHBondContact O-N 3.42Å; F126-C129 PolarHBondContact O-N 3.27Å; F126-C130 WeakPolarHBondContact CZ-SG 3.49Å; F126-C130 WeakPolarHBondContact O-CB 3.49Å; F126-C130 PolarHBondContact O-N 3.45Å; F126-C130 PolarHBondContact O-SG 3.26Å; F126-C130 VanDerWaalsContact O-SG 3.37Å |
| 127 | F | 92.7 | Very high | 89.5 | Confident | 55 Ų | 55 | 49.8 Ų | 49.8 | 24% | 0.241 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.5 | -38.3 | 174.1 | -65.5 | -57.1 | 0 | 0 | 0 | 112.3 | I123 V124 G131 M139 | I123-F127 HydrophobicContact CG2-CD2 4.22Å; I123-F127 HydrophobicContact CG2-CE2 3.61Å; I123-F127 HydrophobicContact CG2-CZ 4.45Å; I123-F127 WeakPolarHBondContact O-CD2 3.48Å; I123-F127 PolarHBondContact O-N 2.92Å; V124-F127 PolarHBondContact O-N 3.08Å; F127-G131 PolarHBondContact O-N 3.34Å; F127-M139 HydrophobicContact CD1-SD 3.87Å; F127-M139 HydrophobicContact CE1-SD 4.2Å |
| 128 | G | 92.2 | Very high | 89 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -63.5 | -46.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | V124 S125 F126 S132 Y143 | V124-G128 PolarHBondContact O-N 3.44Å; S125-G128 PolarHBondContact O-N 3.44Å; F126-G128 VanDerWaalsContact C-N 3.3Å; F126-G128 PolarHBondContact O-N 3.42Å; G128-S132 WeakPolarHBondContact O-CB 3.4Å; G128-S132 PolarHBondContact O-N 3.27Å; G128-Y143 VanDerWaalsContact CA-CD2 3.5Å |
| 129 | C | 91.6 | Very high | 88.6 | Confident | 13 Ų | 13 | 53.4 Ų | 53.4 | 9% | 0.088 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.5 | -50.6 | 175.8 | -74.7 | 0 | 0 | 0 | 0 | 111.9 | F63 N66 S125 F126 G131 S132 I133 | F63-C129 HydrophobicContact CD2-CB 4.22Å; F63-C129 HydrophobicContact CE2-CB 4.26Å; N66-C129 WeakPolarHBondContact CB-SG 3.3Å; S125-C129 PolarHBondContact O-N 3.38Å; S125-C129 PolarHBondContact O-SG 3.46Å; F126-C129 PolarHBondContact O-N 3.27Å; C129-G131 PolarHBondContact O-N 2.98Å; C129-S132 PolarHBondContact O-N 3.31Å; C129-I133 WeakPolarHBondContact O-CG1 3.38Å; C129-I133 PolarHBondContact O-N 3.03Å; C129-I133 VanDerWaalsContact O-N 3.07Å |
| 130 | C | 89.9 | Confident | 88.2 | Confident | 22 Ų | 22 | 52.8 Ų | 52.8 | 15% | 0.149 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -62.2 | -42.6 | 178.2 | -71.1 | 0 | 0 | 0 | 0 | 111.8 | F126 S132 Q134 | F126-C130 WeakPolarHBondContact CZ-SG 3.49Å; F126-C130 WeakPolarHBondContact O-CB 3.49Å; F126-C130 PolarHBondContact O-N 3.45Å; F126-C130 PolarHBondContact O-SG 3.26Å; F126-C130 VanDerWaalsContact O-SG 3.37Å; C130-S132 VanDerWaalsContact C-N 3.31Å; C130-S132 PolarHBondContact O-N 2.93Å; C130-Q134 VanDerWaalsContact O-CB 3.24Å; C130-Q134 WeakPolarHBondContact O-CB 3.42Å; C130-Q134 WeakPolarHBondContact O-CG 3.2Å; C130-Q134 PolarHBondContact O-N 3.48Å |
| 131 | G | 86.8 | Confident | 87.9 | Confident | 6 Ų | 6 | 53.7 Ų | 53.7 | 6% | 0.062 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -67.2 | -26.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114 | F127 C129 Q134 | F127-G131 PolarHBondContact O-N 3.34Å; C129-G131 PolarHBondContact O-N 2.98Å; G131-Q134 VanDerWaalsContact O-O 3.1Å |
| 132 | S | 86.4 | Confident | 87.7 | Confident | 5 Ų | 5 | 53.8 Ų | 53.8 | 4% | 0.035 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -79.3 | -43.7 | 175.8 | -174.3 | 0 | 0 | 0 | 0 | 112.6 | K59 G128 C129 C130 | K59-S132 VanDerWaalsContact C-OG 3.31Å; K59-S132 VanDerWaalsContact CA-OG 3.27Å; K59-S132 WeakPolarHBondContact CA-OG 3.37Å; K59-S132 WeakPolarHBondContact CB-OG 3.45Å; K59-S132 PolarHBondContact O-OG 2.88Å; G128-S132 WeakPolarHBondContact O-CB 3.4Å; G128-S132 PolarHBondContact O-N 3.27Å; C129-S132 PolarHBondContact O-N 3.31Å; C130-S132 VanDerWaalsContact C-N 3.31Å; C130-S132 PolarHBondContact O-N 2.93Å |
| 133 | I | 84 | Confident | 87.5 | Confident | 114 Ų | 114 | 51.8 Ų | 51.8 | 59% | 0.585 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -70.9 | -49.7 | 179.5 | -65.1 | 169.6 | 0 | 0 | 0 | 110.5 | F63 C129 | F63-I133 HydrophobicContact CD2-CD1 4.03Å; F63-I133 HydrophobicContact CD2-CG1 4.07Å; F63-I133 HydrophobicContact CE2-CD1 3.59Å; F63-I133 HydrophobicContact CE2-CG1 4.12Å; F63-I133 HydrophobicContact CZ-CD1 4.38Å; C129-I133 WeakPolarHBondContact O-CG1 3.38Å; C129-I133 PolarHBondContact O-N 3.03Å; C129-I133 VanDerWaalsContact O-N 3.07Å |
| 134 | Q | 75.5 | Confident | 87.4 | Confident | 86 Ų | 86 | 49.7 Ų | 49.7 | 40% | 0.402 | 26% | 0.264 | S | S | . | . | S | Bend | trans | -89.3 | 149.4 | -173.2 | -57.3 | 179.1 | 1.1 | 0 | 0 | 110.9 | C130 G131 H136 | C130-Q134 VanDerWaalsContact O-CB 3.24Å; C130-Q134 WeakPolarHBondContact O-CB 3.42Å; C130-Q134 WeakPolarHBondContact O-CG 3.2Å; C130-Q134 PolarHBondContact O-N 3.48Å; G131-Q134 VanDerWaalsContact O-O 3.1Å; Q134-H136 PolarHBondContact O-N 2.89Å; Q134-H136 PolarHBondContact OE1-CD2 3.25Å |
| 135 | L | 65.9 | Low | 87.4 | Confident | 99 Ų | 99 | 52.9 Ų | 52.9 | 52% | 0.518 | 28% | 0.279 | S | S | . | . | trans | -81.6 | 10.2 | 176.5 | -150.7 | 66.5 | 0 | 0 | 0 | 112.6 | S137 G270 P272 | L135-S137 PolarHBondContact O-N 2.98Å; L135-S137 VanDerWaalsContact O-N 3.17Å; L135-G270 WeakPolarHBondContact CD1-O 3.35Å; L135-P272 HydrophobicContact CD2-CG 3.54Å; L135-P272 HydrophobicContact CG-CG 4.39Å | ||
| 136 | H | 76 | Confident | 87.4 | Confident | 122 Ų | 122 | 54.4 Ų | 54.4 | 57% | 0.565 | 29% | 0.289 | S | S | * | . | trans | -78.3 | 101.2 | -178.8 | -69 | -63.6 | 0 | 0 | 0 | 110.4 | Q134 C138 M139 | Q134-H136 PolarHBondContact O-N 2.89Å; Q134-H136 PolarHBondContact OE1-CD2 3.25Å; H136-C138 PolarHBondContact O-N 3.43Å; H136-C138 VanDerWaalsContact O-N 3.07Å; H136-M139 PolarHBondContact O-N 3.25Å; H136-M139 VanDerWaalsContact O-N 3.13Å | ||
| 137 | S | 78.9 | Confident | 87.5 | Confident | 41 Ų | 41 | 49.7 Ų | 49.7 | 29% | 0.287 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -55 | -28.6 | 177.3 | -50.4 | 0 | 0 | 0 | 0 | 113.3 | L135 M139 L140 V141 V271 | L135-S137 PolarHBondContact O-N 2.98Å; L135-S137 VanDerWaalsContact O-N 3.17Å; S137-M139 PolarHBondContact O-N 3.42Å; S137-L140 PolarHBondContact O-N 3.34Å; S137-V141 VanDerWaalsContact O-CG2 3.28Å; S137-V141 WeakPolarHBondContact O-CG2 3.49Å; S137-V141 PolarHBondContact O-N 3.42Å; S137-V271 VanDerWaalsContact OG-CG2 3.22Å; S137-V271 WeakPolarHBondContact OG-CG2 2.94Å |
| 138 | C | 85.5 | Confident | 87.7 | Confident | 90 Ų | 90 | 50.4 Ų | 50.4 | 61% | 0.608 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -57.1 | -45.7 | 177.7 | -168 | 0 | 0 | 0 | 0 | 112.2 | H136 L140 V141 T142 | H136-C138 PolarHBondContact O-N 3.43Å; H136-C138 VanDerWaalsContact O-N 3.07Å; C138-L140 VanDerWaalsContact C-N 3.32Å; C138-L140 PolarHBondContact O-N 3.33Å; C138-V141 PolarHBondContact O-N 2.89Å; C138-T142 WeakPolarHBondContact O-CG2 3.29Å; C138-T142 PolarHBondContact O-N 2.89Å; C138-T142 PolarHBondContact O-OG1 2.95Å |
| 139 | M | 89.1 | Confident | 87.9 | Confident | 65 Ų | 65 | 53.9 Ų | 53.9 | 32% | 0.32 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -68.2 | -32.2 | -178.2 | -68.1 | -63.2 | 167.9 | 0 | 0 | 112.9 | F127 H136 S137 T142 Y143 | F127-M139 HydrophobicContact CD1-SD 3.87Å; F127-M139 HydrophobicContact CE1-SD 4.2Å; H136-M139 PolarHBondContact O-N 3.25Å; H136-M139 VanDerWaalsContact O-N 3.13Å; S137-M139 PolarHBondContact O-N 3.42Å; M139-T142 VanDerWaalsContact C-OG1 3.31Å; M139-T142 VanDerWaalsContact CA-OG1 3.32Å; M139-T142 WeakPolarHBondContact CA-OG1 3.45Å; M139-T142 PolarHBondContact O-OG1 3.33Å; M139-Y143 WeakPolarHBondContact O-CB 3.3Å; M139-Y143 PolarHBondContact O-N 3.13Å |
| 140 | L | 88.2 | Confident | 88.1 | Confident | 8 Ų | 8 | 56.7 Ų | 56.7 | 4% | 0.042 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -75.7 | -34.6 | 177.1 | -166.6 | 68.7 | 0 | 0 | 0 | 111.7 | S137 C138 Y143 F144 A263 L266 A267 | S137-L140 PolarHBondContact O-N 3.34Å; C138-L140 VanDerWaalsContact C-N 3.32Å; C138-L140 PolarHBondContact O-N 3.33Å; L140-Y143 PolarHBondContact O-N 3.47Å; L140-F144 WeakPolarHBondContact O-CB 3.44Å; L140-F144 PolarHBondContact O-N 2.94Å; L140-A263 HydrophobicContact CD1-CB 4.1Å; L140-A263 VanDerWaalsContact CD2-O 3.26Å; L140-A263 WeakPolarHBondContact CD2-O 3.42Å; L140-A263 HydrophobicContact CG-CB 4.35Å; L140-L266 HydrophobicContact CD2-CB 3.5Å; L140-L266 VanDerWaalsContact CD2-CB 3.5Å; L140-A267 HydrophobicContact CD2-CB 3.82Å; L140-A267 HydrophobicContact CG-CB 4.44Å |
| 141 | V | 89.4 | Confident | 88.5 | Confident | 70 Ų | 70 | 57.5 Ų | 57.5 | 42% | 0.424 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -67.6 | -41.8 | 172.4 | 171.6 | 0 | 0 | 0 | 0 | 110.7 | S137 C138 Y143 F144 I145 | S137-V141 VanDerWaalsContact O-CG2 3.28Å; S137-V141 WeakPolarHBondContact O-CG2 3.49Å; S137-V141 PolarHBondContact O-N 3.42Å; C138-V141 PolarHBondContact O-N 2.89Å; V141-Y143 VanDerWaalsContact C-N 3.35Å; V141-F144 WeakPolarHBondContact O-CB 3.27Å; V141-F144 PolarHBondContact O-N 3.18Å; V141-I145 HydrophobicContact CG1-CD1 3.84Å; V141-I145 HydrophobicContact CG1-CG1 4.4Å; V141-I145 VanDerWaalsContact O-CG1 3.3Å; V141-I145 WeakPolarHBondContact O-CG1 3.42Å; V141-I145 PolarHBondContact O-N 3.4Å |
| 142 | T | 92.5 | Very high | 89 | Confident | 44 Ų | 44 | 60.9 Ų | 60.9 | 27% | 0.27 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.8 | -43 | 174.2 | 52.8 | 0 | 0 | 0 | 0 | 111.2 | C138 M139 F144 I145 C146 | C138-T142 WeakPolarHBondContact O-CG2 3.29Å; C138-T142 PolarHBondContact O-N 2.89Å; C138-T142 PolarHBondContact O-OG1 2.95Å; M139-T142 VanDerWaalsContact C-OG1 3.31Å; M139-T142 VanDerWaalsContact CA-OG1 3.32Å; M139-T142 WeakPolarHBondContact CA-OG1 3.45Å; M139-T142 PolarHBondContact O-OG1 3.33Å; T142-F144 VanDerWaalsContact C-N 3.34Å; T142-F144 PolarHBondContact O-N 3.07Å; T142-I145 PolarHBondContact O-N 3.04Å; T142-C146 WeakPolarHBondContact O-CB 3.24Å; T142-C146 PolarHBondContact O-N 2.86Å; T142-C146 PolarHBondContact O-SG 2.9Å |
| 143 | Y | 93.6 | Very high | 89.4 | Confident | 8 Ų | 8 | 65 Ų | 65 | 3% | 0.031 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -57.4 | -45.5 | 173.2 | 176.7 | -108.3 | 0 | 0 | 0 | 112.2 | N66 V124 G128 M139 L140 V141 C146 L147 A263 | N66-Y143 PolarHBondContact ND2-OH 3.43Å; N66-Y143 WeakPolarHBondContact OD1-CE2 3.42Å; V124-Y143 HydrophobicContact CG1-CD2 4.18Å; V124-Y143 HydrophobicContact CG1-CE2 4.09Å; V124-Y143 WeakPolarHBondContact O-CD2 3.48Å; G128-Y143 VanDerWaalsContact CA-CD2 3.5Å; M139-Y143 WeakPolarHBondContact O-CB 3.3Å; M139-Y143 PolarHBondContact O-N 3.13Å; L140-Y143 PolarHBondContact O-N 3.47Å; V141-Y143 VanDerWaalsContact C-N 3.35Å; Y143-C146 PolarHBondContact O-N 3.02Å; Y143-L147 HydrophobicContact CD1-CD1 4.18Å; Y143-L147 HydrophobicContact CE1-CD1 3.51Å; Y143-L147 HydrophobicContact CE1-CG 4.23Å; Y143-L147 HydrophobicContact CE2-CD1 4.24Å; Y143-L147 HydrophobicContact CE2-CD2 4.32Å; Y143-L147 HydrophobicContact CE2-CG 4.19Å; Y143-L147 WeakPolarHBondContact O-CG 3.26Å; Y143-L147 PolarHBondContact O-N 3.46Å; Y143-A263 HydrophobicContact CD1-CB 3.88Å; Y143-A263 HydrophobicContact CE1-CB 4.13Å |
| 144 | F | 94 | Very high | 90 | Very high | 58 Ų | 58 | 61.4 Ų | 61.4 | 25% | 0.254 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -60.2 | -46 | 175.3 | 174.2 | -91.9 | 0 | 0 | 0 | 112.5 | L140 V141 T142 C146 L147 L148 M260 A263 L264 | L140-F144 WeakPolarHBondContact O-CB 3.44Å; L140-F144 PolarHBondContact O-N 2.94Å; V141-F144 WeakPolarHBondContact O-CB 3.27Å; V141-F144 PolarHBondContact O-N 3.18Å; T142-F144 VanDerWaalsContact C-N 3.34Å; T142-F144 PolarHBondContact O-N 3.07Å; F144-C146 VanDerWaalsContact C-N 3.34Å; F144-C146 PolarHBondContact O-N 3.28Å; F144-L147 PolarHBondContact O-N 3.27Å; F144-L148 HydrophobicContact CE1-CD2 4.3Å; F144-L148 WeakPolarHBondContact O-CB 3.38Å; F144-L148 PolarHBondContact O-N 2.96Å; F144-M260 HydrophobicContact CD2-CB 4.07Å; F144-M260 HydrophobicContact CD2-CG 4.17Å; F144-M260 HydrophobicContact CE2-CB 3.96Å; F144-M260 HydrophobicContact CE2-CG 4.22Å; F144-M260 HydrophobicContact CE2-SD 4.41Å; F144-A263 HydrophobicContact CB-CB 4.46Å; F144-L264 HydrophobicContact CE2-CB 4.45Å |
| 145 | I | 95 | Very high | 90.9 | Very high | 88 Ų | 88 | 60.9 Ų | 60.9 | 45% | 0.451 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -62.4 | -42.9 | 178 | -67.5 | 166.6 | 0 | 0 | 0 | 110.4 | V141 T142 L148 C149 | V141-I145 HydrophobicContact CG1-CD1 3.84Å; V141-I145 HydrophobicContact CG1-CG1 4.4Å; V141-I145 VanDerWaalsContact O-CG1 3.3Å; V141-I145 WeakPolarHBondContact O-CG1 3.42Å; V141-I145 PolarHBondContact O-N 3.4Å; T142-I145 PolarHBondContact O-N 3.04Å; I145-L148 PolarHBondContact O-N 3.37Å; I145-C149 PolarHBondContact O-N 3.06Å; I145-C149 PolarHBondContact O-SG 3.08Å |
| 146 | C | 95.5 | Very high | 92.4 | Very high | 36 Ų | 36 | 59 Ų | 59 | 24% | 0.243 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -59.6 | -48.1 | 175.8 | -70.3 | 0 | 0 | 0 | 0 | 112 | V124 T142 Y143 F144 L148 C149 L150 | V124-C146 HydrophobicContact CG1-CB 4.21Å; V124-C146 HydrophobicContact CG2-CB 4.06Å; T142-C146 WeakPolarHBondContact O-CB 3.24Å; T142-C146 PolarHBondContact O-N 2.86Å; T142-C146 PolarHBondContact O-SG 2.9Å; Y143-C146 PolarHBondContact O-N 3.02Å; F144-C146 VanDerWaalsContact C-N 3.34Å; F144-C146 PolarHBondContact O-N 3.28Å; C146-L148 VanDerWaalsContact C-N 3.31Å; C146-L148 PolarHBondContact O-N 3.24Å; C146-C149 PolarHBondContact O-N 2.83Å; C146-L150 WeakPolarHBondContact O-CG 3.33Å; C146-L150 PolarHBondContact O-N 3.31Å |
| 147 | L | 95.3 | Very high | 93.3 | Very high | 13 Ų | 13 | 57.9 Ų | 57.9 | 7% | 0.068 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -62.2 | -38.6 | 176.2 | -70.4 | -173.3 | 0 | 0 | 0 | 112.2 | V124 Y143 F144 L150 F151 M260 | V124-L147 HydrophobicContact CG1-CD2 4.21Å; Y143-L147 HydrophobicContact CD1-CD1 4.18Å; Y143-L147 HydrophobicContact CE1-CD1 3.51Å; Y143-L147 HydrophobicContact CE1-CG 4.23Å; Y143-L147 HydrophobicContact CE2-CD1 4.24Å; Y143-L147 HydrophobicContact CE2-CD2 4.32Å; Y143-L147 HydrophobicContact CE2-CG 4.19Å; Y143-L147 WeakPolarHBondContact O-CG 3.26Å; Y143-L147 PolarHBondContact O-N 3.46Å; F144-L147 PolarHBondContact O-N 3.27Å; L147-L150 HydrophobicContact CD2-CD1 4.45Å; L147-L150 PolarHBondContact O-N 2.87Å; L147-F151 WeakPolarHBondContact O-CB 3.36Å; L147-F151 PolarHBondContact O-N 2.91Å; L147-M260 HydrophobicContact CB-CG 3.63Å; L147-M260 HydrophobicContact CB-SD 4.24Å; L147-M260 HydrophobicContact CD1-CG 3.95Å; L147-M260 HydrophobicContact CG-CG 4.49Å |
| 148 | L | 96.6 | Very high | 94 | Very high | 71 Ų | 71 | 56.9 Ų | 56.9 | 37% | 0.372 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.8 | -42.4 | 176.6 | -179.5 | 63.3 | 0 | 0 | 0 | 111.6 | F144 I145 C146 F151 V152 M260 | F144-L148 HydrophobicContact CE1-CD2 4.3Å; F144-L148 WeakPolarHBondContact O-CB 3.38Å; F144-L148 PolarHBondContact O-N 2.96Å; I145-L148 PolarHBondContact O-N 3.37Å; C146-L148 VanDerWaalsContact C-N 3.31Å; C146-L148 PolarHBondContact O-N 3.24Å; L148-F151 PolarHBondContact O-N 3.47Å; L148-V152 WeakPolarHBondContact O-CG2 3.34Å; L148-V152 PolarHBondContact O-N 3.31Å; L148-M260 HydrophobicContact CB-SD 4.19Å; L148-M260 HydrophobicContact CD1-SD 4.32Å |
| 149 | C | 96.9 | Very high | 94.4 | Very high | 72 Ų | 72 | 54.8 Ų | 54.8 | 49% | 0.486 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -61.4 | -46.2 | 174.3 | -69.8 | 0 | 0 | 0 | 0 | 111.4 | I145 C146 F151 V152 T153 | I145-C149 PolarHBondContact O-N 3.06Å; I145-C149 PolarHBondContact O-SG 3.08Å; C146-C149 PolarHBondContact O-N 2.83Å; C149-F151 PolarHBondContact O-N 2.85Å; C149-V152 PolarHBondContact O-N 3.17Å; C149-T153 WeakPolarHBondContact O-CB 3.48Å; C149-T153 PolarHBondContact O-N 2.95Å; C149-T153 PolarHBondContact O-OG1 3.3Å; C149-T153 VanDerWaalsContact O-OG1 3.08Å |
| 150 | L | 95.9 | Very high | 94.7 | Very high | 73 Ų | 73 | 56.3 Ų | 56.3 | 38% | 0.382 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -59.1 | -46.3 | 176.7 | -70.6 | 176.4 | 0 | 0 | 0 | 111.6 | V124 C146 L147 V152 T153 Q154 | V124-L150 HydrophobicContact CG1-CD1 4.44Å; V124-L150 HydrophobicContact CG2-CD1 4.37Å; C146-L150 WeakPolarHBondContact O-CG 3.33Å; C146-L150 PolarHBondContact O-N 3.31Å; L147-L150 HydrophobicContact CD2-CD1 4.45Å; L147-L150 PolarHBondContact O-N 2.87Å; L150-V152 PolarHBondContact O-N 3.47Å; L150-T153 PolarHBondContact O-N 3.38Å; L150-Q154 VanDerWaalsContact O-CB 3.24Å; L150-Q154 WeakPolarHBondContact O-CB 3.44Å; L150-Q154 PolarHBondContact O-N 3.01Å |
| 151 | F | 97.2 | Very high | 94.9 | Very high | 38 Ų | 38 | 59.3 Ų | 59.3 | 17% | 0.167 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -57.6 | -47.2 | 177.4 | -178.7 | -97.4 | 0 | 0 | 0 | 112.2 | L147 L148 C149 Q154 L155 L253 E256 L257 M260 | L147-F151 WeakPolarHBondContact O-CB 3.36Å; L147-F151 PolarHBondContact O-N 2.91Å; L148-F151 PolarHBondContact O-N 3.47Å; C149-F151 PolarHBondContact O-N 2.85Å; F151-Q154 PolarHBondContact O-N 2.99Å; F151-L155 HydrophobicContact CD1-CD1 3.86Å; F151-L155 HydrophobicContact CE1-CD1 3.3Å; F151-L155 HydrophobicContact CE1-CG 4.24Å; F151-L155 HydrophobicContact CE2-CD1 4.4Å; F151-L155 HydrophobicContact CZ-CD1 3.62Å; F151-L155 HydrophobicContact CZ-CG 4.31Å; F151-L155 WeakPolarHBondContact O-CB 3.38Å; F151-L155 WeakPolarHBondContact O-CG 3.27Å; F151-L155 PolarHBondContact O-N 3.27Å; F151-L253 HydrophobicContact CD2-CD2 3.62Å; F151-L253 HydrophobicContact CE2-CB 4.36Å; F151-L253 HydrophobicContact CE2-CD2 3.7Å; F151-E256 WeakPolarHBondContact CA-OE2 3.12Å; F151-L257 HydrophobicContact CD2-CD2 4.45Å; F151-L257 HydrophobicContact CD2-CG 4.41Å; F151-L257 HydrophobicContact CE2-CD1 4.11Å; F151-L257 HydrophobicContact CE2-CD2 3.82Å; F151-L257 HydrophobicContact CE2-CG 3.76Å; F151-L257 HydrophobicContact CZ-CD1 4.49Å; F151-L257 HydrophobicContact CZ-CD2 3.96Å; F151-L257 HydrophobicContact CZ-CG 4.33Å; F151-M260 HydrophobicContact CB-CE 3.91Å; F151-M260 HydrophobicContact CD1-CE 4.48Å; F151-M260 HydrophobicContact CD2-CE 3.92Å; F151-M260 HydrophobicContact CG-CE 3.86Å |
| 152 | V | 97.3 | Very high | 94.9 | Very high | 77 Ų | 77 | 61.4 Ų | 61.4 | 47% | 0.467 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -66.1 | -42.7 | 178.3 | 172.6 | 0 | 0 | 0 | 0 | 111.7 | L148 C149 L150 S156 | L148-V152 WeakPolarHBondContact O-CG2 3.34Å; L148-V152 PolarHBondContact O-N 3.31Å; C149-V152 PolarHBondContact O-N 3.17Å; L150-V152 PolarHBondContact O-N 3.47Å; V152-S156 VanDerWaalsContact O-CB 3.29Å; V152-S156 WeakPolarHBondContact O-CB 3.12Å; V152-S156 PolarHBondContact O-N 3.43Å; V152-S156 PolarHBondContact O-OG 2.86Å |
| 153 | T | 96 | Very high | 95 | Very high | 93 Ų | 93 | 65.1 Ų | 65.1 | 57% | 0.571 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -62.9 | -43.5 | 176.5 | -63.6 | 0 | 0 | 0 | 0 | 111.1 | C149 L150 S156 L157 | C149-T153 WeakPolarHBondContact O-CB 3.48Å; C149-T153 PolarHBondContact O-N 2.95Å; C149-T153 PolarHBondContact O-OG1 3.3Å; C149-T153 VanDerWaalsContact O-OG1 3.08Å; L150-T153 PolarHBondContact O-N 3.38Å; T153-S156 PolarHBondContact O-N 3.33Å; T153-L157 WeakPolarHBondContact O-CB 3.43Å; T153-L157 PolarHBondContact O-N 2.85Å |
| 154 | Q | 95.2 | Very high | 95 | Very high | 37 Ų | 37 | 67.7 Ų | 67.7 | 17% | 0.173 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -64.5 | -46.1 | 179.4 | -176.8 | 166.5 | -19.7 | 0 | 0 | 111.3 | L150 F151 S156 L157 G158 F249 V252 L253 | L150-Q154 VanDerWaalsContact O-CB 3.24Å; L150-Q154 WeakPolarHBondContact O-CB 3.44Å; L150-Q154 PolarHBondContact O-N 3.01Å; F151-Q154 PolarHBondContact O-N 2.99Å; Q154-S156 VanDerWaalsContact C-N 3.33Å; Q154-S156 PolarHBondContact O-N 3.28Å; Q154-L157 PolarHBondContact O-N 3.44Å; Q154-G158 PolarHBondContact O-N 3.32Å; Q154-F249 HydrophobicContact CB-CE2 4.4Å; Q154-F249 HydrophobicContact CG-CD2 3.79Å; Q154-F249 HydrophobicContact CG-CE2 3.14Å; Q154-F249 HydrophobicContact CG-CZ 3.58Å; Q154-F249 VanDerWaalsContact NE2-CD2 3.3Å; Q154-F249 PolarHBondContact NE2-O 2.92Å; Q154-F249 WeakPolarHBondContact O-CE2 3.25Å; Q154-F249 VanDerWaalsContact O-CZ 3.24Å; Q154-F249 WeakPolarHBondContact O-CZ 3.43Å; Q154-V252 VanDerWaalsContact OE1-CG1 3.28Å; Q154-L253 HydrophobicContact CB-CD2 4.33Å; Q154-L253 HydrophobicContact CG-CD2 4Å |
| 155 | L | 96 | Very high | 94.7 | Very high | 75 Ų | 75 | 70.1 Ų | 70.1 | 39% | 0.393 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60 | -42.7 | 174.2 | -75.6 | -179.4 | 0 | 0 | 0 | 112.4 | F151 G158 A159 L253 | F151-L155 HydrophobicContact CD1-CD1 3.86Å; F151-L155 HydrophobicContact CE1-CD1 3.3Å; F151-L155 HydrophobicContact CE1-CG 4.24Å; F151-L155 HydrophobicContact CE2-CD1 4.4Å; F151-L155 HydrophobicContact CZ-CD1 3.62Å; F151-L155 HydrophobicContact CZ-CG 4.31Å; F151-L155 WeakPolarHBondContact O-CB 3.38Å; F151-L155 WeakPolarHBondContact O-CG 3.27Å; F151-L155 PolarHBondContact O-N 3.27Å; L155-G158 PolarHBondContact O-N 3.33Å; L155-A159 VanDerWaalsContact O-CB 3.32Å; L155-A159 WeakPolarHBondContact O-CB 3.31Å; L155-A159 PolarHBondContact O-N 2.88Å; L155-L253 HydrophobicContact CD2-CD1 3.79Å; L155-L253 HydrophobicContact CD2-CD2 4.24Å; L155-L253 HydrophobicContact CG-CD2 4.35Å |
| 156 | S | 96.6 | Very high | 94.5 | Very high | 60 Ų | 60 | 71.1 Ų | 71.1 | 42% | 0.42 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -66.2 | -45.4 | -179.7 | -60 | 0 | 0 | 0 | 0 | 111.3 | V152 T153 Q154 A159 I160 | V152-S156 VanDerWaalsContact O-CB 3.29Å; V152-S156 WeakPolarHBondContact O-CB 3.12Å; V152-S156 PolarHBondContact O-N 3.43Å; V152-S156 PolarHBondContact O-OG 2.86Å; T153-S156 PolarHBondContact O-N 3.33Å; Q154-S156 VanDerWaalsContact C-N 3.33Å; Q154-S156 PolarHBondContact O-N 3.28Å; S156-A159 PolarHBondContact O-N 3.48Å; S156-I160 WeakPolarHBondContact O-CB 3.4Å; S156-I160 VanDerWaalsContact O-CG1 3.23Å; S156-I160 WeakPolarHBondContact O-CG1 3.4Å; S156-I160 PolarHBondContact O-N 3.43Å |
| 157 | L | 94.9 | Very high | 94.4 | Very high | 99 Ų | 99 | 72.7 Ų | 72.7 | 52% | 0.518 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -63.1 | -44.7 | 176.1 | -177.8 | 59.8 | 0 | 0 | 0 | 111.5 | T153 Q154 A159 I160 L161 | T153-L157 WeakPolarHBondContact O-CB 3.43Å; T153-L157 PolarHBondContact O-N 2.85Å; Q154-L157 PolarHBondContact O-N 3.44Å; L157-A159 PolarHBondContact O-N 3.26Å; L157-I160 PolarHBondContact O-N 3.42Å; L157-L161 HydrophobicContact CD1-CD1 4.38Å; L157-L161 HydrophobicContact CD1-CG 4.43Å; L157-L161 HydrophobicContact CG-CD1 4.18Å; L157-L161 WeakPolarHBondContact O-CB 3.29Å; L157-L161 VanDerWaalsContact O-CG 3.29Å; L157-L161 WeakPolarHBondContact O-CG 3.25Å; L157-L161 PolarHBondContact O-N 2.8Å |
| 158 | G | 93.5 | Very high | 94.1 | Very high | 19 Ų | 19 | 75.7 Ų | 75.7 | 20% | 0.196 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -59.8 | -43.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q154 L155 L161 F162 | Q154-G158 PolarHBondContact O-N 3.32Å; L155-G158 PolarHBondContact O-N 3.33Å; G158-L161 PolarHBondContact O-N 3.01Å; G158-F162 WeakPolarHBondContact O-CB 3.35Å; G158-F162 PolarHBondContact O-N 3.04Å |
| 159 | A | 94.5 | Very high | 93.7 | Very high | 47 Ų | 47 | 75 Ų | 75 | 39% | 0.388 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -65 | -44.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L155 S156 L157 L161 F162 I163 | L155-A159 VanDerWaalsContact O-CB 3.32Å; L155-A159 WeakPolarHBondContact O-CB 3.31Å; L155-A159 PolarHBondContact O-N 2.88Å; S156-A159 PolarHBondContact O-N 3.48Å; L157-A159 PolarHBondContact O-N 3.26Å; A159-L161 VanDerWaalsContact C-N 3.34Å; A159-L161 PolarHBondContact O-N 3.38Å; A159-F162 PolarHBondContact O-N 3.2Å; A159-I163 VanDerWaalsContact O-CG1 3.3Å; A159-I163 WeakPolarHBondContact O-CG1 3.18Å; A159-I163 PolarHBondContact O-N 3.41Å |
| 160 | I | 94.7 | Very high | 93.5 | Very high | 96 Ų | 96 | 75.3 Ų | 75.3 | 49% | 0.492 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -59.9 | -45.1 | 176.8 | -70.9 | 166.2 | 0 | 0 | 0 | 110.6 | S156 L157 F162 N164 | S156-I160 WeakPolarHBondContact O-CB 3.4Å; S156-I160 VanDerWaalsContact O-CG1 3.23Å; S156-I160 WeakPolarHBondContact O-CG1 3.4Å; S156-I160 PolarHBondContact O-N 3.43Å; L157-I160 PolarHBondContact O-N 3.42Å; I160-F162 VanDerWaalsContact C-N 3.34Å; I160-F162 PolarHBondContact O-N 3.43Å; I160-N164 WeakPolarHBondContact O-CB 3.32Å; I160-N164 PolarHBondContact O-N 3.43Å; I160-N164 PolarHBondContact O-ND2 3.24Å |
| 161 | L | 91.5 | Very high | 93.3 | Very high | 71 Ų | 71 | 75.3 Ų | 75.3 | 37% | 0.372 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63 | -40.1 | 177.1 | -71.8 | 170.6 | 0 | 0 | 0 | 111.8 | L157 G158 A159 R165 I168 | L157-L161 HydrophobicContact CD1-CD1 4.38Å; L157-L161 HydrophobicContact CD1-CG 4.43Å; L157-L161 HydrophobicContact CG-CD1 4.18Å; L157-L161 WeakPolarHBondContact O-CB 3.29Å; L157-L161 VanDerWaalsContact O-CG 3.29Å; L157-L161 WeakPolarHBondContact O-CG 3.25Å; L157-L161 PolarHBondContact O-N 2.8Å; G158-L161 PolarHBondContact O-N 3.01Å; A159-L161 VanDerWaalsContact C-N 3.34Å; A159-L161 PolarHBondContact O-N 3.38Å; L161-R165 PolarHBondContact O-N 3.48Å; L161-I168 HydrophobicContact CD2-CD1 4.33Å |
| 162 | F | 90.9 | Very high | 93.1 | Very high | 115 Ų | 115 | 75.3 Ų | 75.3 | 50% | 0.504 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -69.5 | -41.8 | -179.9 | -176.9 | -98.7 | 0 | 0 | 0 | 113.4 | G158 A159 I160 R165 | G158-F162 WeakPolarHBondContact O-CB 3.35Å; G158-F162 PolarHBondContact O-N 3.04Å; A159-F162 PolarHBondContact O-N 3.2Å; I160-F162 VanDerWaalsContact C-N 3.34Å; I160-F162 PolarHBondContact O-N 3.43Å; F162-R165 PolarHBondContact O-NH1 2.93Å |
| 163 | I | 94.3 | Very high | 92.8 | Very high | 121 Ų | 121 | 71.6 Ų | 71.6 | 62% | 0.621 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -68.4 | -44 | 179.1 | -67.6 | 165.6 | 0 | 0 | 0 | 110.2 | A159 R165 | A159-I163 VanDerWaalsContact O-CG1 3.3Å; A159-I163 WeakPolarHBondContact O-CG1 3.18Å; A159-I163 PolarHBondContact O-N 3.41Å; I163-R165 VanDerWaalsContact C-N 3.27Å; I163-R165 PolarHBondContact O-N 2.77Å |
| 164 | N | 92.7 | Very high | 92.7 | Very high | 63 Ų | 63 | 73.6 Ų | 73.6 | 34% | 0.337 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.9 | 12.5 | -175.6 | -65.4 | -64.4 | 0 | 0 | 0 | 114.1 | I160 E166 T167 I168 | I160-N164 WeakPolarHBondContact O-CB 3.32Å; I160-N164 PolarHBondContact O-N 3.43Å; I160-N164 PolarHBondContact O-ND2 3.24Å; N164-E166 VanDerWaalsContact C-N 3.3Å; N164-E166 PolarHBondContact O-N 3.33Å; N164-T167 WeakPolarHBondContact O-CB 3.41Å; N164-T167 PolarHBondContact O-N 3.01Å; N164-T167 VanDerWaalsContact O-N 3.14Å; N164-I168 HydrophobicContact CB-CD1 4.34Å; N164-I168 HydrophobicContact CB-CG1 4.49Å; N164-I168 VanDerWaalsContact O-CG1 3.24Å; N164-I168 WeakPolarHBondContact O-CG1 3.31Å; N164-I168 PolarHBondContact O-N 3.09Å |
| 165 | R | 89.2 | Confident | 92.5 | Very high | 109 Ų | 109 | 75.5 Ų | 75.5 | 41% | 0.411 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -54.1 | -44.4 | -177.7 | 73.2 | -172.9 | -177.8 | -94.9 | -12.7 | 112.6 | L161 F162 I163 I168 E169 | L161-R165 PolarHBondContact O-N 3.48Å; F162-R165 PolarHBondContact O-NH1 2.93Å; I163-R165 VanDerWaalsContact C-N 3.27Å; I163-R165 PolarHBondContact O-N 2.77Å; R165-I168 PolarHBondContact O-N 3.39Å; R165-E169 WeakPolarHBondContact O-CG 3.19Å; R165-E169 PolarHBondContact O-N 2.87Å |
| 166 | E | 90.2 | Very high | 92.4 | Very high | 108 Ų | 108 | 71.9 Ų | 71.9 | 51% | 0.505 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -71.6 | -36.4 | -178.8 | -69 | 173 | -156 | 0 | 0 | 111.4 | N164 E169 N170 | N164-E166 VanDerWaalsContact C-N 3.3Å; N164-E166 PolarHBondContact O-N 3.33Å; E166-E169 PolarHBondContact O-N 3.35Å; E166-N170 WeakPolarHBondContact O-CB 3.3Å; E166-N170 PolarHBondContact O-N 2.75Å; E166-N170 PolarHBondContact O-ND2 2.81Å |
| 167 | T | 93 | Very high | 92.3 | Very high | 69 Ų | 69 | 72.6 Ų | 72.6 | 42% | 0.423 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -64 | -45.5 | 173.3 | -55.8 | 0 | 0 | 0 | 0 | 110.5 | N164 E169 N170 D171 | N164-T167 WeakPolarHBondContact O-CB 3.41Å; N164-T167 PolarHBondContact O-N 3.01Å; N164-T167 VanDerWaalsContact O-N 3.14Å; T167-E169 VanDerWaalsContact C-N 3.33Å; T167-E169 PolarHBondContact O-N 2.81Å; T167-N170 PolarHBondContact O-N 3.47Å; T167-D171 WeakPolarHBondContact CG2-OD2 3.4Å; T167-D171 WeakPolarHBondContact O-CB 3.49Å; T167-D171 VanDerWaalsContact O-CG 3.29Å; T167-D171 PolarHBondContact O-N 2.88Å |
| 168 | I | 89.6 | Confident | 92.1 | Very high | 76 Ų | 76 | 70.4 Ų | 70.4 | 39% | 0.39 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -60 | -42.9 | 176.6 | -67.5 | 162.9 | 0 | 0 | 0 | 110.7 | L161 N164 R165 L172 | L161-I168 HydrophobicContact CD2-CD1 4.33Å; N164-I168 HydrophobicContact CB-CD1 4.34Å; N164-I168 HydrophobicContact CB-CG1 4.49Å; N164-I168 VanDerWaalsContact O-CG1 3.24Å; N164-I168 WeakPolarHBondContact O-CG1 3.31Å; N164-I168 PolarHBondContact O-N 3.09Å; R165-I168 PolarHBondContact O-N 3.39Å; I168-L172 WeakPolarHBondContact O-CB 3.35Å; I168-L172 PolarHBondContact O-N 2.84Å |
| 169 | E | 88.7 | Confident | 91.9 | Very high | 56 Ų | 56 | 70.8 Ų | 70.8 | 26% | 0.262 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -61.5 | -42.8 | 175.8 | -75.6 | 173 | -138.6 | 0 | 0 | 112.9 | R165 E166 T167 G173 F235 | R165-E169 WeakPolarHBondContact O-CG 3.19Å; R165-E169 PolarHBondContact O-N 2.87Å; E166-E169 PolarHBondContact O-N 3.35Å; T167-E169 VanDerWaalsContact C-N 3.33Å; T167-E169 PolarHBondContact O-N 2.81Å; E169-G173 PolarHBondContact O-N 3.38Å; E169-G173 VanDerWaalsContact O-N 3.12Å; E169-F235 HydrophobicContact CG-CD2 3.5Å; E169-F235 VanDerWaalsContact CG-CD2 3.5Å; E169-F235 HydrophobicContact CG-CE2 3.31Å; E169-F235 HydrophobicContact CG-CG 4.35Å; E169-F235 HydrophobicContact CG-CZ 3.98Å; E169-F235 WeakPolarHBondContact OE1-CE2 3.28Å; E169-F235 WeakPolarHBondContact OE1-CZ 3.02Å; E169-F235 WeakPolarHBondContact OE2-CZ 3.36Å |
| 170 | N | 92.5 | Very high | 91.9 | Very high | 79 Ų | 79 | 68.7 Ų | 68.7 | 42% | 0.422 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -71.3 | -41.7 | 179.2 | -75 | -32.8 | 0 | 0 | 0 | 112.1 | E166 T167 G173 K174 R231 | E166-N170 WeakPolarHBondContact O-CB 3.3Å; E166-N170 PolarHBondContact O-N 2.75Å; E166-N170 PolarHBondContact O-ND2 2.81Å; T167-N170 PolarHBondContact O-N 3.47Å; N170-G173 PolarHBondContact O-N 2.73Å; N170-K174 WeakPolarHBondContact O-CG 3.26Å; N170-K174 PolarHBondContact O-N 3.33Å; N170-R231 PolarHBondContact OD1-NH2 3.3Å |
| 171 | D | 91.2 | Very high | 91.7 | Very high | 73 Ų | 73 | 66.5 Ų | 66.5 | 39% | 0.39 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -69.1 | -36.2 | 178.4 | -71.4 | -15.8 | 0 | 0 | 0 | 111.2 | T167 K174 T175 | T167-D171 WeakPolarHBondContact CG2-OD2 3.4Å; T167-D171 WeakPolarHBondContact O-CB 3.49Å; T167-D171 VanDerWaalsContact O-CG 3.29Å; T167-D171 PolarHBondContact O-N 2.88Å; D171-K174 PolarHBondContact O-N 2.72Å; D171-K174 IonicContact OD1-NZ 3.72Å; D171-T175 VanDerWaalsContact O-CB 3.27Å; D171-T175 WeakPolarHBondContact O-CB 3.34Å; D171-T175 PolarHBondContact O-N 2.72Å; D171-T175 PolarHBondContact O-OG1 3.39Å |
| 172 | L | 91.8 | Very high | 91.5 | Very high | 38 Ų | 38 | 69.9 Ų | 69.9 | 20% | 0.199 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -58.6 | -48.7 | 169.6 | 176.6 | 65.2 | 0 | 0 | 0 | 110.9 | I168 T175 L176 I234 L238 | I168-L172 WeakPolarHBondContact O-CB 3.35Å; I168-L172 PolarHBondContact O-N 2.84Å; L172-T175 PolarHBondContact O-N 3.47Å; L172-L176 HydrophobicContact CD1-CD1 4.24Å; L172-L176 HydrophobicContact CD1-CG 4.33Å; L172-L176 HydrophobicContact CG-CD1 4.09Å; L172-L176 WeakPolarHBondContact O-CG 3.38Å; L172-L176 PolarHBondContact O-N 3.26Å; L172-I234 HydrophobicContact CD1-CG2 4.44Å; L172-I234 HydrophobicContact CD2-CB 4.11Å; L172-I234 HydrophobicContact CD2-CG2 3.55Å; L172-L238 HydrophobicContact CD2-CD1 4.22Å |
| 173 | G | 92.7 | Very high | 91.4 | Very high | 0 Ų | 0 | 64.8 Ų | 64.8 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -57.2 | -51.1 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | E169 N170 T175 L176 D177 | E169-G173 PolarHBondContact O-N 3.38Å; E169-G173 VanDerWaalsContact O-N 3.12Å; N170-G173 PolarHBondContact O-N 2.73Å; G173-T175 VanDerWaalsContact C-N 3.28Å; G173-T175 PolarHBondContact O-N 2.95Å; G173-L176 WeakPolarHBondContact O-CB 3.28Å; G173-L176 PolarHBondContact O-N 2.89Å; G173-D177 PolarHBondContact O-N 3.46Å |
| 174 | K | 93.2 | Very high | 91.2 | Very high | 135 Ų | 135 | 64.1 Ų | 64.1 | 59% | 0.587 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -60.3 | -38.3 | 176.9 | -69.3 | 171.5 | -172.7 | 165.6 | 0 | 112.6 | N170 D171 D177 S178 | N170-K174 WeakPolarHBondContact O-CG 3.26Å; N170-K174 PolarHBondContact O-N 3.33Å; D171-K174 PolarHBondContact O-N 2.72Å; D171-K174 IonicContact OD1-NZ 3.72Å; K174-D177 PolarHBondContact O-N 2.92Å; K174-S178 VanDerWaalsContact O-CB 3.3Å; K174-S178 WeakPolarHBondContact O-CB 3.47Å; K174-S178 PolarHBondContact O-N 3.45Å |
| 175 | T | 91.8 | Very high | 90.8 | Very high | 76 Ų | 76 | 69.2 Ų | 69.2 | 47% | 0.466 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -66.9 | -43.5 | 178.2 | -55.2 | 0 | 0 | 0 | 0 | 110 | D171 L172 G173 S178 M179 | D171-T175 VanDerWaalsContact O-CB 3.27Å; D171-T175 WeakPolarHBondContact O-CB 3.34Å; D171-T175 PolarHBondContact O-N 2.72Å; D171-T175 PolarHBondContact O-OG1 3.39Å; L172-T175 PolarHBondContact O-N 3.47Å; G173-T175 VanDerWaalsContact C-N 3.28Å; G173-T175 PolarHBondContact O-N 2.95Å; T175-S178 PolarHBondContact O-N 2.78Å; T175-M179 HydrophobicContact CG2-CE 3.68Å; T175-M179 WeakPolarHBondContact O-CB 3.35Å; T175-M179 VanDerWaalsContact O-CG 3.27Å; T175-M179 WeakPolarHBondContact O-CG 3.24Å; T175-M179 PolarHBondContact O-N 3.3Å |
| 176 | L | 93.6 | Very high | 90.1 | Very high | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -61.3 | -46.8 | 174.2 | -70.6 | 167.8 | 0 | 0 | 0 | 111.8 | L172 G173 S178 M179 V180 L194 L197 C230 R231 I234 | L172-L176 HydrophobicContact CD1-CD1 4.24Å; L172-L176 HydrophobicContact CD1-CG 4.33Å; L172-L176 HydrophobicContact CG-CD1 4.09Å; L172-L176 WeakPolarHBondContact O-CG 3.38Å; L172-L176 PolarHBondContact O-N 3.26Å; G173-L176 WeakPolarHBondContact O-CB 3.28Å; G173-L176 PolarHBondContact O-N 2.89Å; L176-S178 VanDerWaalsContact C-N 3.29Å; L176-S178 PolarHBondContact O-N 3.21Å; L176-M179 HydrophobicContact CD2-CE 3.83Å; L176-M179 HydrophobicContact CG-CE 4.35Å; L176-M179 PolarHBondContact O-N 3.46Å; L176-M179 VanDerWaalsContact O-N 3.15Å; L176-V180 WeakPolarHBondContact O-CG2 3.37Å; L176-V180 PolarHBondContact O-N 3.49Å; L176-L194 HydrophobicContact CD2-CD1 4.3Å; L176-L197 HydrophobicContact CD2-CD1 3.86Å; L176-C230 HydrophobicContact CD1-CB 4.24Å; L176-C230 HydrophobicContact CD2-CB 4.27Å; L176-R231 HydrophobicContact CD1-CB 3.98Å; L176-I234 HydrophobicContact CD1-CD1 4.13Å; L176-I234 HydrophobicContact CD2-CD1 4.19Å |
| 177 | D | 93.5 | Very high | 89.4 | Confident | 75 Ų | 75 | 63.9 Ų | 63.9 | 40% | 0.401 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -57.8 | -44.6 | 176.6 | -63.4 | -24.6 | 0 | 0 | 0 | 111.1 | G173 K174 V180 S181 S206 | G173-D177 PolarHBondContact O-N 3.46Å; K174-D177 PolarHBondContact O-N 2.92Å; D177-V180 PolarHBondContact O-N 2.84Å; D177-S181 PolarHBondContact O-N 3.29Å; D177-S206 WeakPolarHBondContact OD1-CB 3.22Å; D177-S206 PolarHBondContact OD1-OG 3.48Å |
| 178 | S | 90.8 | Very high | 88.5 | Confident | 52 Ų | 52 | 64.3 Ų | 64.3 | 36% | 0.364 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -62.8 | -43.1 | 176.1 | -174.2 | 0 | 0 | 0 | 0 | 111.8 | K174 T175 L176 S181 R182 | K174-S178 VanDerWaalsContact O-CB 3.3Å; K174-S178 WeakPolarHBondContact O-CB 3.47Å; K174-S178 PolarHBondContact O-N 3.45Å; T175-S178 PolarHBondContact O-N 2.78Å; L176-S178 VanDerWaalsContact C-N 3.29Å; L176-S178 PolarHBondContact O-N 3.21Å; S178-S181 PolarHBondContact O-N 2.94Å; S178-S181 PolarHBondContact O-OG 2.87Å; S178-R182 WeakPolarHBondContact O-CB 3.47Å; S178-R182 WeakPolarHBondContact O-CG 3.3Å; S178-R182 PolarHBondContact O-N 3.32Å; S178-R182 VanDerWaalsContact O-N 3.08Å |
| 179 | M | 90.4 | Very high | 87.4 | Confident | 28 Ų | 28 | 62.5 Ų | 62.5 | 14% | 0.138 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62.3 | -44.2 | 177.1 | -74.5 | -168.9 | -93.1 | 0 | 0 | 111.9 | T175 L176 R182 Y183 V190 A193 L194 L197 | T175-M179 HydrophobicContact CG2-CE 3.68Å; T175-M179 WeakPolarHBondContact O-CB 3.35Å; T175-M179 VanDerWaalsContact O-CG 3.27Å; T175-M179 WeakPolarHBondContact O-CG 3.24Å; T175-M179 PolarHBondContact O-N 3.3Å; L176-M179 HydrophobicContact CD2-CE 3.83Å; L176-M179 HydrophobicContact CG-CE 4.35Å; L176-M179 PolarHBondContact O-N 3.46Å; L176-M179 VanDerWaalsContact O-N 3.15Å; M179-R182 CarbonylContact O-C 3.57Å; M179-R182 PolarHBondContact O-N 3.32Å; M179-Y183 PolarHBondContact O-N 3.43Å; M179-V190 HydrophobicContact CB-CG1 3.94Å; M179-V190 HydrophobicContact CG-CG1 4.01Å; M179-V190 WeakPolarHBondContact O-CG1 3.2Å; M179-A193 HydrophobicContact SD-CB 4.47Å; M179-L194 HydrophobicContact CB-CD1 4.32Å; M179-L194 HydrophobicContact CB-CD2 4.45Å; M179-L197 HydrophobicContact CE-CD1 3.83Å; M179-L197 HydrophobicContact SD-CD1 4.33Å |
| 180 | V | 93 | Very high | 87 | Confident | 3 Ų | 3 | 61 Ų | 61 | 2% | 0.018 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -61.7 | -46.6 | 176.4 | 175.5 | 0 | 0 | 0 | 0 | 110.7 | L176 D177 R182 Y183 L194 D211 F212 L215 | L176-V180 WeakPolarHBondContact O-CG2 3.37Å; L176-V180 PolarHBondContact O-N 3.49Å; D177-V180 PolarHBondContact O-N 2.84Å; V180-R182 PolarHBondContact O-N 3.08Å; V180-Y183 WeakPolarHBondContact O-CB 3.14Å; V180-Y183 PolarHBondContact O-N 3.44Å; V180-L194 HydrophobicContact CB-CD2 4.49Å; V180-L194 HydrophobicContact CG2-CD2 3.86Å; V180-D211 HydrophobicContact CG1-CB 4Å; V180-F212 HydrophobicContact CG1-CD1 4.14Å; V180-F212 HydrophobicContact CG1-CE1 3.95Å; V180-F212 HydrophobicContact CG1-CE2 4.4Å; V180-F212 HydrophobicContact CG1-CG 4.45Å; V180-F212 HydrophobicContact CG1-CZ 4.07Å; V180-F212 HydrophobicContact CG2-CZ 4.39Å; V180-L215 HydrophobicContact CG1-CD1 3.86Å |
| 181 | S | 91.7 | Very high | 86.6 | Confident | 50 Ų | 50 | 60.6 Ų | 60.6 | 35% | 0.35 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -61.7 | -29.7 | 179.4 | 75.9 | 0 | 0 | 0 | 0 | 113.6 | D177 S178 | D177-S181 PolarHBondContact O-N 3.29Å; S178-S181 PolarHBondContact O-N 2.94Å; S178-S181 PolarHBondContact O-OG 2.87Å |
| 182 | R | 88.1 | Confident | 86 | Confident | 142 Ų | 142 | 58.7 Ų | 58.7 | 54% | 0.536 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.1 | 9.8 | -177.8 | -65.9 | 179.8 | -177.3 | -146.2 | -0.4 | 113 | S178 M179 V180 Y184 Q185 G186 V190 | S178-R182 WeakPolarHBondContact O-CB 3.47Å; S178-R182 WeakPolarHBondContact O-CG 3.3Å; S178-R182 PolarHBondContact O-N 3.32Å; S178-R182 VanDerWaalsContact O-N 3.08Å; M179-R182 CarbonylContact O-C 3.57Å; M179-R182 PolarHBondContact O-N 3.32Å; V180-R182 PolarHBondContact O-N 3.08Å; R182-Y184 VanDerWaalsContact C-N 3.34Å; R182-Y184 PolarHBondContact O-N 2.93Å; R182-Q185 PolarHBondContact O-N 3.33Å; R182-G186 VanDerWaalsContact O-CA 3.23Å; R182-G186 WeakPolarHBondContact O-CA 3.29Å; R182-G186 PolarHBondContact O-N 2.91Å; R182-V190 HydrophobicContact CB-CG1 4.1Å |
| 183 | Y | 88.7 | Confident | 85.5 | Confident | 8 Ų | 8 | 58.2 Ų | 58.2 | 3% | 0.031 | 31% | 0.309 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.7 | -43.3 | -172.9 | -176.1 | -93.1 | 0 | 0 | 0 | 113.3 | M179 V180 Q191 L194 D195 F212 P220 | M179-Y183 PolarHBondContact O-N 3.43Å; V180-Y183 WeakPolarHBondContact O-CB 3.14Å; V180-Y183 PolarHBondContact O-N 3.44Å; Y183-Q191 HydrophobicContact CD1-CG 4.14Å; Y183-Q191 HydrophobicContact CD2-CB 4.32Å; Y183-Q191 HydrophobicContact CD2-CG 3.76Å; Y183-Q191 HydrophobicContact CE1-CG 3.7Å; Y183-Q191 HydrophobicContact CE2-CB 4.19Å; Y183-Q191 HydrophobicContact CE2-CG 3.32Å; Y183-Q191 HydrophobicContact CG-CG 4.17Å; Y183-Q191 PolarHBondContact OH-NE2 3.5Å; Y183-L194 HydrophobicContact CD2-CB 4.16Å; Y183-L194 HydrophobicContact CD2-CD2 3.63Å; Y183-L194 HydrophobicContact CD2-CG 4.35Å; Y183-L194 HydrophobicContact CE2-CB 4.37Å; Y183-L194 HydrophobicContact CE2-CD2 4.31Å; Y183-L194 HydrophobicContact CG-CD2 4.44Å; Y183-D195 VanDerWaalsContact CE2-OD1 3.25Å; Y183-D195 WeakPolarHBondContact CE2-OD1 3.22Å; Y183-D195 PolarHBondContact OH-OD1 3.2Å; Y183-D195 PolarHBondContact OH-OD2 3.11Å; Y183-F212 HydrophobicContact CD1-CE1 4.49Å; Y183-F212 HydrophobicContact CG-CE1 4.24Å; Y183-P220 HydrophobicContact CE1-CB 3.79Å; Y183-P220 HydrophobicContact CE1-CG 4.31Å; Y183-P220 HydrophobicContact CE2-CB 4.18Å; Y183-P220 HydrophobicContact CE2-CG 4.25Å; Y183-P220 VanDerWaalsContact CZ-CB 3.43Å; Y183-P220 WeakPolarHBondContact OH-CB 3.48Å |
| 184 | Y | 88.9 | Confident | 85.4 | Confident | 106 Ų | 106 | 58.2 Ų | 58.2 | 42% | 0.416 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.6 | -9.8 | 179.7 | -68 | -72.6 | 0 | 0 | 0 | 114.8 | R182 L217 T218 | R182-Y184 VanDerWaalsContact C-N 3.34Å; R182-Y184 PolarHBondContact O-N 2.93Å; Y184-L217 HydrophobicContact CD2-CB 4.13Å; Y184-L217 HydrophobicContact CD2-CD1 4.05Å; Y184-L217 HydrophobicContact CD2-CD2 3.77Å; Y184-L217 HydrophobicContact CD2-CG 4.19Å; Y184-L217 HydrophobicContact CE2-CB 3.99Å; Y184-L217 HydrophobicContact CE2-CD2 4.41Å; Y184-T218 VanDerWaalsContact CE2-O 3.31Å; Y184-T218 WeakPolarHBondContact CE2-O 3.49Å; Y184-T218 PolarHBondContact OH-O 3.43Å |
| 185 | Q | 84.3 | Confident | 85.3 | Confident | 171 Ų | 171 | 53.6 Ų | 53.6 | 80% | 0.799 | 29% | 0.29 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -117.5 | -13.3 | -174.1 | -63 | -179.7 | 4 | 0 | 0 | 113.1 | R182 | R182-Q185 PolarHBondContact O-N 3.33Š|
| 186 | G | 74.7 | Confident | 85 | Confident | 25 Ų | 25 | 50.3 Ų | 50.3 | 26% | 0.258 | 27% | 0.271 | S | S | . | . | S | Bend | trans | -84.4 | 173.3 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | R182 | R182-G186 VanDerWaalsContact O-CA 3.23Å; R182-G186 WeakPolarHBondContact O-CA 3.29Å; R182-G186 PolarHBondContact O-N 2.91Å |
| 187 | P | 74.8 | Confident | 84.9 | Confident | 80 Ų | 80 | 52 Ų | 52 | 52% | 0.519 | 28% | 0.28 | S | S | . | . | trans | -60.2 | 149.2 | 169.7 | 28 | -33.1 | 0 | 0 | 0 | 109.5 | I189 V190 | P187-I189 HydrophobicContact CB-CG2 3.87Å; P187-I189 HydrophobicContact CG-CG2 3.69Å; P187-I189 PolarHBondContact O-N 2.95Å; P187-V190 HydrophobicContact CG-CG2 4.1Å; P187-V190 PolarHBondContact O-N 2.74Å | ||
| 188 | S | 75.3 | Confident | 84.9 | Confident | 77 Ų | 77 | 48.5 Ų | 48.5 | 54% | 0.538 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -49.4 | -31.2 | -176.3 | 57.3 | 0 | 0 | 0 | 0 | 113.3 | V190 Q191 E192 | S188-V190 VanDerWaalsContact C-N 3.3Å; S188-V190 PolarHBondContact O-N 2.95Å; S188-Q191 WeakPolarHBondContact O-CB 3.06Å; S188-Q191 PolarHBondContact O-N 3.44Å; S188-Q191 VanDerWaalsContact O-N 3.13Å; S188-E192 WeakPolarHBondContact O-CG 3.44Å; S188-E192 PolarHBondContact O-N 2.81Å |
| 189 | I | 67 | Low | 84.9 | Confident | 38 Ų | 38 | 50.5 Ų | 50.5 | 20% | 0.195 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -57 | -36.6 | 176.4 | -165.9 | -110.1 | 0 | 0 | 0 | 114.4 | Q103 P187 A193 | Q103-I189 HydrophobicContact CB-CD1 4.18Å; Q103-I189 HydrophobicContact CB-CG1 3.82Å; Q103-I189 HydrophobicContact CG-CB 4.45Å; Q103-I189 HydrophobicContact CG-CD1 3.86Å; Q103-I189 HydrophobicContact CG-CG1 3.61Å; P187-I189 HydrophobicContact CB-CG2 3.87Å; P187-I189 HydrophobicContact CG-CG2 3.69Å; P187-I189 PolarHBondContact O-N 2.95Å; I189-A193 WeakPolarHBondContact O-CB 2.97Å; I189-A193 PolarHBondContact O-N 2.75Å |
| 190 | V | 78.8 | Confident | 85 | Confident | 24 Ų | 24 | 52.8 Ų | 52.8 | 15% | 0.145 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -68.9 | -41.8 | 178.3 | 171.7 | 0 | 0 | 0 | 0 | 110.1 | M179 R182 P187 S188 L194 | M179-V190 HydrophobicContact CB-CG1 3.94Å; M179-V190 HydrophobicContact CG-CG1 4.01Å; M179-V190 WeakPolarHBondContact O-CG1 3.2Å; R182-V190 HydrophobicContact CB-CG1 4.1Å; P187-V190 HydrophobicContact CG-CG2 4.1Å; P187-V190 PolarHBondContact O-N 2.74Å; S188-V190 VanDerWaalsContact C-N 3.3Å; S188-V190 PolarHBondContact O-N 2.95Å; V190-L194 WeakPolarHBondContact O-CB 2.8Å; V190-L194 PolarHBondContact O-N 3.24Å; V190-L194 VanDerWaalsContact O-N 3.08Å |
| 191 | Q | 83.8 | Confident | 85 | Confident | 71 Ų | 71 | 55.8 Ų | 55.8 | 33% | 0.332 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -63.9 | -49.2 | 178.9 | -164.1 | -175.4 | -14.4 | 0 | 0 | 110.9 | Y183 S188 L194 D195 | Y183-Q191 HydrophobicContact CD1-CG 4.14Å; Y183-Q191 HydrophobicContact CD2-CB 4.32Å; Y183-Q191 HydrophobicContact CD2-CG 3.76Å; Y183-Q191 HydrophobicContact CE1-CG 3.7Å; Y183-Q191 HydrophobicContact CE2-CB 4.19Å; Y183-Q191 HydrophobicContact CE2-CG 3.32Å; Y183-Q191 HydrophobicContact CG-CG 4.17Å; Y183-Q191 PolarHBondContact OH-NE2 3.5Å; S188-Q191 WeakPolarHBondContact O-CB 3.06Å; S188-Q191 PolarHBondContact O-N 3.44Å; S188-Q191 VanDerWaalsContact O-N 3.13Å; Q191-L194 PolarHBondContact O-N 2.86Å; Q191-D195 WeakPolarHBondContact O-CB 3.36Å; Q191-D195 VanDerWaalsContact O-CG 3.32Å; Q191-D195 PolarHBondContact O-N 3.46Å |
| 192 | E | 78.6 | Confident | 85.1 | Confident | 33 Ų | 33 | 61.4 Ų | 61.4 | 15% | 0.154 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -68.8 | -42.2 | -175.9 | -68.9 | 163.1 | 146.4 | 0 | 0 | 111.6 | S99 N102 S188 L194 D195 A196 | S99-E192 CarbonylContact O-C 3.37Å; S99-E192 VanDerWaalsContact O-C 3.3Å; N102-E192 HydrophobicContact CB-CB 4.32Å; N102-E192 WeakPolarHBondContact CB-OE2 3.38Å; N102-E192 PolarHBondContact ND2-OE1 2.84Å; N102-E192 PolarHBondContact ND2-OE2 3.4Å; S188-E192 WeakPolarHBondContact O-CG 3.44Å; S188-E192 PolarHBondContact O-N 2.81Å; E192-L194 VanDerWaalsContact C-N 3.35Å; E192-L194 PolarHBondContact O-N 3.38Å; E192-D195 PolarHBondContact O-N 3.48Å; E192-A196 PolarHBondContact O-N 2.89Å |
| 193 | A | 82.6 | Confident | 85.5 | Confident | 29 Ų | 29 | 54.6 Ų | 54.6 | 24% | 0.24 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.4 | -42.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | S99 M179 I189 A196 L197 | S99-A193 WeakPolarHBondContact O-CA 3.4Å; M179-A193 HydrophobicContact SD-CB 4.47Å; I189-A193 WeakPolarHBondContact O-CB 2.97Å; I189-A193 PolarHBondContact O-N 2.75Å; A193-A196 VanDerWaalsContact O-CB 3.27Å; A193-A196 WeakPolarHBondContact O-CB 3.27Å; A193-A196 PolarHBondContact O-N 2.88Å; A193-L197 VanDerWaalsContact O-CG 3.32Å; A193-L197 WeakPolarHBondContact O-CG 3.01Å; A193-L197 PolarHBondContact O-N 3.17Å |
| 194 | L | 90.2 | Very high | 85.8 | Confident | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -68.2 | -40.4 | 178.2 | -170.4 | 63.1 | 0 | 0 | 0 | 111.7 | L176 M179 V180 Y183 V190 Q191 E192 A196 L197 H198 F212 | L176-L194 HydrophobicContact CD2-CD1 4.3Å; M179-L194 HydrophobicContact CB-CD1 4.32Å; M179-L194 HydrophobicContact CB-CD2 4.45Å; V180-L194 HydrophobicContact CB-CD2 4.49Å; V180-L194 HydrophobicContact CG2-CD2 3.86Å; Y183-L194 HydrophobicContact CD2-CB 4.16Å; Y183-L194 HydrophobicContact CD2-CD2 3.63Å; Y183-L194 HydrophobicContact CD2-CG 4.35Å; Y183-L194 HydrophobicContact CE2-CB 4.37Å; Y183-L194 HydrophobicContact CE2-CD2 4.31Å; Y183-L194 HydrophobicContact CG-CD2 4.44Å; V190-L194 WeakPolarHBondContact O-CB 2.8Å; V190-L194 PolarHBondContact O-N 3.24Å; V190-L194 VanDerWaalsContact O-N 3.08Å; Q191-L194 PolarHBondContact O-N 2.86Å; E192-L194 VanDerWaalsContact C-N 3.35Å; E192-L194 PolarHBondContact O-N 3.38Å; L194-A196 VanDerWaalsContact C-N 3.26Å; L194-A196 PolarHBondContact O-N 3.01Å; L194-L197 PolarHBondContact O-N 3.48Å; L194-L197 VanDerWaalsContact O-N 3.17Å; L194-H198 PolarHBondContact O-CD2 3.31Å; L194-H198 PolarHBondContact O-N 3.4Å; L194-F212 HydrophobicContact CD2-CZ 4.05Å |
| 195 | D | 90.3 | Very high | 86.1 | Confident | 37 Ų | 37 | 49.2 Ų | 49.2 | 20% | 0.198 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -61.1 | -35.8 | 173.8 | -74.8 | -18 | 0 | 0 | 0 | 112.2 | Y183 Q191 E192 T199 S222 | Y183-D195 VanDerWaalsContact CE2-OD1 3.25Å; Y183-D195 WeakPolarHBondContact CE2-OD1 3.22Å; Y183-D195 PolarHBondContact OH-OD1 3.2Å; Y183-D195 PolarHBondContact OH-OD2 3.11Å; Q191-D195 WeakPolarHBondContact O-CB 3.36Å; Q191-D195 VanDerWaalsContact O-CG 3.32Å; Q191-D195 PolarHBondContact O-N 3.46Å; E192-D195 PolarHBondContact O-N 3.48Å; D195-T199 WeakPolarHBondContact O-CB 3.09Å; D195-T199 PolarHBondContact O-N 2.65Å; D195-T199 PolarHBondContact O-OG1 3.33Å; D195-S222 VanDerWaalsContact OD1-CB 3.27Å; D195-S222 WeakPolarHBondContact OD1-CB 3.27Å; D195-S222 PolarHBondContact OD1-OG 3.17Å |
| 196 | A | 85.7 | Confident | 86.6 | Confident | 7 Ų | 7 | 41 Ų | 41 | 6% | 0.058 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.3 | -48.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | S99 V100 E192 A193 L194 T199 A200 | S99-A196 VanDerWaalsContact C-CB 3.42Å; S99-A196 WeakPolarHBondContact O-CB 3.19Å; S99-A196 WeakPolarHBondContact OG-CB 3.19Å; V100-A196 HydrophobicContact CG2-CB 3.99Å; E192-A196 PolarHBondContact O-N 2.89Å; A193-A196 VanDerWaalsContact O-CB 3.27Å; A193-A196 WeakPolarHBondContact O-CB 3.27Å; A193-A196 PolarHBondContact O-N 2.88Å; L194-A196 VanDerWaalsContact C-N 3.26Å; L194-A196 PolarHBondContact O-N 3.01Å; A196-T199 PolarHBondContact O-N 2.77Å; A196-A200 WeakPolarHBondContact O-CB 3.1Å; A196-A200 PolarHBondContact O-N 3Å |
| 197 | L | 91.5 | Very high | 87.6 | Confident | 37 Ų | 37 | 44 Ų | 44 | 19% | 0.194 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.4 | -44.6 | -179.3 | -70.4 | 170.7 | 0 | 0 | 0 | 110.5 | L176 M179 A193 L194 T199 A200 F201 C203 I234 | L176-L197 HydrophobicContact CD2-CD1 3.86Å; M179-L197 HydrophobicContact CE-CD1 3.83Å; M179-L197 HydrophobicContact SD-CD1 4.33Å; A193-L197 VanDerWaalsContact O-CG 3.32Å; A193-L197 WeakPolarHBondContact O-CG 3.01Å; A193-L197 PolarHBondContact O-N 3.17Å; L194-L197 PolarHBondContact O-N 3.48Å; L194-L197 VanDerWaalsContact O-N 3.17Å; L197-T199 VanDerWaalsContact C-N 3.34Å; L197-T199 PolarHBondContact O-N 3.46Å; L197-A200 PolarHBondContact O-N 2.79Å; L197-F201 HydrophobicContact CD2-CD2 3.94Å; L197-F201 HydrophobicContact CD2-CE2 3.72Å; L197-F201 WeakPolarHBondContact O-CB 3.43Å; L197-F201 PolarHBondContact O-N 2.73Å; L197-C203 PolarHBondContact O-SG 3.41Å; L197-I234 HydrophobicContact CD2-CD1 3.96Å |
| 198 | H | 94.1 | Very high | 88.6 | Confident | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -55.9 | -48.9 | 175 | -66.3 | 168.7 | 0 | 0 | 0 | 111.8 | L194 R202 C203 G205 F212 S222 C223 C230 | L194-H198 PolarHBondContact O-CD2 3.31Å; L194-H198 PolarHBondContact O-N 3.4Å; H198-R202 WeakPolarHBondContact O-CA 3.46Å; H198-R202 PolarHBondContact O-N 2.85Å; H198-C203 WeakPolarHBondContact CA-O 3.33Å; H198-C203 WeakPolarHBondContact CB-O 3.47Å; H198-C203 PolarHBondContact O-N 3.42Å; H198-C203 VanDerWaalsContact O-N 3.12Å; H198-G205 PolarHBondContact NE2-N 2.86Å; H198-F212 AromaticContact CE1-CE2 3.99Å; H198-F212 AromaticContact CE1-CZ 3.86Å; H198-S222 VanDerWaalsContact CB-O 3.27Å; H198-S222 WeakPolarHBondContact CB-O 3.44Å; H198-S222 PolarHBondContact ND1-OG 3.31Å; H198-C223 PolarHBondContact CE1-SG 3.37Å; H198-C230 VanDerWaalsContact CD2-SG 3.53Å |
| 199 | T | 91.5 | Very high | 89.5 | Confident | 94 Ų | 94 | 37.2 Ų | 37.2 | 58% | 0.577 | 21% | 0.209 | S | C | * | . | H | α-helix | trans | -71.2 | -43.7 | -177.5 | -51.7 | 0 | 0 | 0 | 0 | 112.1 | D195 A196 L197 | D195-T199 WeakPolarHBondContact O-CB 3.09Å; D195-T199 PolarHBondContact O-N 2.65Å; D195-T199 PolarHBondContact O-OG1 3.33Å; A196-T199 PolarHBondContact O-N 2.77Å; L197-T199 VanDerWaalsContact C-N 3.34Å; L197-T199 PolarHBondContact O-N 3.46Å |
| 200 | A | 90.8 | Very high | 90.8 | Very high | 77 Ų | 77 | 37 Ų | 37 | 64% | 0.636 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -70.9 | -38.6 | -175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | A196 L197 | A196-A200 WeakPolarHBondContact O-CB 3.1Å; A196-A200 PolarHBondContact O-N 3Å; L197-A200 PolarHBondContact O-N 2.79Å |
| 201 | F | 93.6 | Very high | 91.6 | Very high | 66 Ų | 66 | 37 Ų | 37 | 29% | 0.289 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -102.5 | 0.5 | -177.5 | -67.2 | -77.3 | 0 | 0 | 0 | 114 | L197 R233 I234 A237 | L197-F201 HydrophobicContact CD2-CD2 3.94Å; L197-F201 HydrophobicContact CD2-CE2 3.72Å; L197-F201 WeakPolarHBondContact O-CB 3.43Å; L197-F201 PolarHBondContact O-N 2.73Å; F201-R233 HydrophobicContact CB-CB 4.24Å; F201-I234 HydrophobicContact CB-CG1 4.34Å; F201-I234 HydrophobicContact CD1-CG1 4.08Å; F201-I234 HydrophobicContact CD2-CD1 4.23Å; F201-I234 HydrophobicContact CD2-CG1 3.57Å; F201-I234 HydrophobicContact CE1-CG1 4.28Å; F201-I234 HydrophobicContact CE2-CD1 4.43Å; F201-I234 HydrophobicContact CE2-CG1 3.78Å; F201-I234 HydrophobicContact CG-CG1 3.72Å; F201-I234 HydrophobicContact CZ-CG1 4.13Å; F201-I234 HydrophobicContact CZ-CG2 4.49Å; F201-A237 HydrophobicContact CD1-CB 4Å; F201-A237 HydrophobicContact CE1-CB 3.57Å |
| 202 | R | 94.3 | Very high | 92.1 | Very high | 167 Ų | 167 | 33.6 Ų | 33.6 | 63% | 0.63 | 20% | 0.199 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 48.7 | 63.8 | -175.3 | -71.3 | -176 | 154.1 | 164 | -5.4 | 110.9 | H198 D224 | H198-R202 WeakPolarHBondContact O-CA 3.46Å; H198-R202 PolarHBondContact O-N 2.85Å; R202-D224 HydrophobicContact CB-CB 4.21Å |
| 203 | C | 95.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 22% | 0.216 | C | C | . | . | trans | -143.1 | 173.2 | -175.2 | 63.7 | 0 | 0 | 0 | 0 | 110.7 | L197 H198 D224 E228 C230 R233 | L197-C203 PolarHBondContact O-SG 3.41Å; H198-C203 WeakPolarHBondContact CA-O 3.33Å; H198-C203 WeakPolarHBondContact CB-O 3.47Å; H198-C203 PolarHBondContact O-N 3.42Å; H198-C203 VanDerWaalsContact O-N 3.12Å; C203-D224 PolarHBondContact O-N 3.35Å; C203-E228 CarbonylContact C-O 3.14Å; C203-E228 VanDerWaalsContact CA-O 3.28Å; C203-E228 WeakPolarHBondContact CA-O 3.29Å; C203-E228 VanDerWaalsContact CB-O 3.31Å; C203-E228 WeakPolarHBondContact CB-O 3.49Å; C203-C230 HydrophobicContact CB-CB 3.88Å; C203-C230 WeakPolarHBondContact CB-SG 3.23Å; C203-C230 WeakPolarHBondContact SG-CA 3.49Å; C203-C230 WeakPolarHBondContact SG-CB 3.32Å; C203-C230 CovalentContact SG-SG 2.03Å; C203-C230 PolarHBondContact SG-SG 3.5Å; C203-R233 HydrophobicContact CB-CB 4.21Å; C203-R233 HydrophobicContact CB-CG 4.12Å | ||
| 204 | C | 96.2 | Very high | 93.2 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 24% | 0.24 | C | C | . | . | trans | -146.4 | 134 | 174.9 | -172.1 | 0 | 0 | 0 | 0 | 110.3 | G208 C209 C223 E228 | C204-G208 CarbonylContact O-C 3.28Å; C204-G208 WeakPolarHBondContact O-CA 3.45Å; C204-G208 PolarHBondContact O-N 3.48Å; C204-C209 VanDerWaalsContact CB-SG 3.54Å; C204-C209 PolarHBondContact SG-SG 2.78Å; C204-C223 HydrophobicContact CB-CB 3.54Å; C204-C223 WeakPolarHBondContact CB-SG 3.32Å; C204-C223 WeakPolarHBondContact SG-CB 3.48Å; C204-C223 CovalentContact SG-SG 2.04Å; C204-C223 PolarHBondContact SG-SG 3.48Å; C204-E228 PolarHBondContact N-O 2.97Å | ||
| 205 | G | 94.7 | Very high | 93.3 | Very high | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 26% | 0.26 | C | S | . | . | S | Bend | trans | 65.8 | -173.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113 | H198 C230 | H198-G205 PolarHBondContact NE2-N 2.86Å; G205-C230 WeakPolarHBondContact O-CB 3.38Å; G205-C230 PolarHBondContact O-N 3.04Å; G205-C230 PolarHBondContact O-SG 2.03Å |
| 206 | S | 94.6 | Very high | 93.5 | Very high | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 29% | 0.294 | C | S | . | . | S | Bend | trans | -78.2 | -54.9 | 174.8 | 179.7 | 0 | 0 | 0 | 0 | 111 | D177 D211 G229 C230 R231 | D177-S206 WeakPolarHBondContact OD1-CB 3.22Å; D177-S206 PolarHBondContact OD1-OG 3.48Å; S206-D211 WeakPolarHBondContact CA-OD2 2.92Å; S206-D211 WeakPolarHBondContact CB-OD2 3.21Å; S206-D211 PolarHBondContact N-OD2 3.49Å; S206-G229 CarbonylContact O-C 3.49Å; S206-G229 WeakPolarHBondContact O-CA 3.21Å; S206-C230 PolarHBondContact O-N 3.49Å; S206-R231 VanDerWaalsContact O-CB 3.22Å; S206-R231 WeakPolarHBondContact O-CB 3.36Å; S206-R231 PolarHBondContact O-N 3.1Å |
| 207 | S | 95.3 | Very high | 93.7 | Very high | 86 Ų | 86 | 57.8 Ų | 57.8 | 60% | 0.601 | 30% | 0.3 | S | S | * | . | S | Bend | trans | -105.8 | -12 | 179.8 | -59.8 | 0 | 0 | 0 | 0 | 113.1 | D211 | S207-D211 PolarHBondContact N-OD2 2.77Š|
| 208 | G | 95.8 | Very high | 93.7 | Very high | 7 Ų | 7 | 61.3 Ų | 61.3 | 7% | 0.072 | 32% | 0.324 | C | S | . | . | B | Isolated β-bridge | trans | 152.8 | -173.8 | 173 | 0 | 0 | 0 | 0 | 0 | 112.2 | C204 G210 D211 C227 | C204-G208 CarbonylContact O-C 3.28Å; C204-G208 WeakPolarHBondContact O-CA 3.45Å; C204-G208 PolarHBondContact O-N 3.48Å; G208-G210 PolarHBondContact O-N 2.9Å; G208-G210 VanDerWaalsContact O-N 3.12Å; G208-D211 PolarHBondContact N-OD2 3.48Å; G208-D211 VanDerWaalsContact O-CG 3.27Å; G208-D211 PolarHBondContact O-N 2.99Å; G208-C227 WeakPolarHBondContact CA-O 3.41Å |
| 209 | C | 94.2 | Very high | 93.7 | Very high | 9 Ų | 9 | 66.5 Ų | 66.5 | 6% | 0.061 | 34% | 0.343 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -27.8 | 177.9 | -74.6 | 0 | 0 | 0 | 0 | 114.7 | C204 D211 F212 R219 C227 | C204-C209 VanDerWaalsContact CB-SG 3.54Å; C204-C209 PolarHBondContact SG-SG 2.78Å; C209-D211 PolarHBondContact O-N 3.47Å; C209-D211 VanDerWaalsContact O-N 3.16Å; C209-F212 PolarHBondContact O-N 2.94Å; C209-R219 PolarHBondContact SG-NE 2.82Å; C209-C227 HydrophobicContact CB-CB 3.69Å; C209-C227 WeakPolarHBondContact CB-SG 3.43Å; C209-C227 PolarHBondContact N-O 3.38Å; C209-C227 WeakPolarHBondContact SG-CA 3.5Å; C209-C227 WeakPolarHBondContact SG-CB 3.4Å; C209-C227 CovalentContact SG-SG 2.03Å; C209-C227 PolarHBondContact SG-SG 3.36Å |
| 210 | G | 94.4 | Very high | 93.7 | Very high | 32 Ų | 32 | 62.4 Ų | 62.4 | 33% | 0.33 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -63.2 | -17.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | G208 F212 D213 Q214 | G208-G210 PolarHBondContact O-N 2.9Å; G208-G210 VanDerWaalsContact O-N 3.12Å; G210-F212 VanDerWaalsContact C-N 3.31Å; G210-F212 PolarHBondContact O-N 3Å; G210-D213 PolarHBondContact O-N 2.7Å; G210-Q214 VanDerWaalsContact O-CG 3.29Å; G210-Q214 WeakPolarHBondContact O-CG 3.06Å; G210-Q214 PolarHBondContact O-N 3.36Å |
| 211 | D | 95.2 | Very high | 93.8 | Very high | 24 Ų | 24 | 71.1 Ų | 71.1 | 13% | 0.128 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -65.4 | -35.6 | 177.9 | -58.6 | -20.2 | 0 | 0 | 0 | 111.7 | V180 S206 S207 G208 C209 | V180-D211 HydrophobicContact CG1-CB 4Å; S206-D211 WeakPolarHBondContact CA-OD2 2.92Å; S206-D211 WeakPolarHBondContact CB-OD2 3.21Å; S206-D211 PolarHBondContact N-OD2 3.49Å; S207-D211 PolarHBondContact N-OD2 2.77Å; G208-D211 PolarHBondContact N-OD2 3.48Å; G208-D211 VanDerWaalsContact O-CG 3.27Å; G208-D211 PolarHBondContact O-N 2.99Å; C209-D211 PolarHBondContact O-N 3.47Å; C209-D211 VanDerWaalsContact O-N 3.16Å |
| 212 | F | 94.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 69.1 Ų | 69.1 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -72.7 | -38.1 | 174.5 | -69.7 | -79.4 | 0 | 0 | 0 | 111.7 | V180 Y183 L194 H198 C209 G210 Q214 L215 R216 L217 P220 | V180-F212 HydrophobicContact CG1-CD1 4.14Å; V180-F212 HydrophobicContact CG1-CE1 3.95Å; V180-F212 HydrophobicContact CG1-CE2 4.4Å; V180-F212 HydrophobicContact CG1-CG 4.45Å; V180-F212 HydrophobicContact CG1-CZ 4.07Å; V180-F212 HydrophobicContact CG2-CZ 4.39Å; Y183-F212 HydrophobicContact CD1-CE1 4.49Å; Y183-F212 HydrophobicContact CG-CE1 4.24Å; L194-F212 HydrophobicContact CD2-CZ 4.05Å; H198-F212 AromaticContact CE1-CE2 3.99Å; H198-F212 AromaticContact CE1-CZ 3.86Å; C209-F212 PolarHBondContact O-N 2.94Å; G210-F212 VanDerWaalsContact C-N 3.31Å; G210-F212 PolarHBondContact O-N 3Å; F212-Q214 PolarHBondContact O-N 3.06Å; F212-L215 CarbonylContact O-C 3.56Å; F212-L215 PolarHBondContact O-N 3.26Å; F212-R216 PolarHBondContact O-N 2.88Å; F212-R216 VanDerWaalsContact O-N 3.15Å; F212-L217 HydrophobicContact CB-CB 4.49Å; F212-L217 HydrophobicContact CD1-CB 4.19Å; F212-L217 PolarHBondContact O-N 2.93Å; F212-P220 HydrophobicContact CE1-CG 4.28Å; F212-P220 HydrophobicContact CE2-CG 4.28Å; F212-P220 HydrophobicContact CZ-CG 3.85Å |
| 213 | D | 92.3 | Very high | 93.7 | Very high | 97 Ų | 97 | 62.1 Ų | 62.1 | 52% | 0.519 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -64.7 | -40.5 | 179.8 | -61 | -32 | 0 | 0 | 0 | 111.1 | G210 L215 R216 | G210-D213 PolarHBondContact O-N 2.7Å; D213-L215 PolarHBondContact O-N 2.98Å; D213-R216 PolarHBondContact O-N 2.75Å |
| 214 | Q | 93 | Very high | 93.5 | Very high | 161 Ų | 161 | 63.7 Ų | 63.7 | 75% | 0.752 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -60.6 | -33.5 | 175.5 | -73.4 | 173.6 | 32.5 | 0 | 0 | 112.8 | G210 F212 R216 | G210-Q214 VanDerWaalsContact O-CG 3.29Å; G210-Q214 WeakPolarHBondContact O-CG 3.06Å; G210-Q214 PolarHBondContact O-N 3.36Å; F212-Q214 PolarHBondContact O-N 3.06Å; Q214-R216 VanDerWaalsContact C-N 3.34Å |
| 215 | L | 92.6 | Very high | 93.3 | Very high | 81 Ų | 81 | 71.2 Ų | 71.2 | 42% | 0.424 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.7 | 0.3 | 178 | -65.9 | 166.8 | 0 | 0 | 0 | 113.2 | V180 F212 D213 L217 | V180-L215 HydrophobicContact CG1-CD1 3.86Å; F212-L215 CarbonylContact O-C 3.56Å; F212-L215 PolarHBondContact O-N 3.26Å; D213-L215 PolarHBondContact O-N 2.98Å; L215-L217 HydrophobicContact CB-CB 4.45Å; L215-L217 HydrophobicContact CB-CD1 3.75Å; L215-L217 HydrophobicContact CB-CG 3.77Å; L215-L217 HydrophobicContact CD1-CD1 4.01Å; L215-L217 PolarHBondContact O-N 2.97Å |
| 216 | R | 92.6 | Very high | 93.2 | Very high | 237 Ų | 237 | 76.4 Ų | 76.4 | 89% | 0.894 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.7 | 35.7 | -173 | -55.3 | -179.2 | 177.2 | 173 | -0.9 | 112.8 | F212 D213 Q214 | F212-R216 PolarHBondContact O-N 2.88Å; F212-R216 VanDerWaalsContact O-N 3.15Å; D213-R216 PolarHBondContact O-N 2.75Å; Q214-R216 VanDerWaalsContact C-N 3.34Å |
| 217 | L | 91.1 | Very high | 93.1 | Very high | 38 Ų | 38 | 78.1 Ų | 78.1 | 20% | 0.199 | 39% | 0.392 | C | S | . | . | P | Polyproline II helix | trans | -102.1 | 147.9 | 178.9 | -64.2 | 177.4 | 0 | 0 | 0 | 110.3 | Y184 F212 L215 | Y184-L217 HydrophobicContact CD2-CB 4.13Å; Y184-L217 HydrophobicContact CD2-CD1 4.05Å; Y184-L217 HydrophobicContact CD2-CD2 3.77Å; Y184-L217 HydrophobicContact CD2-CG 4.19Å; Y184-L217 HydrophobicContact CE2-CB 3.99Å; Y184-L217 HydrophobicContact CE2-CD2 4.41Å; F212-L217 HydrophobicContact CB-CB 4.49Å; F212-L217 HydrophobicContact CD1-CB 4.19Å; F212-L217 PolarHBondContact O-N 2.93Å; L215-L217 HydrophobicContact CB-CB 4.45Å; L215-L217 HydrophobicContact CB-CD1 3.75Å; L215-L217 HydrophobicContact CB-CG 3.77Å; L215-L217 HydrophobicContact CD1-CD1 4.01Å; L215-L217 PolarHBondContact O-N 2.97Å |
| 218 | T | 91.9 | Very high | 93.1 | Very high | 112 Ų | 112 | 77.3 Ų | 77.3 | 69% | 0.687 | 38% | 0.379 | S | S | * | . | P | Polyproline II helix | trans | -73.5 | 134.3 | 172.4 | -57.2 | 0 | 0 | 0 | 0 | 109.3 | Y184 | Y184-T218 VanDerWaalsContact CE2-O 3.31Å; Y184-T218 WeakPolarHBondContact CE2-O 3.49Å; Y184-T218 PolarHBondContact OH-O 3.43Å |
| 219 | R | 92.5 | Very high | 93 | Very high | 108 Ų | 108 | 77.2 Ų | 77.2 | 41% | 0.408 | 38% | 0.378 | S | S | . | . | P | Polyproline II helix | trans | -61.1 | 133.7 | 175.3 | -170.9 | -173.1 | -54.7 | 164.4 | 3.4 | 110.7 | C209 C223 C227 | C209-R219 PolarHBondContact SG-NE 2.82Å; R219-C223 HydrophobicContact CG-CB 3.72Å; R219-C223 VanDerWaalsContact CG-SG 3.57Å; R219-C227 VanDerWaalsContact CZ-SG 3.53Å; R219-C227 PolarHBondContact NH1-SG 3.05Å |
| 220 | P | 92.3 | Very high | 93.1 | Very high | 8 Ų | 8 | 76.8 Ų | 76.8 | 5% | 0.052 | 38% | 0.375 | C | S | . | . | P | Polyproline II helix | trans | -70.4 | 153.1 | 177.3 | 30.1 | -35.4 | 0 | 0 | 0 | 111.8 | Y183 F212 S222 C223 | Y183-P220 HydrophobicContact CE1-CB 3.79Å; Y183-P220 HydrophobicContact CE1-CG 4.31Å; Y183-P220 HydrophobicContact CE2-CB 4.18Å; Y183-P220 HydrophobicContact CE2-CG 4.25Å; Y183-P220 VanDerWaalsContact CZ-CB 3.43Å; Y183-P220 WeakPolarHBondContact OH-CB 3.48Å; F212-P220 HydrophobicContact CE1-CG 4.28Å; F212-P220 HydrophobicContact CE2-CG 4.28Å; F212-P220 HydrophobicContact CZ-CG 3.85Å; P220-S222 PolarHBondContact O-N 3.02Å; P220-C223 WeakPolarHBondContact O-CB 3.27Å; P220-C223 PolarHBondContact O-N 2.93Å |
| 221 | R | 92 | Very high | 93.1 | Very high | 260 Ų | 260 | 79.7 Ų | 79.7 | 98% | 0.981 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.2 | -16.5 | 178.3 | -66.4 | -175.5 | -177.5 | 177.6 | 1.1 | 113.4 | C223 | R221-C223 VanDerWaalsContact C-N 3.28Š|
| 222 | S | 91.9 | Very high | 93.1 | Very high | 25 Ų | 25 | 82.9 Ų | 82.9 | 18% | 0.175 | 39% | 0.393 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.7 | -18.5 | 176.9 | 58.1 | 0 | 0 | 0 | 0 | 113.5 | D195 H198 P220 | D195-S222 VanDerWaalsContact OD1-CB 3.27Å; D195-S222 WeakPolarHBondContact OD1-CB 3.27Å; D195-S222 PolarHBondContact OD1-OG 3.17Å; H198-S222 VanDerWaalsContact CB-O 3.27Å; H198-S222 WeakPolarHBondContact CB-O 3.44Å; H198-S222 PolarHBondContact ND1-OG 3.31Å; P220-S222 PolarHBondContact O-N 3.02Å |
| 223 | C | 94.5 | Very high | 93.1 | Very high | 20 Ų | 20 | 85.7 Ų | 85.7 | 14% | 0.135 | 40% | 0.403 | C | S | . | . | S | Bend | trans | -65.9 | 138.6 | -178.6 | -83.6 | 0 | 0 | 0 | 0 | 112.4 | H198 C204 R219 P220 R221 | H198-C223 PolarHBondContact CE1-SG 3.37Å; C204-C223 HydrophobicContact CB-CB 3.54Å; C204-C223 WeakPolarHBondContact CB-SG 3.32Å; C204-C223 WeakPolarHBondContact SG-CB 3.48Å; C204-C223 CovalentContact SG-SG 2.04Å; C204-C223 PolarHBondContact SG-SG 3.48Å; R219-C223 HydrophobicContact CG-CB 3.72Å; R219-C223 VanDerWaalsContact CG-SG 3.57Å; P220-C223 WeakPolarHBondContact O-CB 3.27Å; P220-C223 PolarHBondContact O-N 2.93Å; R221-C223 VanDerWaalsContact C-N 3.28Å |
| 224 | D | 92.9 | Very high | 93.2 | Very high | 33 Ų | 33 | 81.5 Ų | 81.5 | 18% | 0.176 | 38% | 0.381 | C | S | . | . | trans | -69.7 | 153.5 | 174.2 | -167.7 | 71.9 | 0 | 0 | 0 | 112.4 | R202 C203 D226 C227 | R202-D224 HydrophobicContact CB-CB 4.21Å; C203-D224 PolarHBondContact O-N 3.35Å; D224-D226 VanDerWaalsContact C-N 3.31Å; D224-D226 PolarHBondContact O-N 3.43Å; D224-D226 WeakPolarHBondContact OD2-CB 3.27Å; D224-D226 PolarHBondContact OD2-N 3.12Å; D224-D226 VanDerWaalsContact OD2-N 3.1Å; D224-C227 PolarHBondContact O-N 3.32Å | ||
| 225 | I | 91.3 | Very high | 93.1 | Very high | 157 Ų | 157 | 76 Ų | 76 | 81% | 0.805 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.7 | -32.4 | -176.2 | -57.9 | 170.8 | 0 | 0 | 0 | 111 | C227 | I225-C227 PolarHBondContact O-N 2.98Š|
| 226 | D | 92.1 | Very high | 93.1 | Very high | 109 Ų | 109 | 77.9 Ų | 77.9 | 58% | 0.583 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.7 | -11.6 | -177.2 | -65.7 | -23 | 0 | 0 | 0 | 112.7 | D224 E228 | D224-D226 VanDerWaalsContact C-N 3.31Å; D224-D226 PolarHBondContact O-N 3.43Å; D224-D226 WeakPolarHBondContact OD2-CB 3.27Å; D224-D226 PolarHBondContact OD2-N 3.12Å; D224-D226 VanDerWaalsContact OD2-N 3.1Å; D226-E228 PolarHBondContact O-N 3.47Å; D226-E228 VanDerWaalsContact O-N 3.08Å |
| 227 | C | 92.3 | Very high | 93.1 | Very high | 37 Ų | 37 | 68.6 Ų | 68.6 | 25% | 0.25 | 33% | 0.33 | C | S | . | . | trans | 57.5 | 22 | 175.2 | -85.7 | 0 | 0 | 0 | 0 | 115.8 | G208 C209 R219 D224 I225 | G208-C227 WeakPolarHBondContact CA-O 3.41Å; C209-C227 HydrophobicContact CB-CB 3.69Å; C209-C227 WeakPolarHBondContact CB-SG 3.43Å; C209-C227 PolarHBondContact N-O 3.38Å; C209-C227 WeakPolarHBondContact SG-CA 3.5Å; C209-C227 WeakPolarHBondContact SG-CB 3.4Å; C209-C227 CovalentContact SG-SG 2.03Å; C209-C227 PolarHBondContact SG-SG 3.36Å; R219-C227 VanDerWaalsContact CZ-SG 3.53Å; R219-C227 PolarHBondContact NH1-SG 3.05Å; D224-C227 PolarHBondContact O-N 3.32Å; I225-C227 PolarHBondContact O-N 2.98Å | ||
| 228 | E | 95.3 | Very high | 93 | Very high | 68 Ų | 68 | 71 Ų | 71 | 32% | 0.318 | 34% | 0.342 | S | S | . | . | B | Isolated β-bridge | trans | -71.4 | 143 | 175.5 | -72.1 | -168.7 | -151 | 0 | 0 | 112.4 | C203 C204 D226 R233 | C203-E228 CarbonylContact C-O 3.14Å; C203-E228 VanDerWaalsContact CA-O 3.28Å; C203-E228 WeakPolarHBondContact CA-O 3.29Å; C203-E228 VanDerWaalsContact CB-O 3.31Å; C203-E228 WeakPolarHBondContact CB-O 3.49Å; C204-E228 PolarHBondContact N-O 2.97Å; D226-E228 PolarHBondContact O-N 3.47Å; D226-E228 VanDerWaalsContact O-N 3.08Å; E228-R233 HydrophobicContact CB-CG 4.43Å; E228-R233 IonicContact OE1-CZ 3.09Å; E228-R233 IonicContact OE1-NE 3.73Å; E228-R233 IonicContact OE1-NH2 3.85Å; E228-R233 PolarHBondContact OE1-NH2 2.84Å; E228-R233 IonicContact OE2-CZ 2.77Å; E228-R233 VanDerWaalsContact OE2-CZ 3.27Å; E228-R233 IonicContact OE2-NE 3.27Å; E228-R233 PolarHBondContact OE2-NE 3.22Å; E228-R233 IonicContact OE2-NH2 3.94Å; E228-R233 PolarHBondContact OE2-NH2 3.44Å; E228-R233 VanDerWaalsContact OE2-NH2 3.09Å |
| 229 | G | 95.1 | Very high | 93 | Very high | 6 Ų | 6 | 72.9 Ų | 72.9 | 6% | 0.062 | 34% | 0.337 | C | S | . | . | trans | -66.3 | 136 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | S206 R231 L232 R233 | S206-G229 CarbonylContact O-C 3.49Å; S206-G229 WeakPolarHBondContact O-CA 3.21Å; G229-R231 VanDerWaalsContact C-N 3.27Å; G229-R231 PolarHBondContact O-N 3.46Å; G229-L232 PolarHBondContact O-N 3.45Å; G229-R233 PolarHBondContact O-N 2.86Å | ||
| 230 | C | 95.6 | Very high | 92.9 | Very high | 0 Ų | 0 | 72.3 Ų | 72.3 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64.8 | -29.9 | 179.5 | -66 | 0 | 0 | 0 | 0 | 113.2 | L176 H198 C203 G205 S206 L232 R233 I234 | L176-C230 HydrophobicContact CD1-CB 4.24Å; L176-C230 HydrophobicContact CD2-CB 4.27Å; H198-C230 VanDerWaalsContact CD2-SG 3.53Å; C203-C230 HydrophobicContact CB-CB 3.88Å; C203-C230 WeakPolarHBondContact CB-SG 3.23Å; C203-C230 WeakPolarHBondContact SG-CA 3.49Å; C203-C230 WeakPolarHBondContact SG-CB 3.32Å; C203-C230 CovalentContact SG-SG 2.03Å; C203-C230 PolarHBondContact SG-SG 3.5Å; G205-C230 WeakPolarHBondContact O-CB 3.38Å; G205-C230 PolarHBondContact O-N 3.04Å; G205-C230 PolarHBondContact O-SG 2.03Å; S206-C230 PolarHBondContact O-N 3.49Å; C230-L232 VanDerWaalsContact C-N 3.27Å; C230-L232 PolarHBondContact O-N 3.37Å; C230-R233 PolarHBondContact O-N 3.1Å; C230-I234 HydrophobicContact CB-CD1 3.94Å; C230-I234 VanDerWaalsContact O-CB 3.24Å; C230-I234 WeakPolarHBondContact O-CB 3.45Å; C230-I234 WeakPolarHBondContact O-CD1 3.41Å; C230-I234 WeakPolarHBondContact O-CG1 3.36Å; C230-I234 PolarHBondContact O-N 3Å |
| 231 | R | 95 | Very high | 92.8 | Very high | 93 Ų | 93 | 73.8 Ų | 73.8 | 35% | 0.351 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -56.7 | -43.8 | 177.3 | -174.7 | 179.2 | 177.2 | -179.3 | -1 | 111.4 | N170 L176 S206 G229 F235 | N170-R231 PolarHBondContact OD1-NH2 3.3Å; L176-R231 HydrophobicContact CD1-CB 3.98Å; S206-R231 VanDerWaalsContact O-CB 3.22Å; S206-R231 WeakPolarHBondContact O-CB 3.36Å; S206-R231 PolarHBondContact O-N 3.1Å; G229-R231 VanDerWaalsContact C-N 3.27Å; G229-R231 PolarHBondContact O-N 3.46Å; R231-F235 WeakPolarHBondContact O-CB 3.44Å; R231-F235 PolarHBondContact O-N 3.32Å; R231-F235 VanDerWaalsContact O-N 3.1Å |
| 232 | L | 93.8 | Very high | 92.7 | Very high | 91 Ų | 91 | 65.9 Ų | 65.9 | 48% | 0.476 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -70.2 | -47.8 | 179.6 | -179.3 | 64.6 | 0 | 0 | 0 | 111.9 | G229 C230 F235 R236 | G229-L232 PolarHBondContact O-N 3.45Å; C230-L232 VanDerWaalsContact C-N 3.27Å; C230-L232 PolarHBondContact O-N 3.37Å; L232-F235 PolarHBondContact O-N 3.22Å; L232-R236 WeakPolarHBondContact O-CB 3.05Å; L232-R236 PolarHBondContact O-N 2.94Å |
| 233 | R | 94.9 | Very high | 92.6 | Very high | 59 Ų | 59 | 68.5 Ų | 68.5 | 22% | 0.223 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -65.1 | -45.5 | -177.9 | -73.6 | -83.3 | 179 | 129.9 | -2.6 | 111.8 | F201 C203 E228 G229 C230 R236 A237 | F201-R233 HydrophobicContact CB-CB 4.24Å; C203-R233 HydrophobicContact CB-CB 4.21Å; C203-R233 HydrophobicContact CB-CG 4.12Å; E228-R233 HydrophobicContact CB-CG 4.43Å; E228-R233 IonicContact OE1-CZ 3.09Å; E228-R233 IonicContact OE1-NE 3.73Å; E228-R233 IonicContact OE1-NH2 3.85Å; E228-R233 PolarHBondContact OE1-NH2 2.84Å; E228-R233 IonicContact OE2-CZ 2.77Å; E228-R233 VanDerWaalsContact OE2-CZ 3.27Å; E228-R233 IonicContact OE2-NE 3.27Å; E228-R233 PolarHBondContact OE2-NE 3.22Å; E228-R233 IonicContact OE2-NH2 3.94Å; E228-R233 PolarHBondContact OE2-NH2 3.44Å; E228-R233 VanDerWaalsContact OE2-NH2 3.09Å; G229-R233 PolarHBondContact O-N 2.86Å; C230-R233 PolarHBondContact O-N 3.1Å; R233-R236 PolarHBondContact O-N 3.44Å; R233-A237 WeakPolarHBondContact O-CB 3.31Å; R233-A237 PolarHBondContact O-N 3.43Å |
| 234 | I | 93.9 | Very high | 92.5 | Very high | 9 Ų | 9 | 72 Ų | 72 | 5% | 0.046 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -63.7 | -45.8 | 176.3 | -64.9 | 165.5 | 0 | 0 | 0 | 110 | L172 L176 L197 F201 C230 R236 A237 L238 | L172-I234 HydrophobicContact CD1-CG2 4.44Å; L172-I234 HydrophobicContact CD2-CB 4.11Å; L172-I234 HydrophobicContact CD2-CG2 3.55Å; L176-I234 HydrophobicContact CD1-CD1 4.13Å; L176-I234 HydrophobicContact CD2-CD1 4.19Å; L197-I234 HydrophobicContact CD2-CD1 3.96Å; F201-I234 HydrophobicContact CB-CG1 4.34Å; F201-I234 HydrophobicContact CD1-CG1 4.08Å; F201-I234 HydrophobicContact CD2-CD1 4.23Å; F201-I234 HydrophobicContact CD2-CG1 3.57Å; F201-I234 HydrophobicContact CE1-CG1 4.28Å; F201-I234 HydrophobicContact CE2-CD1 4.43Å; F201-I234 HydrophobicContact CE2-CG1 3.78Å; F201-I234 HydrophobicContact CG-CG1 3.72Å; F201-I234 HydrophobicContact CZ-CG1 4.13Å; F201-I234 HydrophobicContact CZ-CG2 4.49Å; C230-I234 HydrophobicContact CB-CD1 3.94Å; C230-I234 VanDerWaalsContact O-CB 3.24Å; C230-I234 WeakPolarHBondContact O-CB 3.45Å; C230-I234 WeakPolarHBondContact O-CD1 3.41Å; C230-I234 WeakPolarHBondContact O-CG1 3.36Å; C230-I234 PolarHBondContact O-N 3Å; I234-R236 VanDerWaalsContact C-N 3.34Å; I234-R236 PolarHBondContact O-N 3.33Å; I234-A237 PolarHBondContact O-N 3.32Å; I234-L238 HydrophobicContact CG2-CD1 3.85Å; I234-L238 HydrophobicContact CG2-CG 4.07Å; I234-L238 WeakPolarHBondContact O-CB 3.17Å; I234-L238 VanDerWaalsContact O-CG 3.31Å; I234-L238 WeakPolarHBondContact O-CG 3.24Å; I234-L238 PolarHBondContact O-N 3.09Å |
| 235 | F | 91.5 | Very high | 92.5 | Very high | 46 Ų | 46 | 75.2 Ų | 75.2 | 20% | 0.202 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -64.6 | -38.8 | -179.8 | -179.4 | -119.5 | 0 | 0 | 0 | 113 | E169 R231 L232 L238 R239 | E169-F235 HydrophobicContact CG-CD2 3.5Å; E169-F235 VanDerWaalsContact CG-CD2 3.5Å; E169-F235 HydrophobicContact CG-CE2 3.31Å; E169-F235 HydrophobicContact CG-CG 4.35Å; E169-F235 HydrophobicContact CG-CZ 3.98Å; E169-F235 WeakPolarHBondContact OE1-CE2 3.28Å; E169-F235 WeakPolarHBondContact OE1-CZ 3.02Å; E169-F235 WeakPolarHBondContact OE2-CZ 3.36Å; R231-F235 WeakPolarHBondContact O-CB 3.44Å; R231-F235 PolarHBondContact O-N 3.32Å; R231-F235 VanDerWaalsContact O-N 3.1Å; L232-F235 PolarHBondContact O-N 3.22Å; F235-L238 PolarHBondContact O-N 2.68Å; F235-R239 WeakPolarHBondContact O-CB 3.24Å; F235-R239 PolarHBondContact O-N 2.92Å |
| 236 | R | 92.6 | Very high | 92.5 | Very high | 120 Ų | 120 | 70.2 Ų | 70.2 | 45% | 0.453 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -60.5 | -46.9 | 173 | -172.3 | 178.4 | -69.3 | 126.7 | -3.4 | 111 | L232 R233 I234 L238 R239 D240 | L232-R236 WeakPolarHBondContact O-CB 3.05Å; L232-R236 PolarHBondContact O-N 2.94Å; R233-R236 PolarHBondContact O-N 3.44Å; I234-R236 VanDerWaalsContact C-N 3.34Å; I234-R236 PolarHBondContact O-N 3.33Å; R236-L238 PolarHBondContact O-N 2.94Å; R236-R239 WeakPolarHBondContact O-CB 3.3Å; R236-R239 PolarHBondContact O-N 2.97Å; R236-D240 PolarHBondContact O-N 2.94Å |
| 237 | A | 91.7 | Very high | 92.6 | Very high | 41 Ų | 41 | 69 Ų | 69 | 34% | 0.339 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -64.4 | -39.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113 | F201 R233 I234 R239 D240 G241 | F201-A237 HydrophobicContact CD1-CB 4Å; F201-A237 HydrophobicContact CE1-CB 3.57Å; R233-A237 WeakPolarHBondContact O-CB 3.31Å; R233-A237 PolarHBondContact O-N 3.43Å; I234-A237 PolarHBondContact O-N 3.32Å; A237-R239 VanDerWaalsContact C-N 3.35Å; A237-D240 PolarHBondContact O-N 2.77Å; A237-G241 PolarHBondContact O-N 2.89Å |
| 238 | L | 90.6 | Very high | 92.7 | Very high | 89 Ų | 89 | 71 Ų | 71 | 47% | 0.466 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -64.7 | -39 | 174.7 | -75.3 | 176.1 | 0 | 0 | 0 | 111.5 | L172 I234 F235 R236 G241 F242 | L172-L238 HydrophobicContact CD2-CD1 4.22Å; I234-L238 HydrophobicContact CG2-CD1 3.85Å; I234-L238 HydrophobicContact CG2-CG 4.07Å; I234-L238 WeakPolarHBondContact O-CB 3.17Å; I234-L238 VanDerWaalsContact O-CG 3.31Å; I234-L238 WeakPolarHBondContact O-CG 3.24Å; I234-L238 PolarHBondContact O-N 3.09Å; F235-L238 PolarHBondContact O-N 2.68Å; R236-L238 PolarHBondContact O-N 2.94Å; L238-G241 PolarHBondContact O-N 2.53Å; L238-F242 VanDerWaalsContact O-CB 3.22Å; L238-F242 WeakPolarHBondContact O-CB 3.31Å; L238-F242 PolarHBondContact O-N 2.92Å |
| 239 | R | 90.2 | Very high | 92.7 | Very high | 151 Ų | 151 | 70.4 Ų | 70.4 | 57% | 0.57 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -63.2 | -49 | 176.4 | -179.2 | 174.3 | -67.8 | -173.6 | -6.3 | 111.1 | F235 R236 A237 G241 F242 T243 | F235-R239 WeakPolarHBondContact O-CB 3.24Å; F235-R239 PolarHBondContact O-N 2.92Å; R236-R239 WeakPolarHBondContact O-CB 3.3Å; R236-R239 PolarHBondContact O-N 2.97Å; A237-R239 VanDerWaalsContact C-N 3.35Å; R239-G241 VanDerWaalsContact C-N 3.34Å; R239-G241 PolarHBondContact O-N 3.01Å; R239-F242 PolarHBondContact O-N 3.34Å; R239-T243 WeakPolarHBondContact O-CG2 3.49Å; R239-T243 PolarHBondContact O-N 3.49Å; R239-T243 VanDerWaalsContact O-N 3.11Å |
| 240 | D | 90.7 | Very high | 92.7 | Very high | 97 Ų | 97 | 73.3 Ų | 73.3 | 52% | 0.519 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.1 | -44.7 | 176.9 | -65.5 | -19.8 | 0 | 0 | 0 | 110.5 | R236 A237 F242 T243 V244 | R236-D240 PolarHBondContact O-N 2.94Å; A237-D240 PolarHBondContact O-N 2.77Å; D240-F242 VanDerWaalsContact C-N 3.34Å; D240-F242 PolarHBondContact O-N 2.89Å; D240-T243 PolarHBondContact O-N 3.13Å; D240-T243 PolarHBondContact O-OG1 3.08Å; D240-V244 PolarHBondContact O-N 3.3Å |
| 241 | G | 90.3 | Very high | 92.7 | Very high | 38 Ų | 38 | 80 Ų | 80 | 39% | 0.392 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -60.6 | -38.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | A237 L238 R239 T243 V244 L245 | A237-G241 PolarHBondContact O-N 2.89Å; L238-G241 PolarHBondContact O-N 2.53Å; R239-G241 VanDerWaalsContact C-N 3.34Å; R239-G241 PolarHBondContact O-N 3.01Å; G241-T243 VanDerWaalsContact C-N 3.32Å; G241-T243 PolarHBondContact O-N 2.94Å; G241-V244 PolarHBondContact O-N 2.71Å; G241-L245 VanDerWaalsContact O-CB 3.3Å; G241-L245 WeakPolarHBondContact O-CB 2.92Å; G241-L245 PolarHBondContact O-N 2.04Å |
| 242 | F | 89.9 | Confident | 92.7 | Very high | 95 Ų | 95 | 78.3 Ų | 78.3 | 42% | 0.417 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -66.3 | -34.5 | 177.4 | -168.6 | -91.5 | 0 | 0 | 0 | 111.6 | L238 R239 D240 L245 S246 | L238-F242 VanDerWaalsContact O-CB 3.22Å; L238-F242 WeakPolarHBondContact O-CB 3.31Å; L238-F242 PolarHBondContact O-N 2.92Å; R239-F242 PolarHBondContact O-N 3.34Å; D240-F242 VanDerWaalsContact C-N 3.34Å; D240-F242 PolarHBondContact O-N 2.89Å; F242-L245 PolarHBondContact O-N 3.09Å; F242-S246 WeakPolarHBondContact O-CB 3.36Å; F242-S246 PolarHBondContact O-N 3.25Å |
| 243 | T | 89.9 | Confident | 92.8 | Very high | 80 Ų | 80 | 75.1 Ų | 75.1 | 49% | 0.491 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63 | -46.5 | 174 | 67 | 0 | 0 | 0 | 0 | 111.4 | R239 D240 G241 S246 V247 | R239-T243 WeakPolarHBondContact O-CG2 3.49Å; R239-T243 PolarHBondContact O-N 3.49Å; R239-T243 VanDerWaalsContact O-N 3.11Å; D240-T243 PolarHBondContact O-N 3.13Å; D240-T243 PolarHBondContact O-OG1 3.08Å; G241-T243 VanDerWaalsContact C-N 3.32Å; G241-T243 PolarHBondContact O-N 2.94Å; T243-S246 PolarHBondContact O-N 2.89Å; T243-V247 WeakPolarHBondContact O-CG2 3.39Å; T243-V247 PolarHBondContact O-N 3.47Å; T243-V247 VanDerWaalsContact O-N 3.09Å |
| 244 | V | 93.4 | Very high | 92.9 | Very high | 94 Ų | 94 | 77.1 Ų | 77.1 | 57% | 0.57 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -64.5 | -45.6 | 177.2 | 179.1 | 0 | 0 | 0 | 0 | 110.7 | D240 G241 S246 V247 V248 | D240-V244 PolarHBondContact O-N 3.3Å; G241-V244 PolarHBondContact O-N 2.71Å; V244-S246 VanDerWaalsContact C-N 3.33Å; V244-S246 PolarHBondContact O-N 3.2Å; V244-V247 PolarHBondContact O-N 3.18Å; V244-V248 WeakPolarHBondContact O-CG2 3.13Å; V244-V248 PolarHBondContact O-N 3.48Å |
| 245 | L | 91.5 | Very high | 92.8 | Very high | 99 Ų | 99 | 78.6 Ų | 78.6 | 52% | 0.518 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -61.3 | -41 | 178.1 | -177.8 | 62.7 | 0 | 0 | 0 | 111.6 | G241 F242 V248 F249 | G241-L245 VanDerWaalsContact O-CB 3.3Å; G241-L245 WeakPolarHBondContact O-CB 2.92Å; G241-L245 PolarHBondContact O-N 2.04Å; F242-L245 PolarHBondContact O-N 3.09Å; L245-V248 PolarHBondContact O-N 3.39Å; L245-F249 WeakPolarHBondContact O-CB 3.15Å; L245-F249 PolarHBondContact O-N 3.38Å |
| 246 | S | 91.9 | Very high | 93 | Very high | 53 Ų | 53 | 77.5 Ų | 77.5 | 37% | 0.371 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -63.3 | -39.9 | 177 | -179.4 | 0 | 0 | 0 | 0 | 112.1 | F242 T243 V244 F249 T250 | F242-S246 WeakPolarHBondContact O-CB 3.36Å; F242-S246 PolarHBondContact O-N 3.25Å; T243-S246 PolarHBondContact O-N 2.89Å; V244-S246 VanDerWaalsContact C-N 3.33Å; V244-S246 PolarHBondContact O-N 3.2Å; S246-F249 PolarHBondContact O-N 2.84Å; S246-T250 WeakPolarHBondContact O-CB 2.87Å; S246-T250 PolarHBondContact O-N 2.97Å; S246-T250 PolarHBondContact O-OG1 2.87Å |
| 247 | V | 94.7 | Very high | 93.2 | Very high | 82 Ų | 82 | 75.4 Ų | 75.4 | 50% | 0.497 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -62.1 | -52.2 | 173.6 | 173.2 | 0 | 0 | 0 | 0 | 110.1 | T243 V244 F249 T250 F251 | T243-V247 WeakPolarHBondContact O-CG2 3.39Å; T243-V247 PolarHBondContact O-N 3.47Å; T243-V247 VanDerWaalsContact O-N 3.09Å; V244-V247 PolarHBondContact O-N 3.18Å; V247-F249 VanDerWaalsContact C-N 3.33Å; V247-F249 PolarHBondContact O-N 3.2Å; V247-T250 WeakPolarHBondContact O-CB 3.33Å; V247-T250 PolarHBondContact O-N 3.19Å; V247-F251 HydrophobicContact CG1-CD2 3.81Å; V247-F251 HydrophobicContact CG1-CE2 3.59Å; V247-F251 WeakPolarHBondContact O-CD2 3.35Å; V247-F251 PolarHBondContact O-N 3.33Å; V247-F251 VanDerWaalsContact O-N 3.07Å |
| 248 | V | 94.3 | Very high | 93.3 | Very high | 80 Ų | 80 | 79.7 Ų | 79.7 | 49% | 0.485 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -58.6 | -45.5 | 178 | 174.6 | 0 | 0 | 0 | 0 | 111.2 | V244 L245 T250 F251 V252 | V244-V248 WeakPolarHBondContact O-CG2 3.13Å; V244-V248 PolarHBondContact O-N 3.48Å; L245-V248 PolarHBondContact O-N 3.39Å; V248-T250 VanDerWaalsContact C-N 3.31Å; V248-T250 PolarHBondContact O-N 3.29Å; V248-F251 PolarHBondContact O-N 3.49Å; V248-V252 HydrophobicContact CG1-CG2 4.4Å; V248-V252 WeakPolarHBondContact O-CG2 3.48Å; V248-V252 PolarHBondContact O-N 2.94Å |
| 249 | F | 94.4 | Very high | 93.4 | Very high | 55 Ų | 55 | 75.9 Ų | 75.9 | 24% | 0.241 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -57.8 | -43.2 | 177.8 | -178 | -87.6 | 0 | 0 | 0 | 111.7 | Q154 L245 S246 V247 V252 L253 | Q154-F249 HydrophobicContact CB-CE2 4.4Å; Q154-F249 HydrophobicContact CG-CD2 3.79Å; Q154-F249 HydrophobicContact CG-CE2 3.14Å; Q154-F249 HydrophobicContact CG-CZ 3.58Å; Q154-F249 VanDerWaalsContact NE2-CD2 3.3Å; Q154-F249 PolarHBondContact NE2-O 2.92Å; Q154-F249 WeakPolarHBondContact O-CE2 3.25Å; Q154-F249 VanDerWaalsContact O-CZ 3.24Å; Q154-F249 WeakPolarHBondContact O-CZ 3.43Å; L245-F249 WeakPolarHBondContact O-CB 3.15Å; L245-F249 PolarHBondContact O-N 3.38Å; S246-F249 PolarHBondContact O-N 2.84Å; V247-F249 VanDerWaalsContact C-N 3.33Å; V247-F249 PolarHBondContact O-N 3.2Å; F249-V252 PolarHBondContact O-N 3.31Å; F249-L253 HydrophobicContact CD1-CD1 3.76Å; F249-L253 HydrophobicContact CD1-CG 4.25Å; F249-L253 HydrophobicContact CE1-CD1 3.35Å; F249-L253 HydrophobicContact CE1-CG 4.06Å; F249-L253 HydrophobicContact CZ-CD1 4.14Å; F249-L253 WeakPolarHBondContact O-CG 3.03Å; F249-L253 PolarHBondContact O-N 3.02Å |
| 250 | T | 95 | Very high | 93.6 | Very high | 68 Ų | 68 | 69.3 Ų | 69.3 | 42% | 0.417 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63 | -44.6 | 176.3 | -58.5 | 0 | 0 | 0 | 0 | 111.5 | S246 V247 V248 V252 L253 L254 | S246-T250 WeakPolarHBondContact O-CB 2.87Å; S246-T250 PolarHBondContact O-N 2.97Å; S246-T250 PolarHBondContact O-OG1 2.87Å; V247-T250 WeakPolarHBondContact O-CB 3.33Å; V247-T250 PolarHBondContact O-N 3.19Å; V248-T250 VanDerWaalsContact C-N 3.31Å; V248-T250 PolarHBondContact O-N 3.29Å; T250-V252 VanDerWaalsContact C-N 3.34Å; T250-V252 PolarHBondContact O-N 3.34Å; T250-L253 PolarHBondContact O-N 3.37Å; T250-L254 HydrophobicContact CG2-CD1 4.34Å; T250-L254 WeakPolarHBondContact O-CG 3.06Å; T250-L254 PolarHBondContact O-N 3.42Å |
| 251 | F | 95.8 | Very high | 93.7 | Very high | 140 Ų | 140 | 68.2 Ų | 68.2 | 61% | 0.614 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -61.9 | -40.4 | 176 | -81.8 | -73.2 | 0 | 0 | 0 | 112.6 | V247 V248 L254 A255 | V247-F251 HydrophobicContact CG1-CD2 3.81Å; V247-F251 HydrophobicContact CG1-CE2 3.59Å; V247-F251 WeakPolarHBondContact O-CD2 3.35Å; V247-F251 PolarHBondContact O-N 3.33Å; V247-F251 VanDerWaalsContact O-N 3.07Å; V248-F251 PolarHBondContact O-N 3.49Å; F251-L254 PolarHBondContact O-N 3.42Å; F251-A255 WeakPolarHBondContact O-CB 3.33Å; F251-A255 PolarHBondContact O-N 2.98Å |
| 252 | V | 94.8 | Very high | 93.8 | Very high | 58 Ų | 58 | 67.7 Ų | 67.7 | 35% | 0.352 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.8 | -48.1 | 176.4 | 173.7 | 0 | 0 | 0 | 0 | 110.7 | Q154 V248 F249 T250 L254 A255 E256 | Q154-V252 VanDerWaalsContact OE1-CG1 3.28Å; V248-V252 HydrophobicContact CG1-CG2 4.4Å; V248-V252 WeakPolarHBondContact O-CG2 3.48Å; V248-V252 PolarHBondContact O-N 2.94Å; F249-V252 PolarHBondContact O-N 3.31Å; T250-V252 VanDerWaalsContact C-N 3.34Å; T250-V252 PolarHBondContact O-N 3.34Å; V252-L254 VanDerWaalsContact C-N 3.31Å; V252-L254 PolarHBondContact O-N 3.12Å; V252-A255 PolarHBondContact O-N 3.21Å; V252-A255 VanDerWaalsContact O-N 3.13Å; V252-E256 HydrophobicContact CG1-CG 4.44Å; V252-E256 WeakPolarHBondContact O-CG 3.36Å; V252-E256 PolarHBondContact O-N 2.83Å |
| 253 | L | 96.4 | Very high | 93.8 | Very high | 24 Ų | 24 | 63.2 Ų | 63.2 | 13% | 0.126 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -59 | -41.4 | 177.4 | -70.8 | 178.9 | 0 | 0 | 0 | 112.4 | F151 Q154 L155 F249 T250 E256 L257 | F151-L253 HydrophobicContact CD2-CD2 3.62Å; F151-L253 HydrophobicContact CE2-CB 4.36Å; F151-L253 HydrophobicContact CE2-CD2 3.7Å; Q154-L253 HydrophobicContact CB-CD2 4.33Å; Q154-L253 HydrophobicContact CG-CD2 4Å; L155-L253 HydrophobicContact CD2-CD1 3.79Å; L155-L253 HydrophobicContact CD2-CD2 4.24Å; L155-L253 HydrophobicContact CG-CD2 4.35Å; F249-L253 HydrophobicContact CD1-CD1 3.76Å; F249-L253 HydrophobicContact CD1-CG 4.25Å; F249-L253 HydrophobicContact CE1-CD1 3.35Å; F249-L253 HydrophobicContact CE1-CG 4.06Å; F249-L253 HydrophobicContact CZ-CD1 4.14Å; F249-L253 WeakPolarHBondContact O-CG 3.03Å; F249-L253 PolarHBondContact O-N 3.02Å; T250-L253 PolarHBondContact O-N 3.37Å; L253-E256 PolarHBondContact O-N 3.21Å; L253-L257 WeakPolarHBondContact O-CB 3.17Å; L253-L257 VanDerWaalsContact O-CG 3.29Å; L253-L257 WeakPolarHBondContact O-CG 3.37Å; L253-L257 PolarHBondContact O-N 3.26Å |
| 254 | L | 96.5 | Very high | 93.9 | Very high | 101 Ų | 101 | 63.8 Ų | 63.8 | 53% | 0.529 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -65 | -40.8 | 176.4 | -69.8 | 175.8 | 0 | 0 | 0 | 112 | T250 F251 V252 L257 F258 | T250-L254 HydrophobicContact CG2-CD1 4.34Å; T250-L254 WeakPolarHBondContact O-CG 3.06Å; T250-L254 PolarHBondContact O-N 3.42Å; F251-L254 PolarHBondContact O-N 3.42Å; V252-L254 VanDerWaalsContact C-N 3.31Å; V252-L254 PolarHBondContact O-N 3.12Å; L254-L257 PolarHBondContact O-N 3.24Å; L254-F258 WeakPolarHBondContact O-CB 3.48Å; L254-F258 PolarHBondContact O-N 3.3Å |
| 255 | A | 93.5 | Very high | 93.7 | Very high | 40 Ų | 40 | 62.9 Ų | 62.9 | 33% | 0.331 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -64.9 | -40.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | F251 V252 F258 G259 | F251-A255 WeakPolarHBondContact O-CB 3.33Å; F251-A255 PolarHBondContact O-N 2.98Å; V252-A255 PolarHBondContact O-N 3.21Å; V252-A255 VanDerWaalsContact O-N 3.13Å; A255-F258 PolarHBondContact O-N 3.35Å; A255-G259 PolarHBondContact O-N 3.27Å |
| 256 | E | 95.2 | Very high | 93.5 | Very high | 23 Ų | 23 | 58.6 Ų | 58.6 | 11% | 0.107 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -64.4 | -46.4 | 174.6 | -72.4 | -174.6 | 155.9 | 0 | 0 | 112 | F151 V252 L253 F258 G259 M260 | F151-E256 WeakPolarHBondContact CA-OE2 3.12Å; V252-E256 HydrophobicContact CG1-CG 4.44Å; V252-E256 WeakPolarHBondContact O-CG 3.36Å; V252-E256 PolarHBondContact O-N 2.83Å; L253-E256 PolarHBondContact O-N 3.21Å; E256-F258 VanDerWaalsContact C-N 3.31Å; E256-F258 PolarHBondContact O-N 3.14Å; E256-G259 PolarHBondContact O-N 2.64Å; E256-M260 HydrophobicContact CB-CE 4.33Å; E256-M260 WeakPolarHBondContact O-CB 3.19Å; E256-M260 WeakPolarHBondContact O-CG 3.1Å; E256-M260 PolarHBondContact O-N 3.01Å |
| 257 | L | 96.3 | Very high | 93.2 | Very high | 75 Ų | 75 | 56.9 Ų | 56.9 | 39% | 0.393 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -59 | -42.8 | 175.5 | -74.8 | 171 | 0 | 0 | 0 | 111.9 | F151 L253 L254 M260 S261 | F151-L257 HydrophobicContact CD2-CD2 4.45Å; F151-L257 HydrophobicContact CD2-CG 4.41Å; F151-L257 HydrophobicContact CE2-CD1 4.11Å; F151-L257 HydrophobicContact CE2-CD2 3.82Å; F151-L257 HydrophobicContact CE2-CG 3.76Å; F151-L257 HydrophobicContact CZ-CD1 4.49Å; F151-L257 HydrophobicContact CZ-CD2 3.96Å; F151-L257 HydrophobicContact CZ-CG 4.33Å; L253-L257 WeakPolarHBondContact O-CB 3.17Å; L253-L257 VanDerWaalsContact O-CG 3.29Å; L253-L257 WeakPolarHBondContact O-CG 3.37Å; L253-L257 PolarHBondContact O-N 3.26Å; L254-L257 PolarHBondContact O-N 3.24Å; L257-M260 HydrophobicContact CD2-CE 3.9Å; L257-M260 HydrophobicContact CG-CE 4.4Å; L257-S261 WeakPolarHBondContact O-CB 3.22Å; L257-S261 PolarHBondContact O-N 3.41Å; L257-S261 PolarHBondContact O-OG 3.08Å |
| 258 | F | 94 | Very high | 92.8 | Very high | 131 Ų | 131 | 57.1 Ų | 57.1 | 58% | 0.575 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -63.6 | -46.3 | 174.6 | -176.7 | -108 | 0 | 0 | 0 | 111.3 | L254 A255 E256 M260 S261 L262 | L254-F258 WeakPolarHBondContact O-CB 3.48Å; L254-F258 PolarHBondContact O-N 3.3Å; A255-F258 PolarHBondContact O-N 3.35Å; E256-F258 VanDerWaalsContact C-N 3.31Å; E256-F258 PolarHBondContact O-N 3.14Å; F258-M260 PolarHBondContact O-N 3.22Å; F258-S261 WeakPolarHBondContact O-CB 3.49Å; F258-S261 PolarHBondContact O-N 2.72Å; F258-L262 HydrophobicContact CD1-CD1 3.96Å; F258-L262 HydrophobicContact CD1-CG 4.42Å; F258-L262 HydrophobicContact CE1-CD1 3.38Å; F258-L262 HydrophobicContact CE1-CG 4.11Å; F258-L262 HydrophobicContact CE2-CD1 4.39Å; F258-L262 HydrophobicContact CE2-CD2 4.35Å; F258-L262 HydrophobicContact CE2-CG 4.33Å; F258-L262 HydrophobicContact CZ-CD1 3.64Å; F258-L262 HydrophobicContact CZ-CD2 4.2Å; F258-L262 HydrophobicContact CZ-CG 4.06Å; F258-L262 WeakPolarHBondContact O-CG 3.23Å; F258-L262 PolarHBondContact O-N 3.31Å |
| 259 | G | 92.6 | Very high | 92.1 | Very high | 9 Ų | 9 | 58.1 Ų | 58.1 | 9% | 0.093 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -58.7 | -45.5 | 176 | 0 | 0 | 0 | 0 | 0 | 113.1 | A255 E256 L262 A263 | A255-G259 PolarHBondContact O-N 3.27Å; E256-G259 PolarHBondContact O-N 2.64Å; G259-L262 PolarHBondContact O-N 2.9Å; G259-A263 WeakPolarHBondContact O-CB 3.42Å; G259-A263 PolarHBondContact O-N 3.15Å |
| 260 | M | 94.4 | Very high | 90.9 | Very high | 13 Ų | 13 | 56.5 Ų | 56.5 | 6% | 0.064 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -61.9 | -43.3 | 175 | -76.6 | -170.5 | -81 | 0 | 0 | 111.7 | F144 L147 L148 F151 E256 L257 F258 L262 A263 L264 | F144-M260 HydrophobicContact CD2-CB 4.07Å; F144-M260 HydrophobicContact CD2-CG 4.17Å; F144-M260 HydrophobicContact CE2-CB 3.96Å; F144-M260 HydrophobicContact CE2-CG 4.22Å; F144-M260 HydrophobicContact CE2-SD 4.41Å; L147-M260 HydrophobicContact CB-CG 3.63Å; L147-M260 HydrophobicContact CB-SD 4.24Å; L147-M260 HydrophobicContact CD1-CG 3.95Å; L147-M260 HydrophobicContact CG-CG 4.49Å; L148-M260 HydrophobicContact CB-SD 4.19Å; L148-M260 HydrophobicContact CD1-SD 4.32Å; F151-M260 HydrophobicContact CB-CE 3.91Å; F151-M260 HydrophobicContact CD1-CE 4.48Å; F151-M260 HydrophobicContact CD2-CE 3.92Å; F151-M260 HydrophobicContact CG-CE 3.86Å; E256-M260 HydrophobicContact CB-CE 4.33Å; E256-M260 WeakPolarHBondContact O-CB 3.19Å; E256-M260 WeakPolarHBondContact O-CG 3.1Å; E256-M260 PolarHBondContact O-N 3.01Å; L257-M260 HydrophobicContact CD2-CE 3.9Å; L257-M260 HydrophobicContact CG-CE 4.4Å; F258-M260 PolarHBondContact O-N 3.22Å; M260-L262 PolarHBondContact O-N 3.29Å; M260-A263 PolarHBondContact O-N 3.34Å; M260-L264 WeakPolarHBondContact O-CB 3.42Å; M260-L264 PolarHBondContact O-N 2.65Å |
| 261 | S | 93.2 | Very high | 89.3 | Confident | 74 Ų | 74 | 55.8 Ų | 55.8 | 52% | 0.517 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.9 | -44.4 | 177.9 | -59.8 | 0 | 0 | 0 | 0 | 111.7 | L257 F258 Y265 | L257-S261 WeakPolarHBondContact O-CB 3.22Å; L257-S261 PolarHBondContact O-N 3.41Å; L257-S261 PolarHBondContact O-OG 3.08Å; F258-S261 WeakPolarHBondContact O-CB 3.49Å; F258-S261 PolarHBondContact O-N 2.72Å; S261-Y265 WeakPolarHBondContact O-CB 3.47Å; S261-Y265 PolarHBondContact O-N 3.5Å |
| 262 | L | 91.8 | Very high | 87.5 | Confident | 28 Ų | 28 | 51.9 Ų | 51.9 | 15% | 0.147 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -67.9 | -41.2 | 176.9 | -66.4 | -174.9 | 0 | 0 | 0 | 112.2 | I58 I62 F258 G259 M260 Y265 L266 | I58-L262 HydrophobicContact CD1-CD2 4.47Å; I58-L262 HydrophobicContact CG1-CD2 4.31Å; I58-L262 HydrophobicContact CG2-CB 4.08Å; I58-L262 HydrophobicContact CG2-CD1 4.29Å; I58-L262 HydrophobicContact CG2-CD2 3.95Å; I58-L262 HydrophobicContact CG2-CG 4.34Å; I62-L262 HydrophobicContact CD1-CB 3.92Å; I62-L262 HydrophobicContact CG1-CB 4.3Å; I62-L262 HydrophobicContact CG1-CD1 4.18Å; F258-L262 HydrophobicContact CD1-CD1 3.96Å; F258-L262 HydrophobicContact CD1-CG 4.42Å; F258-L262 HydrophobicContact CE1-CD1 3.38Å; F258-L262 HydrophobicContact CE1-CG 4.11Å; F258-L262 HydrophobicContact CE2-CD1 4.39Å; F258-L262 HydrophobicContact CE2-CD2 4.35Å; F258-L262 HydrophobicContact CE2-CG 4.33Å; F258-L262 HydrophobicContact CZ-CD1 3.64Å; F258-L262 HydrophobicContact CZ-CD2 4.2Å; F258-L262 HydrophobicContact CZ-CG 4.06Å; F258-L262 WeakPolarHBondContact O-CG 3.23Å; F258-L262 PolarHBondContact O-N 3.31Å; G259-L262 PolarHBondContact O-N 2.9Å; M260-L262 PolarHBondContact O-N 3.29Å; L262-Y265 PolarHBondContact O-N 2.84Å; L262-L266 WeakPolarHBondContact O-CB 3.34Å; L262-L266 PolarHBondContact O-N 3.37Å |
| 263 | A | 90.7 | Very high | 85.5 | Confident | 1 Ų | 1 | 59.7 Ų | 59.7 | 1% | 0.008 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62.2 | -44.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | L140 Y143 F144 G259 M260 L266 A267 | L140-A263 HydrophobicContact CD1-CB 4.1Å; L140-A263 VanDerWaalsContact CD2-O 3.26Å; L140-A263 WeakPolarHBondContact CD2-O 3.42Å; L140-A263 HydrophobicContact CG-CB 4.35Å; Y143-A263 HydrophobicContact CD1-CB 3.88Å; Y143-A263 HydrophobicContact CE1-CB 4.13Å; F144-A263 HydrophobicContact CB-CB 4.46Å; G259-A263 WeakPolarHBondContact O-CB 3.42Å; G259-A263 PolarHBondContact O-N 3.15Å; M260-A263 PolarHBondContact O-N 3.34Å; A263-L266 PolarHBondContact O-N 3.18Å; A263-A267 WeakPolarHBondContact O-CB 3.49Å; A263-A267 PolarHBondContact O-N 2.85Å |
| 264 | L | 90.7 | Very high | 83.4 | Confident | 91 Ų | 91 | 62.8 Ų | 62.8 | 48% | 0.476 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -65 | -42.5 | 176.3 | -175 | 62.6 | 0 | 0 | 0 | 111.7 | F144 M260 L266 A267 C268 | F144-L264 HydrophobicContact CE2-CB 4.45Å; M260-L264 WeakPolarHBondContact O-CB 3.42Å; M260-L264 PolarHBondContact O-N 2.65Å; L264-L266 PolarHBondContact O-N 3.34Å; L264-A267 PolarHBondContact O-N 2.94Å; L264-C268 WeakPolarHBondContact O-CB 3.27Å; L264-C268 PolarHBondContact O-N 3.45Å; L264-C268 PolarHBondContact O-SG 2.89Å; L264-C268 VanDerWaalsContact O-SG 3.36Å |
| 265 | Y | 90.1 | Very high | 81.3 | Confident | 75 Ų | 75 | 60.4 Ų | 60.4 | 29% | 0.294 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -58.2 | -48 | 175.4 | 176.7 | -94.4 | 0 | 0 | 0 | 111.7 | I58 S261 L262 C268 H269 | I58-Y265 HydrophobicContact CD1-CD1 3.56Å; I58-Y265 HydrophobicContact CD1-CE1 3.43Å; I58-Y265 VanDerWaalsContact CD1-CE1 3.43Å; S261-Y265 WeakPolarHBondContact O-CB 3.47Å; S261-Y265 PolarHBondContact O-N 3.5Å; L262-Y265 PolarHBondContact O-N 2.84Å; Y265-C268 PolarHBondContact O-N 2.95Å; Y265-H269 AromaticContact CD2-CD2 3.57Å; Y265-H269 AromaticContact CE2-CD2 3.38Å; Y265-H269 WeakPolarHBondContact CE2-CD2 3.27Å; Y265-H269 AromaticContact CE2-NE2 3.81Å; Y265-H269 AromaticContact CZ-CD2 3.97Å; Y265-H269 WeakPolarHBondContact O-CB 3.46Å; Y265-H269 PolarHBondContact O-N 2.81Å |
| 266 | L | 88 | Confident | 79.3 | Confident | 9 Ų | 9 | 62 Ų | 62 | 5% | 0.047 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -66.8 | -34.5 | 176.6 | -76.5 | -171.9 | 0 | 0 | 0 | 112.3 | I58 K59 I62 L140 L262 A263 L264 G270 | I58-L266 HydrophobicContact CB-CD2 4.32Å; I58-L266 HydrophobicContact CG2-CD1 3.9Å; I58-L266 HydrophobicContact CG2-CD2 3.99Å; I58-L266 HydrophobicContact CG2-CG 3.76Å; K59-L266 HydrophobicContact CG-CD1 3.98Å; K59-L266 HydrophobicContact CG-CD2 4.22Å; I62-L266 HydrophobicContact CD1-CD1 3.47Å; I62-L266 VanDerWaalsContact CD1-CD1 3.47Å; I62-L266 HydrophobicContact CD1-CG 4.38Å; L140-L266 HydrophobicContact CD2-CB 3.5Å; L140-L266 VanDerWaalsContact CD2-CB 3.5Å; L262-L266 WeakPolarHBondContact O-CB 3.34Å; L262-L266 PolarHBondContact O-N 3.37Å; A263-L266 PolarHBondContact O-N 3.18Å; L264-L266 PolarHBondContact O-N 3.34Å; L266-G270 WeakPolarHBondContact O-CA 3.34Å; L266-G270 PolarHBondContact O-N 3.26Å |
| 267 | A | 85.9 | Confident | 77.4 | Confident | 17 Ų | 17 | 65 Ų | 65 | 14% | 0.14 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -66.5 | -42.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | L140 A263 L264 V271 | L140-A267 HydrophobicContact CD2-CB 3.82Å; L140-A267 HydrophobicContact CG-CB 4.44Å; A263-A267 WeakPolarHBondContact O-CB 3.49Å; A263-A267 PolarHBondContact O-N 2.85Å; L264-A267 PolarHBondContact O-N 2.94Å; A267-V271 VanDerWaalsContact O-CG2 3.27Å; A267-V271 WeakPolarHBondContact O-CG2 3.36Å |
| 268 | C | 85.1 | Confident | 75.4 | Confident | 87 Ų | 87 | 64.6 Ų | 64.6 | 59% | 0.588 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -75.1 | -40.5 | -179.6 | -68.3 | 0 | 0 | 0 | 0 | 113.1 | L264 Y265 | L264-C268 WeakPolarHBondContact O-CB 3.27Å; L264-C268 PolarHBondContact O-N 3.45Å; L264-C268 PolarHBondContact O-SG 2.89Å; L264-C268 VanDerWaalsContact O-SG 3.36Å; Y265-C268 PolarHBondContact O-N 2.95Å |
| 269 | H | 80.8 | Confident | 73.5 | Confident | 102 Ų | 102 | 62.8 Ų | 62.8 | 47% | 0.472 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -99.6 | -11.2 | -175.5 | -74.4 | -79.3 | 0 | 0 | 0 | 114.9 | K55 Y265 | K55-H269 PolarHBondContact NZ-O 3.33Å; Y265-H269 AromaticContact CD2-CD2 3.57Å; Y265-H269 AromaticContact CE2-CD2 3.38Å; Y265-H269 WeakPolarHBondContact CE2-CD2 3.27Å; Y265-H269 AromaticContact CE2-NE2 3.81Å; Y265-H269 AromaticContact CZ-CD2 3.97Å; Y265-H269 WeakPolarHBondContact O-CB 3.46Å; Y265-H269 PolarHBondContact O-N 2.81Å |
| 270 | G | 68.8 | Low | 71.9 | Confident | 20 Ų | 20 | 70.4 Ų | 70.4 | 21% | 0.206 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -89.7 | -15.1 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | L135 L266 P272 | L135-G270 WeakPolarHBondContact CD1-O 3.35Å; L266-G270 WeakPolarHBondContact O-CA 3.34Å; L266-G270 PolarHBondContact O-N 3.26Å; G270-P272 WeakPolarHBondContact O-CD 3.06Å |
| 271 | V | 61.3 | Low | 70.1 | Confident | 54 Ų | 54 | 78.6 Ų | 78.6 | 33% | 0.327 | 42% | 0.423 | S | S | . | . | S | Bend | trans | -69.2 | 109.9 | 175.2 | 178.4 | 0 | 0 | 0 | 0 | 108.9 | S137 A267 R273 A275 | S137-V271 VanDerWaalsContact OG-CG2 3.22Å; S137-V271 WeakPolarHBondContact OG-CG2 2.94Å; A267-V271 VanDerWaalsContact O-CG2 3.27Å; A267-V271 WeakPolarHBondContact O-CG2 3.36Å; V271-R273 PolarHBondContact O-N 3.34Å; V271-A275 HydrophobicContact CG1-CB 4.23Å |
| 272 | P | 56.7 | Low | 68.7 | Low | 58 Ų | 58 | 80.9 Ų | 80.9 | 38% | 0.377 | 43% | 0.426 | S | S | . | . | trans | -62.2 | 131.4 | 165.3 | 29.4 | -34.2 | 0 | 0 | 0 | 106.9 | L135 G270 S274 A275 | L135-P272 HydrophobicContact CD2-CG 3.54Å; L135-P272 HydrophobicContact CG-CG 4.39Å; G270-P272 WeakPolarHBondContact O-CD 3.06Å; P272-S274 PolarHBondContact O-N 2.03Å; P272-A275 PolarHBondContact O-N 3.16Å | ||
| 273 | R | 53.7 | Low | 67.2 | Low | 222 Ų | 222 | 82.9 Ų | 82.9 | 84% | 0.838 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -44.4 | -27.6 | 179.9 | -74.8 | 178.4 | 173.2 | 151.8 | -3.7 | 113.7 | V271 A275 S276 D277 | V271-R273 PolarHBondContact O-N 3.34Å; R273-A275 VanDerWaalsContact C-N 3.33Å; R273-A275 PolarHBondContact O-N 3.44Å; R273-S276 PolarHBondContact O-N 3.12Å; R273-D277 PolarHBondContact O-N 3.18Å; R273-D277 VanDerWaalsContact O-N 3.12Å |
| 274 | S | 51.6 | Low | 65.8 | Low | 89 Ų | 89 | 91.7 Ų | 91.7 | 62% | 0.622 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -57.6 | -31.2 | 175.3 | -170.2 | 0 | 0 | 0 | 0 | 115.5 | P272 S278 | P272-S274 PolarHBondContact O-N 2.03Å; S274-S278 PolarHBondContact O-N 3.27Å |
| 275 | A | 52.9 | Low | 64.6 | Low | 51 Ų | 51 | 94.9 Ų | 94.9 | 42% | 0.421 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -77.8 | -34.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | V271 P272 R273 D277 S278 C279 | V271-A275 HydrophobicContact CG1-CB 4.23Å; P272-A275 PolarHBondContact O-N 3.16Å; R273-A275 VanDerWaalsContact C-N 3.33Å; R273-A275 PolarHBondContact O-N 3.44Å; A275-D277 VanDerWaalsContact C-N 3.32Å; A275-S278 PolarHBondContact O-N 2.7Å; A275-C279 PolarHBondContact O-N 3.29Å |
| 276 | S | 52.5 | Low | 63.1 | Low | 74 Ų | 74 | 99.9 Ų | 99.9 | 52% | 0.517 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.3 | -40.7 | 170.3 | -170.3 | 0 | 0 | 0 | 0 | 110.5 | R273 C279 R280 | R273-S276 PolarHBondContact O-N 3.12Å; S276-C279 PolarHBondContact O-N 3.23Å; S276-R280 WeakPolarHBondContact O-CB 3.46Å; S276-R280 PolarHBondContact O-N 3.08Å |
| 277 | D | 53.4 | Low | 62 | Low | 84 Ų | 84 | 104.6 Ų | 104.6 | 45% | 0.449 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -67.3 | -34.9 | 174.8 | -75.6 | -26.3 | 0 | 0 | 0 | 113.2 | R273 A275 R280 R281 | R273-D277 PolarHBondContact O-N 3.18Å; R273-D277 VanDerWaalsContact O-N 3.12Å; A275-D277 VanDerWaalsContact C-N 3.32Å; D277-R280 PolarHBondContact O-N 3.32Å; D277-R281 VanDerWaalsContact O-CB 3.23Å; D277-R281 WeakPolarHBondContact O-CB 3.42Å; D277-R281 VanDerWaalsContact O-CG 3.25Å; D277-R281 WeakPolarHBondContact O-CG 2.89Å; D277-R281 PolarHBondContact O-N 2.74Å |
| 278 | S | 54.9 | Low | 61 | Low | 67 Ų | 67 | 108.5 Ų | 108.5 | 47% | 0.469 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -68 | -42.2 | 175.7 | -152.2 | 0 | 0 | 0 | 0 | 111.1 | S274 A275 R280 R281 Q282 | S274-S278 PolarHBondContact O-N 3.27Å; A275-S278 PolarHBondContact O-N 2.7Å; S278-R280 PolarHBondContact O-N 2.59Å; S278-R281 PolarHBondContact O-N 3.27Å; S278-Q282 WeakPolarHBondContact O-CB 3.45Å; S278-Q282 PolarHBondContact O-N 3.36Å |
| 279 | C | 53.8 | Low | 60 | Low | 93 Ų | 93 | 110.3 Ų | 110.3 | 63% | 0.628 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -64.2 | -40.5 | 174.5 | -157.3 | 0 | 0 | 0 | 0 | 111.7 | A275 S276 Q282 S283 | A275-C279 PolarHBondContact O-N 3.29Å; S276-C279 PolarHBondContact O-N 3.23Å; C279-Q282 PolarHBondContact O-N 2.78Å; C279-S283 WeakPolarHBondContact O-CB 3.36Å; C279-S283 PolarHBondContact O-N 2.94Å |
| 280 | R | 59.4 | Low | 58.6 | Low | 170 Ų | 170 | 118.1 Ų | 118.1 | 64% | 0.642 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -66.9 | -38.4 | 174.3 | -131.3 | 177.6 | -165.5 | -158.6 | 3.3 | 112.8 | S276 D277 S278 R284 | S276-R280 WeakPolarHBondContact O-CB 3.46Å; S276-R280 PolarHBondContact O-N 3.08Å; D277-R280 PolarHBondContact O-N 3.32Å; S278-R280 PolarHBondContact O-N 2.59Å; R280-R284 WeakPolarHBondContact O-CB 3.46Å; R280-R284 PolarHBondContact O-N 3.15Å |
| 281 | R | 57.4 | Low | 58.1 | Low | 185 Ų | 185 | 123 Ų | 123 | 70% | 0.698 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -69.2 | -37.7 | 175.1 | -80.6 | 178.3 | -178.9 | -169.9 | 0.6 | 111.7 | D277 S278 R284 K285 | D277-R281 VanDerWaalsContact O-CB 3.23Å; D277-R281 WeakPolarHBondContact O-CB 3.42Å; D277-R281 VanDerWaalsContact O-CG 3.25Å; D277-R281 WeakPolarHBondContact O-CG 2.89Å; D277-R281 PolarHBondContact O-N 2.74Å; S278-R281 PolarHBondContact O-N 3.27Å; R281-R284 PolarHBondContact O-N 3Å; R281-K285 WeakPolarHBondContact O-CB 3.31Å; R281-K285 WeakPolarHBondContact O-CG 3.3Å; R281-K285 PolarHBondContact O-N 3.45Å |
| 282 | Q | 63.5 | Low | 57.9 | Low | 122 Ų | 122 | 126.6 Ų | 126.6 | 57% | 0.57 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -70.7 | -35.9 | 177.2 | -152.8 | 128 | -11.8 | 0 | 0 | 111.7 | S278 C279 R286 | S278-Q282 WeakPolarHBondContact O-CB 3.45Å; S278-Q282 PolarHBondContact O-N 3.36Å; C279-Q282 PolarHBondContact O-N 2.78Å; Q282-R286 PolarHBondContact O-N 3.34Å |
| 283 | S | 59.2 | Low | 58 | Low | 70 Ų | 70 | 130.4 Ų | 130.4 | 49% | 0.49 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -65 | -47.4 | 169.6 | 169.4 | 0 | 0 | 0 | 0 | 111.7 | C279 K285 R286 V287 | C279-S283 WeakPolarHBondContact O-CB 3.36Å; C279-S283 PolarHBondContact O-N 2.94Å; S283-K285 PolarHBondContact O-N 2.98Å; S283-R286 PolarHBondContact O-N 3.05Å; S283-R286 VanDerWaalsContact O-N 3.16Å; S283-V287 WeakPolarHBondContact O-CG2 3.38Å; S283-V287 PolarHBondContact O-N 3.32Å |
| 284 | R | 61.9 | Low | 58.2 | Low | 186 Ų | 186 | 125.1 Ų | 125.1 | 70% | 0.702 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -62.5 | -38.3 | 176.1 | -83 | -172.4 | -177.5 | -174.3 | 0.4 | 113.6 | R280 R281 R286 V287 S288 | R280-R284 WeakPolarHBondContact O-CB 3.46Å; R280-R284 PolarHBondContact O-N 3.15Å; R281-R284 PolarHBondContact O-N 3Å; R284-R286 VanDerWaalsContact C-N 3.29Å; R284-R286 PolarHBondContact O-N 3.2Å; R284-V287 PolarHBondContact O-N 3.49Å; R284-S288 PolarHBondContact O-N 3.26Å; R284-S288 VanDerWaalsContact O-N 3.16Å |
| 285 | K | 65.8 | Low | 58.7 | Low | 158 Ų | 158 | 127.3 Ų | 127.3 | 69% | 0.687 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -65.2 | -32.6 | 175.4 | -79.3 | -171.8 | 177.9 | -171.7 | 0 | 112.4 | R281 S283 V289 | R281-K285 WeakPolarHBondContact O-CB 3.31Å; R281-K285 WeakPolarHBondContact O-CG 3.3Å; R281-K285 PolarHBondContact O-N 3.45Å; S283-K285 PolarHBondContact O-N 2.98Å; K285-V289 VanDerWaalsContact O-CG2 3.27Å; K285-V289 WeakPolarHBondContact O-CG2 3.29Å |
| 286 | R | 58.8 | Low | 59 | Low | 180 Ų | 180 | 132.4 Ų | 132.4 | 68% | 0.679 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -73.6 | -30.5 | 176 | -109.7 | -170 | -76.2 | -158.7 | -1.7 | 113.4 | Q282 S283 R284 | Q282-R286 PolarHBondContact O-N 3.34Å; S283-R286 PolarHBondContact O-N 3.05Å; S283-R286 VanDerWaalsContact O-N 3.16Å; R284-R286 VanDerWaalsContact C-N 3.29Å; R284-R286 PolarHBondContact O-N 3.2Å |
| 287 | V | 65.3 | Low | 59.5 | Low | 107 Ų | 107 | 136.6 Ų | 136.6 | 65% | 0.648 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -78.2 | -24.1 | 176.6 | 177.6 | 0 | 0 | 0 | 0 | 112.3 | S283 R284 | S283-V287 WeakPolarHBondContact O-CG2 3.38Å; S283-V287 PolarHBondContact O-N 3.32Å; R284-V287 PolarHBondContact O-N 3.49Å |
| 288 | S | 63.9 | Low | 60 | Low | 100 Ų | 100 | 140.6 Ų | 140.6 | 70% | 0.699 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | -0.5 | -179.7 | -171.2 | 0 | 0 | 0 | 0 | 114.7 | R284 | R284-S288 PolarHBondContact O-N 3.26Å; R284-S288 VanDerWaalsContact O-N 3.16Å |
| 289 | V | 64.3 | Low | 60.4 | Low | 125 Ų | 125 | 146.8 Ų | 146.8 | 76% | 0.758 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109 | -1.5 | -177.1 | 177.5 | 0 | 0 | 0 | 0 | 112 | K285 | K285-V289 VanDerWaalsContact O-CG2 3.27Å; K285-V289 WeakPolarHBondContact O-CG2 3.29Å |
| 290 | Y | 51.8 | Low | 61 | Low | 265 Ų | 265 | 151.6 Ų | 151.6 | 100% | 1.039 | 69% | 0.692 | S | S | * | * | trans | -110.3 | 0 | 166.3 | -74 | -82.6 | 0 | 0 | 0 | 109 |
Retrieved 290 of 290 residues in 150.6 ms
(Link to these results)