| 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 | 34.4 | Very low | 33.1 | Very low | 243 Ų | 243 | 173.3 Ų | 173.3 | 100% | 1.197 | 88% | 0.88 | S | S | * | * | 0 | 128 | 0 | -66.3 | 165 | 171.2 | 0 | 0 | 109.3 | |||||
| 2 | R | 35.4 | Very low | 33.2 | Very low | 251 Ų | 251 | 169.8 Ų | 169.8 | 95% | 0.947 | 87% | 0.874 | S | S | * | * | trans | -175.3 | 112.8 | 164.1 | -107.2 | 179.2 | -164.8 | -160.8 | 5.5 | 110.3 | ||||
| 3 | R | 28.5 | Very low | 32.9 | Very low | 253 Ų | 253 | 174.2 Ų | 174.2 | 96% | 0.955 | 87% | 0.872 | S | S | * | * | trans | -151.1 | 92.1 | 158.7 | -74.4 | -161.8 | 178.3 | 177.6 | 0.8 | 109.8 | ||||
| 4 | K | 34.7 | Very low | 32.6 | Very low | 190 Ų | 190 | 171.9 Ų | 171.9 | 83% | 0.826 | 86% | 0.863 | S | S | * | * | trans | -95.4 | 153.4 | 159.5 | -78.8 | -174 | 174.4 | -179.2 | 0 | 108.1 | ||||
| 5 | A | 35.1 | Very low | 32.6 | Very low | 106 Ų | 106 | 168.8 Ų | 168.8 | 88% | 0.876 | 86% | 0.86 | S | S | * | * | trans | 63.1 | 152.6 | -172.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 6 | S | 30.7 | Very low | 32.3 | Very low | 93 Ų | 93 | 166.7 Ų | 166.7 | 65% | 0.65 | 86% | 0.857 | S | S | * | * | cis | -132 | 148.6 | 15.6 | -178.7 | 0 | 0 | 0 | 0 | 112.9 | M8 | S6-M8 PolarHBondContact OG-N 3.47Å; S6-M8 PolarHBondContact OG-O 3.46Å | ||
| 7 | C | 29.8 | Very low | 32.1 | Very low | 114 Ų | 114 | 170.7 Ų | 170.7 | 77% | 0.77 | 86% | 0.859 | S | S | * | * | S | Bend | trans | -106.5 | 16.8 | 165.2 | -158.1 | 0 | 0 | 0 | 0 | 112.7 | ||
| 8 | M | 39.2 | Very low | 31.9 | Very low | 175 Ų | 175 | 171.6 Ų | 171.6 | 86% | 0.862 | 86% | 0.859 | S | S | * | * | trans | -117.2 | 121.3 | 163.9 | -84.1 | -176.1 | 157.9 | 0 | 0 | 109 | S6 | S6-M8 PolarHBondContact OG-N 3.47Å; S6-M8 PolarHBondContact OG-O 3.46Å | ||
| 9 | G | 28.3 | Very low | 31.7 | Very low | 79 Ų | 79 | 172.1 Ų | 172.1 | 81% | 0.814 | 86% | 0.859 | S | S | * | * | trans | 166.8 | 78.1 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | R11 | G9-R11 PolarHBondContact O-N 2.93Š| ||
| 10 | N | 36.9 | Very low | 31.7 | Very low | 171 Ų | 171 | 173.1 Ų | 173.1 | 91% | 0.914 | 86% | 0.861 | S | S | * | * | trans | -66.8 | 112.9 | 169.4 | -94.5 | -13.7 | 0 | 0 | 0 | 110.2 | ||||
| 11 | R | 31.3 | Very low | 31.4 | Very low | 231 Ų | 231 | 172.2 Ų | 172.2 | 87% | 0.872 | 86% | 0.858 | S | S | * | * | trans | -137.8 | 110.4 | 148.8 | -73.9 | -161.6 | -180 | -164.7 | 1.3 | 110 | G9 | G9-R11 PolarHBondContact O-N 2.93Š| ||
| 12 | V | 34.4 | Very low | 31.1 | Very low | 132 Ų | 132 | 170.9 Ų | 170.9 | 80% | 0.8 | 85% | 0.846 | S | S | * | * | trans | -63.3 | 135.1 | 163.6 | 178.9 | 0 | 0 | 0 | 0 | 107.8 | L14 | V12-L14 HydrophobicContact CG1-CD1 3.97Š| ||
| 13 | R | 29.6 | Very low | 30.7 | Very low | 226 Ų | 226 | 164 Ų | 164 | 85% | 0.853 | 84% | 0.836 | S | S | * | * | trans | -137.2 | 110.1 | 167.6 | -158.4 | -176 | -66.3 | -152 | 3.7 | 107.4 | ||||
| 14 | L | 28.5 | Very low | 30.6 | Very low | 143 Ų | 143 | 162.9 Ų | 162.9 | 75% | 0.749 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -72 | 148 | 178.3 | -69.8 | 89.9 | 0 | 0 | 0 | 110 | V12 | V12-L14 HydrophobicContact CG1-CD1 3.97Š|
| 15 | P | 31.8 | Very low | 30.4 | Very low | 125 Ų | 125 | 161 Ų | 161 | 81% | 0.812 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 124.5 | 171.3 | 30.6 | -32.4 | 0 | 0 | 0 | 110.3 | ||
| 16 | V | 28.1 | Very low | 30.6 | Very low | 135 Ų | 135 | 161.5 Ų | 161.5 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 130 | 168.2 | 177 | 0 | 0 | 0 | 0 | 108.3 | ||
| 17 | R | 28.6 | Very low | 30.5 | Very low | 235 Ų | 235 | 161.7 Ų | 161.7 | 89% | 0.887 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 127.2 | 171.1 | -95.4 | -178.8 | 166.6 | 173.4 | -5 | 109.6 | Q19 | R17-Q19 PolarHBondContact O-N 2.83Š|
| 18 | H | 29.4 | Very low | 30.6 | Very low | 187 Ų | 187 | 161.5 Ų | 161.5 | 87% | 0.866 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 128.1 | 161.1 | -92 | -100.5 | 0 | 0 | 0 | 109.7 | ||
| 19 | Q | 28.2 | Very low | 30 | Very low | 181 Ų | 181 | 156.8 Ų | 156.8 | 85% | 0.846 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 134 | 157.4 | -72.7 | 176.5 | -45.1 | 0 | 0 | 108.2 | R17 | R17-Q19 PolarHBondContact O-N 2.83Š|
| 20 | Q | 30.5 | Very low | 29.9 | Very low | 192 Ų | 192 | 156.6 Ų | 156.6 | 90% | 0.897 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -95 | 135.9 | 160 | -75.6 | -178.5 | -49.3 | 0 | 0 | 108.3 | ||
| 21 | L | 27 | Very low | 29.5 | Very low | 155 Ų | 155 | 158.7 Ų | 158.7 | 81% | 0.812 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 136.9 | 170.9 | -73.7 | 79.5 | 0 | 0 | 0 | 109.5 | ||
| 22 | F | 27.6 | Very low | 29.2 | Very low | 215 Ų | 215 | 154 Ų | 154 | 94% | 0.943 | 83% | 0.832 | S | S | * | * | trans | -139 | 153 | 145.1 | -109.1 | -85.6 | 0 | 0 | 0 | 108.5 | ||||
| 23 | S | 25.9 | Very low | 29.7 | Very low | 106 Ų | 106 | 152.5 Ų | 152.5 | 74% | 0.741 | 83% | 0.825 | S | S | * | * | trans | -145.4 | 161.3 | -168.1 | -176.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 24 | R | 27.9 | Very low | 29.6 | Very low | 229 Ų | 229 | 149.6 Ų | 149.6 | 86% | 0.864 | 82% | 0.821 | S | S | * | * | trans | 70.5 | 145.4 | -170.5 | -58.5 | 174.5 | 168.1 | 179.5 | -4.7 | 114.4 | ||||
| 25 | N | 28.8 | Very low | 29.4 | Very low | 152 Ų | 152 | 151.2 Ų | 151.2 | 81% | 0.813 | 82% | 0.822 | S | S | * | * | cis | -155.7 | 171.7 | -24.6 | -121.3 | 17.8 | 0 | 0 | 0 | 108.8 | ||||
| 26 | P | 39.9 | Very low | 29.4 | Very low | 115 Ų | 115 | 152.5 Ų | 152.5 | 75% | 0.747 | 82% | 0.821 | S | S | * | * | trans | -98 | 172.8 | -166.2 | 38.7 | -37.3 | 0 | 0 | 0 | 115.8 | ||||
| 27 | A | 29.5 | Very low | 29.4 | Very low | 97 Ų | 97 | 153.5 Ų | 153.5 | 80% | 0.802 | 82% | 0.816 | S | S | * | * | trans | 122.6 | 146.8 | 148.8 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 28 | A | 30.4 | Very low | 29.6 | Very low | 110 Ų | 110 | 146 Ų | 146 | 91% | 0.909 | 81% | 0.805 | S | S | * | * | trans | 62.8 | 145.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 29 | G | 27.1 | Very low | 29.6 | Very low | 77 Ų | 77 | 145.6 Ų | 145.6 | 79% | 0.794 | 80% | 0.8 | S | S | * | * | cis | 167.3 | 106.8 | -13 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 30 | G | 26.9 | Very low | 29.7 | Very low | 75 Ų | 75 | 142.4 Ų | 142.4 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | trans | 91.6 | 159.8 | 150.3 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 31 | K | 27.5 | Very low | 29.8 | Very low | 214 Ų | 214 | 138.4 Ų | 138.4 | 93% | 0.93 | 78% | 0.782 | S | S | * | * | trans | 73.7 | 96.6 | 158.2 | -58.6 | -175.9 | -178.3 | 180 | 0 | 120.2 | ||||
| 32 | T | 26.6 | Very low | 30 | Very low | 133 Ų | 133 | 137.7 Ų | 137.7 | 82% | 0.816 | 77% | 0.774 | S | S | * | * | trans | -57.7 | 172.6 | 134.4 | 43.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 33 | P | 43 | Very low | 30.2 | Very low | 101 Ų | 101 | 133.6 Ų | 133.6 | 66% | 0.656 | 76% | 0.758 | S | S | * | * | cis | -152.1 | -160.7 | 30.7 | 46.3 | -24.2 | 0 | 0 | 0 | 118 | ||||
| 34 | Q | 27.4 | Very low | 30.4 | Very low | 164 Ų | 164 | 135 Ų | 135 | 77% | 0.766 | 75% | 0.753 | S | S | * | * | trans | 82.1 | 113.4 | 156.6 | -75.9 | 167.7 | -2.9 | 0 | 0 | 118.1 | ||||
| 35 | F | 26.1 | Very low | 30.4 | Very low | 177 Ų | 177 | 129 Ų | 129 | 78% | 0.776 | 74% | 0.738 | S | S | * | * | 78.9 | 128.5 | 77.4 | -93.9 | -102 | 0 | 0 | 0 | 111 | |||||
| 36 | I | 30.6 | Very low | 30.2 | Very low | 152 Ų | 152 | 127.8 Ų | 127.8 | 78% | 0.779 | 73% | 0.726 | S | S | * | * | -154.2 | 135.6 | 70.5 | -93.1 | 177.4 | 0 | 0 | 0 | 111.1 | |||||
| 37 | H | 29.3 | Very low | 29.6 | Very low | 156 Ų | 156 | 129 Ų | 129 | 72% | 0.722 | 72% | 0.721 | S | S | * | * | 38.3 | 143.5 | 125.9 | -105.7 | -123.6 | 0 | 0 | 0 | 119.8 | |||||
| 38 | A | 31.5 | Very low | 29.3 | Very low | 78 Ų | 78 | 132 Ų | 132 | 65% | 0.645 | 72% | 0.719 | S | S | * | * | cis | -164.4 | -174.6 | 1.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 39 | K | 29.7 | Very low | 29 | Very low | 178 Ų | 178 | 132.6 Ų | 132.6 | 77% | 0.774 | 72% | 0.716 | S | S | * | * | cis | -159.5 | 146.9 | 14.7 | -132 | -167.4 | 179.8 | 179.3 | 0 | 108.4 | ||||
| 40 | T | 31 | Very low | 28.8 | Very low | 114 Ų | 114 | 136 Ų | 136 | 70% | 0.699 | 72% | 0.716 | S | S | * | * | 53.6 | 138 | 117.3 | -79.7 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 41 | V | 32.2 | Very low | 29.2 | Very low | 108 Ų | 108 | 137.7 Ų | 137.7 | 66% | 0.655 | 71% | 0.713 | S | S | * | * | cis | -165.3 | 156.8 | 12.8 | 132.6 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 42 | E | 30.6 | Very low | 29 | Very low | 140 Ų | 140 | 135.8 Ų | 135.8 | 65% | 0.654 | 71% | 0.707 | S | S | * | * | cis | -169.5 | 170.2 | -18.5 | -95.3 | -176.3 | 130 | 0 | 0 | 106.7 | ||||
| 43 | Q | 32.1 | Very low | 28.8 | Very low | 130 Ų | 130 | 138.9 Ų | 138.9 | 61% | 0.607 | 71% | 0.709 | S | S | * | * | cis | 179.8 | 136.1 | -24.7 | -177.8 | 155.6 | -94.2 | 0 | 0 | 110.9 | ||||
| 44 | Q | 30 | Very low | 27.8 | Very low | 136 Ų | 136 | 139 Ų | 139 | 64% | 0.636 | 71% | 0.713 | S | S | * | * | trans | 65.1 | 166.4 | 147.8 | -75.7 | 173.6 | 5.4 | 0 | 0 | 120.5 | ||||
| 45 | D | 28.2 | Very low | 28.2 | Very low | 101 Ų | 101 | 135.8 Ų | 135.8 | 54% | 0.54 | 71% | 0.706 | S | S | . | * | cis | -137.1 | 149 | 5.1 | -132.8 | 3.9 | 0 | 0 | 0 | 116.1 | ||||
| 46 | K | 25.4 | Very low | 28.1 | Very low | 128 Ų | 128 | 134.3 Ų | 134.3 | 56% | 0.557 | 71% | 0.706 | S | S | * | * | 22.4 | 161.8 | 127.5 | -72.2 | -176.5 | -130.1 | 104.1 | 0 | 121.2 | |||||
| 47 | Q | 25.8 | Very low | 27.8 | Very low | 141 Ų | 141 | 131.9 Ų | 131.9 | 66% | 0.659 | 70% | 0.703 | S | S | * | * | cis | -153.9 | 134.5 | 3.1 | -119 | 163.6 | -54.7 | 0 | 0 | 108 | ||||
| 48 | Q | 24.5 | Very low | 27.7 | Very low | 160 Ų | 160 | 130.4 Ų | 130.4 | 75% | 0.748 | 71% | 0.705 | S | S | * | * | 81 | 146.2 | 83.1 | -167.7 | 178.1 | 8.8 | 0 | 0 | 115.9 | |||||
| 49 | S | 24.6 | Very low | 27.5 | Very low | 121 Ų | 121 | 135 Ų | 135 | 85% | 0.846 | 71% | 0.713 | S | S | * | * | trans | 96.6 | 128.5 | 166.6 | 78.5 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 50 | N | 22.3 | Very low | 27.3 | Very low | 150 Ų | 150 | 133.1 Ų | 133.1 | 80% | 0.802 | 71% | 0.71 | S | S | * | * | trans | -109.2 | 156.2 | 161.2 | -141.6 | -10.9 | 0 | 0 | 0 | 104.1 | ||||
| 51 | P | 34.3 | Very low | 27.1 | Very low | 109 Ų | 109 | 135.8 Ų | 135.8 | 71% | 0.708 | 72% | 0.715 | S | S | * | * | -155.1 | 170.2 | 62.8 | 42.5 | -22.4 | 0 | 0 | 0 | 117.9 | |||||
| 52 | H | 24.2 | Very low | 26.9 | Very low | 174 Ų | 174 | 135.2 Ų | 135.2 | 81% | 0.806 | 72% | 0.721 | S | S | * | * | trans | 48.2 | 138.4 | 145.2 | -92.4 | -60.6 | 0 | 0 | 0 | 124.1 | ||||
| 53 | K | 22.3 | Very low | 26.8 | Very low | 198 Ų | 198 | 135.7 Ų | 135.7 | 86% | 0.861 | 73% | 0.727 | S | S | * | * | trans | 83 | 123.1 | 149.2 | -91.8 | -176.1 | 172.5 | -177.2 | 0 | 119.6 | ||||
| 54 | S | 20.8 | Very low | 26.6 | Very low | 104 Ų | 104 | 140.4 Ų | 140.4 | 73% | 0.727 | 74% | 0.74 | S | S | * | * | trans | -74.8 | 175.5 | 153.9 | 55.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 55 | P | 37 | Very low | 26.4 | Very low | 96 Ų | 96 | 142.1 Ų | 142.1 | 62% | 0.623 | 75% | 0.752 | S | S | * | * | cis | -134 | -170.7 | 9.9 | 45.2 | -28.4 | 0 | 0 | 0 | 115.1 | ||||
| 56 | D | 23.5 | Very low | 26.3 | Very low | 147 Ų | 147 | 145.7 Ų | 145.7 | 79% | 0.786 | 76% | 0.763 | S | S | * | * | trans | 53.2 | 143.8 | 148 | -58.8 | -24.7 | 0 | 0 | 0 | 121.3 | ||||
| 57 | S | 24.4 | Very low | 26.2 | Very low | 100 Ų | 100 | 144.5 Ų | 144.5 | 70% | 0.699 | 77% | 0.771 | S | S | * | * | cis | -174.2 | 178 | -11.1 | 55.8 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 58 | V | 27.3 | Very low | 26.4 | Very low | 126 Ų | 126 | 148.9 Ų | 148.9 | 76% | 0.764 | 78% | 0.781 | S | S | * | * | trans | 67.7 | 104.2 | 158.3 | -176.7 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 59 | Q | 26.3 | Very low | 26.4 | Very low | 175 Ų | 175 | 150.8 Ų | 150.8 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | -162.6 | 130.2 | 108.7 | -99.6 | 170.7 | -4.1 | 0 | 0 | 107.7 | |||||
| 60 | L | 25.9 | Very low | 26.4 | Very low | 138 Ų | 138 | 152.1 Ų | 152.1 | 72% | 0.723 | 78% | 0.78 | S | S | * | * | 68.6 | 120.9 | 71.8 | -151.8 | 78.7 | 0 | 0 | 0 | 110.6 | |||||
| 61 | E | 27.6 | Very low | 26.5 | Very low | 170 Ų | 170 | 151.7 Ų | 151.7 | 79% | 0.794 | 78% | 0.777 | S | S | * | * | cis | -139.6 | 155.4 | 5.1 | -123.4 | 159.8 | 118.2 | 0 | 0 | 107.8 | ||||
| 62 | A | 27.7 | Very low | 25.9 | Very low | 95 Ų | 95 | 155.3 Ų | 155.3 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | cis | -151.9 | 156 | 44.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 63 | L | 27.5 | Very low | 26.5 | Very low | 150 Ų | 150 | 152.1 Ų | 152.1 | 79% | 0.785 | 78% | 0.776 | S | S | * | * | trans | -113.9 | 140.5 | 168.8 | -73.9 | 155.6 | 0 | 0 | 0 | 108.1 | ||||
| 64 | R | 28 | Very low | 26.7 | Very low | 229 Ų | 229 | 146.7 Ų | 146.7 | 86% | 0.864 | 77% | 0.768 | S | S | * | * | 178.1 | 165.2 | 89.2 | -85.1 | 176.7 | 178.5 | 140.5 | -0.9 | 107.1 | |||||
| 65 | L | 26.1 | Very low | 26.9 | Very low | 173 Ų | 173 | 149.3 Ų | 149.3 | 91% | 0.906 | 77% | 0.774 | S | S | * | * | cis | -112.5 | 171 | 14.4 | -89.8 | 83.4 | 0 | 0 | 0 | 114.1 | ||||
| 66 | K | 25.7 | Very low | 26.4 | Very low | 176 Ų | 176 | 152.3 Ų | 152.3 | 77% | 0.765 | 79% | 0.785 | S | S | * | * | trans | -153.4 | 136.9 | -168.9 | 173 | 176 | 177.5 | 178.1 | 0 | 111.8 | ||||
| 67 | S | 24.7 | Very low | 26.5 | Very low | 102 Ų | 102 | 149.7 Ų | 149.7 | 71% | 0.713 | 78% | 0.783 | S | S | * | * | trans | 59.5 | 139.2 | 154.1 | -62.5 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 68 | R | 30.4 | Very low | 26.5 | Very low | 233 Ų | 233 | 150.7 Ų | 150.7 | 88% | 0.879 | 79% | 0.791 | S | S | * | * | trans | -18.8 | 138.9 | 149.8 | -68 | 172.3 | 163.9 | 178.1 | -6.5 | 118.3 | ||||
| 69 | K | 24.4 | Very low | 26.3 | Very low | 201 Ų | 201 | 155 Ų | 155 | 87% | 0.874 | 80% | 0.795 | S | S | * | * | trans | -121.2 | 158.8 | 134.9 | -74.2 | -167.8 | 179.4 | -176.5 | 0 | 108.4 | ||||
| 70 | Q | 23.5 | Very low | 27.2 | Very low | 148 Ų | 148 | 151.6 Ų | 151.6 | 69% | 0.692 | 79% | 0.788 | S | S | * | * | cis | 92.5 | 87.2 | 7 | -51.5 | -57.6 | 99.1 | 0 | 0 | 119.5 | ||||
| 71 | L | 24.8 | Very low | 27.2 | Very low | 142 Ų | 142 | 152.7 Ų | 152.7 | 74% | 0.743 | 79% | 0.789 | S | S | * | * | 87.4 | 114.5 | 112.7 | -160.7 | 70.5 | 0 | 0 | 0 | 122.6 | |||||
| 72 | K | 21.6 | Very low | 27.3 | Very low | 184 Ų | 184 | 152.4 Ų | 152.4 | 80% | 0.8 | 79% | 0.787 | S | S | * | * | trans | 68.3 | 166.1 | 151.9 | -82.2 | -168.9 | 168.2 | -169.1 | 0 | 119.7 | ||||
| 73 | P | 36.8 | Very low | 27.5 | Very low | 108 Ų | 108 | 153.3 Ų | 153.3 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | -139.2 | -167.5 | -50.9 | 42.1 | -24.2 | 0 | 0 | 0 | 113.5 | |||||
| 74 | A | 25.8 | Very low | 28.2 | Very low | 83 Ų | 83 | 151.6 Ų | 151.6 | 69% | 0.686 | 78% | 0.783 | S | S | * | * | trans | 69.6 | 148.6 | 165.3 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 75 | D | 25.7 | Very low | 28.3 | Very low | 159 Ų | 159 | 146.8 Ų | 146.8 | 85% | 0.85 | 78% | 0.782 | S | S | * | * | cis | -154.8 | 175.4 | -7.2 | -107 | -24 | 0 | 0 | 0 | 111.5 | ||||
| 76 | D | 26.2 | Very low | 28.6 | Very low | 159 Ų | 159 | 144.7 Ų | 144.7 | 85% | 0.85 | 78% | 0.776 | S | S | * | * | trans | 87.7 | 123.2 | 159.4 | -106.4 | -27.3 | 0 | 0 | 0 | 124.8 | ||||
| 77 | A | 26.1 | Very low | 29.2 | Very low | 92 Ų | 92 | 142.1 Ų | 142.1 | 76% | 0.76 | 78% | 0.777 | S | S | * | * | trans | 26.4 | 113.9 | 152.7 | 0 | 0 | 0 | 0 | 0 | 125.4 | ||||
| 78 | S | 24.5 | Very low | 29.5 | Very low | 122 Ų | 122 | 145.1 Ų | 145.1 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | -179.5 | 152.4 | 109.6 | -167 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 79 | Y | 23.1 | Very low | 29.6 | Very low | 216 Ų | 216 | 142.6 Ų | 142.6 | 85% | 0.847 | 79% | 0.786 | S | S | * | * | trans | -105 | -178.6 | 174.4 | -82.1 | -81.9 | 0 | 0 | 0 | 111 | ||||
| 80 | P | 45.7 | Very low | 30.1 | Very low | 103 Ų | 103 | 139 Ų | 139 | 67% | 0.669 | 78% | 0.78 | S | S | * | * | cis | -131.9 | -178.9 | -37.9 | 29.8 | -9.3 | 0 | 0 | 0 | 113.1 | ||||
| 81 | E | 26.2 | Very low | 30.6 | Very low | 162 Ų | 162 | 138 Ų | 138 | 76% | 0.757 | 78% | 0.779 | S | S | * | * | 164.9 | 136.7 | 118 | -79.4 | -122.2 | 104.3 | 0 | 0 | 115.3 | |||||
| 82 | H | 29.2 | Very low | 31.3 | Very low | 163 Ų | 163 | 138 Ų | 138 | 76% | 0.755 | 78% | 0.78 | S | S | * | * | trans | 48 | 140.4 | 158.1 | -83.3 | -79.7 | 0 | 0 | 0 | 125.8 | ||||
| 83 | P | 31.2 | Very low | 32 | Very low | 115 Ų | 115 | 132.2 Ų | 132.2 | 75% | 0.747 | 76% | 0.757 | S | S | * | * | trans | -114.7 | -151.4 | 178.1 | 49.4 | -38.5 | 0 | 0 | 0 | 112.8 | ||||
| 84 | P | 43.3 | Very low | 32.3 | Very low | 114 Ų | 114 | 133 Ų | 133 | 74% | 0.74 | 76% | 0.755 | S | S | * | * | -125.1 | -179.9 | -119.3 | 39.5 | -19.2 | 0 | 0 | 0 | 116.3 | |||||
| 85 | P | 30.1 | Very low | 32.8 | Very low | 127 Ų | 127 | 132.8 Ų | 132.8 | 83% | 0.825 | 74% | 0.742 | S | S | * | * | trans | -105 | 175.9 | 157.5 | 36.6 | -29.3 | 0 | 0 | 0 | 113.9 | ||||
| 86 | V | 32.6 | Very low | 33.5 | Very low | 130 Ų | 130 | 133.5 Ų | 133.5 | 79% | 0.788 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -95.3 | 150.8 | -168.4 | 175.3 | 0 | 0 | 0 | 0 | 111.2 | ||
| 87 | P | 37.9 | Very low | 34.1 | Very low | 122 Ų | 122 | 133.8 Ų | 133.8 | 79% | 0.792 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 143.8 | -179.3 | 28.6 | -37.5 | 0 | 0 | 0 | 114.6 | ||
| 88 | D | 29.9 | Very low | 34.9 | Very low | 164 Ų | 164 | 133.6 Ų | 133.6 | 88% | 0.877 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 159.7 | 177.1 | -84 | -52.1 | 0 | 0 | 0 | 114.7 | ||
| 89 | M | 32.7 | Very low | 35.7 | Very low | 181 Ų | 181 | 136.5 Ų | 136.5 | 89% | 0.892 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -88.9 | 131.5 | -177.1 | 179.2 | 172.6 | 60.4 | 0 | 0 | 111.6 | ||
| 90 | V | 35.3 | Very low | 36.6 | Very low | 126 Ų | 126 | 132.9 Ų | 132.9 | 76% | 0.764 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -82.6 | 124.4 | 179.4 | 179.5 | 0 | 0 | 0 | 0 | 110.8 | ||
| 91 | D | 34 | Very low | 36.1 | Very low | 125 Ų | 125 | 131.3 Ų | 131.3 | 67% | 0.668 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 135.4 | 177.2 | -172.3 | -1.3 | 0 | 0 | 0 | 111.8 | D93 | D91-D93 PolarHBondContact OD1-N 3.39Š|
| 92 | L | 40 | Very low | 36.6 | Very low | 144 Ų | 144 | 133.9 Ų | 133.9 | 75% | 0.754 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -91.1 | -20.5 | -174.7 | -87.8 | 78.1 | 0 | 0 | 0 | 114.2 | L94 | L92-L94 VanDerWaalsContact C-N 3.32Å; L92-L94 PolarHBondContact O-N 3.43Å |
| 93 | D | 35.2 | Very low | 36.7 | Very low | 61 Ų | 61 | 129.5 Ų | 129.5 | 33% | 0.326 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -77.1 | -18.1 | -170.8 | -159.9 | 62.7 | 0 | 0 | 0 | 113.6 | D91 R97 | D91-D93 PolarHBondContact OD1-N 3.39Å; D93-R97 IonicContact OD2-CZ 3.35Å; D93-R97 IonicContact OD2-NE 2.8Å; D93-R97 PolarHBondContact OD2-NE 3.47Å; D93-R97 VanDerWaalsContact OD2-NE 3.11Å; D93-R97 IonicContact OD2-NH2 3.29Å; D93-R97 PolarHBondContact OD2-NH2 2.9Å |
| 94 | L | 43.5 | Very low | 36.9 | Very low | 125 Ų | 125 | 127.9 Ų | 127.9 | 65% | 0.654 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -74.3 | -46.2 | 178.9 | -168.9 | 64 | 0 | 0 | 0 | 112.5 | L92 R96 R97 V98 | L92-L94 VanDerWaalsContact C-N 3.32Å; L92-L94 PolarHBondContact O-N 3.43Å; L94-R96 PolarHBondContact O-N 2.86Å; L94-R97 PolarHBondContact O-N 2.95Å; L94-R97 VanDerWaalsContact O-N 3.13Å; L94-V98 PolarHBondContact O-N 3.27Å |
| 95 | D | 37.3 | Very low | 36.5 | Very low | 79 Ų | 79 | 129.5 Ų | 129.5 | 42% | 0.422 | 70% | 0.695 | S | S | . | * | H | α-helix | trans | -61.1 | -35.1 | 177.8 | -176.8 | 63.4 | 0 | 0 | 0 | 111.6 | R97 V98 R99 | D95-R97 VanDerWaalsContact C-N 3.28Å; D95-R97 PolarHBondContact O-N 3.43Å; D95-V98 PolarHBondContact O-N 3.29Å; D95-R99 WeakPolarHBondContact O-CG 3.43Å; D95-R99 PolarHBondContact O-N 3.29Å; D95-R99 IonicContact OD1-NE 3.52Å; D95-R99 IonicContact OD2-CZ 3.88Å; D95-R99 IonicContact OD2-NE 3.11Å; D95-R99 PolarHBondContact OD2-NE 3.38Å; D95-R99 IonicContact OD2-NH2 2.72Å; D95-R99 PolarHBondContact OD2-NH2 3.01Å |
| 96 | R | 39 | Very low | 36.8 | Very low | 173 Ų | 173 | 132 Ų | 132 | 65% | 0.653 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -57 | -38.5 | 175.4 | -165.4 | -179.8 | -168.4 | 178.8 | 4.8 | 112.9 | L94 | L94-R96 PolarHBondContact O-N 2.86Å |
| 97 | R | 39.4 | Very low | 36.6 | Very low | 165 Ų | 165 | 134 Ų | 134 | 62% | 0.623 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -78.5 | -38 | 179.5 | -61.4 | 177.1 | -164.9 | -134 | 3.7 | 111.8 | D93 L94 D95 R99 L100 A101 | D93-R97 IonicContact OD2-CZ 3.35Å; D93-R97 IonicContact OD2-NE 2.8Å; D93-R97 PolarHBondContact OD2-NE 3.47Å; D93-R97 VanDerWaalsContact OD2-NE 3.11Å; D93-R97 IonicContact OD2-NH2 3.29Å; D93-R97 PolarHBondContact OD2-NH2 2.9Å; L94-R97 PolarHBondContact O-N 2.95Å; L94-R97 VanDerWaalsContact O-N 3.13Å; D95-R97 VanDerWaalsContact C-N 3.28Å; D95-R97 PolarHBondContact O-N 3.43Å; R97-R99 VanDerWaalsContact C-N 3.34Å; R97-R99 PolarHBondContact O-N 3.46Å; R97-L100 PolarHBondContact O-N 2.82Å; R97-A101 PolarHBondContact O-N 3.5Å |
| 98 | V | 43.2 | Very low | 36.3 | Very low | 89 Ų | 89 | 136.7 Ų | 136.7 | 54% | 0.539 | 70% | 0.704 | S | S | . | * | H | α-helix | trans | -63.1 | -38.9 | 177.7 | 175.4 | 0 | 0 | 0 | 0 | 111.6 | L94 D95 A101 | L94-V98 PolarHBondContact O-N 3.27Å; D95-V98 PolarHBondContact O-N 3.29Å; V98-A101 PolarHBondContact O-N 3.2Å |
| 99 | R | 41 | Very low | 36.3 | Very low | 182 Ų | 182 | 136.6 Ų | 136.6 | 69% | 0.687 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -67.1 | -39.4 | 175.9 | -64.9 | -172.9 | -156.4 | -166 | 9.9 | 113.3 | D95 R97 A101 R102 | D95-R99 WeakPolarHBondContact O-CG 3.43Å; D95-R99 PolarHBondContact O-N 3.29Å; D95-R99 IonicContact OD1-NE 3.52Å; D95-R99 IonicContact OD2-CZ 3.88Å; D95-R99 IonicContact OD2-NE 3.11Å; D95-R99 PolarHBondContact OD2-NE 3.38Å; D95-R99 IonicContact OD2-NH2 2.72Å; D95-R99 PolarHBondContact OD2-NH2 3.01Å; R97-R99 VanDerWaalsContact C-N 3.34Å; R97-R99 PolarHBondContact O-N 3.46Å; R99-A101 VanDerWaalsContact C-N 3.29Å; R99-A101 PolarHBondContact O-N 3.41Å; R99-R102 PolarHBondContact O-N 3.44Å |
| 100 | L | 41.5 | Very low | 36 | Very low | 141 Ų | 141 | 136.9 Ų | 136.9 | 74% | 0.738 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -64.4 | -32.5 | 178.4 | -76.5 | 168.5 | 0 | 0 | 0 | 112.8 | R97 R102 | R97-L100 PolarHBondContact O-N 2.82Å; L100-R102 VanDerWaalsContact C-N 3.33Å |
| 101 | A | 36 | Very low | 35.6 | Very low | 69 Ų | 69 | 135.5 Ų | 135.5 | 57% | 0.57 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -73.4 | -21.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | R97 V98 R99 | R97-A101 PolarHBondContact O-N 3.5Å; V98-A101 PolarHBondContact O-N 3.2Å; R99-A101 VanDerWaalsContact C-N 3.29Å; R99-A101 PolarHBondContact O-N 3.41Å |
| 102 | R | 35.6 | Very low | 35.3 | Very low | 216 Ų | 216 | 135.8 Ų | 135.8 | 82% | 0.815 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.8 | 16.1 | -168.3 | -136.3 | -164.4 | 86.3 | 102.2 | 9.3 | 115.3 | R99 L100 | R99-R102 PolarHBondContact O-N 3.44Å; L100-R102 VanDerWaalsContact C-N 3.33Å |
| 103 | G | 32.3 | Very low | 34.6 | Very low | 72 Ų | 72 | 138 Ų | 138 | 74% | 0.742 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.3 | 20.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 104 | A | 35.4 | Very low | 34.2 | Very low | 81 Ų | 81 | 139.9 Ų | 139.9 | 67% | 0.669 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -111.4 | -8.4 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 105 | D | 34 | Very low | 33.5 | Very low | 147 Ų | 147 | 143.5 Ų | 143.5 | 79% | 0.786 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -105.9 | 4.4 | -168.8 | -63.2 | -40.8 | 0 | 0 | 0 | 114.7 | ||
| 106 | E | 36.9 | Very low | 33 | Very low | 179 Ų | 179 | 143.4 Ų | 143.4 | 84% | 0.836 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -128.7 | 71.3 | -177.9 | -68.3 | -172 | 148.8 | 0 | 0 | 112.1 | ||
| 107 | D | 29.3 | Very low | 32.4 | Very low | 174 Ų | 174 | 145.7 Ų | 145.7 | 93% | 0.93 | 75% | 0.75 | S | S | * | * | trans | 179.3 | 80.6 | 143 | -98.5 | -21.2 | 0 | 0 | 0 | 111.4 | ||||
| 108 | E | 31.4 | Very low | 31.8 | Very low | 177 Ų | 177 | 146.6 Ų | 146.6 | 83% | 0.827 | 76% | 0.761 | S | S | * | * | trans | -123.2 | 145.3 | 159.2 | -143.2 | -158.1 | 111.6 | 0 | 0 | 109.9 | ||||
| 109 | Q | 30 | Very low | 31 | Very low | 163 Ų | 163 | 150.3 Ų | 150.3 | 76% | 0.762 | 78% | 0.778 | S | S | * | * | trans | 74.2 | 77.4 | 176.2 | -49.7 | -178.5 | 14.4 | 0 | 0 | 119 | ||||
| 110 | Q | 26.2 | Very low | 30.2 | Very low | 187 Ų | 187 | 150.5 Ų | 150.5 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | trans | -153.2 | 73 | 135.2 | -151.4 | 72.6 | 71 | 0 | 0 | 115.5 | ||||
| 111 | S | 25.6 | Very low | 29.5 | Very low | 96 Ų | 96 | 155.7 Ų | 155.7 | 67% | 0.671 | 80% | 0.797 | S | S | * | * | trans | 43.3 | 103.9 | 145.7 | -179.6 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 112 | T | 29 | Very low | 29 | Very low | 131 Ų | 131 | 158.9 Ų | 158.9 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | 65.6 | 95.4 | 122.1 | -37.3 | 0 | 0 | 0 | 0 | 120.6 | |||||
| 113 | F | 24.7 | Very low | 28.7 | Very low | 191 Ų | 191 | 154.7 Ų | 154.7 | 84% | 0.838 | 81% | 0.807 | S | S | * | * | -161 | 158.6 | 121.7 | -160.6 | -119.3 | 0 | 0 | 0 | 111.5 | |||||
| 114 | S | 26.6 | Very low | 28.4 | Very low | 100 Ų | 100 | 156.7 Ų | 156.7 | 70% | 0.699 | 81% | 0.805 | S | S | * | * | trans | 61.5 | 77.5 | 174.1 | -59.9 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 115 | H | 28.4 | Very low | 28 | Very low | 201 Ų | 201 | 159.1 Ų | 159.1 | 93% | 0.931 | 81% | 0.814 | S | S | * | * | trans | -91.5 | 106 | 165.6 | -161.4 | -70.7 | 0 | 0 | 0 | 109.8 | ||||
| 116 | S | 26.5 | Very low | 27.6 | Very low | 77 Ų | 77 | 160.1 Ų | 160.1 | 54% | 0.538 | 81% | 0.814 | S | S | . | * | trans | -173.1 | 148.1 | 156.4 | -157.9 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 117 | Y | 27.7 | Very low | 27.1 | Very low | 222 Ų | 222 | 159.1 Ų | 159.1 | 87% | 0.871 | 81% | 0.814 | S | S | * | * | trans | 70.7 | 61.4 | 162.9 | -48.4 | -60 | 0 | 0 | 0 | 119.8 | ||||
| 118 | E | 25.4 | Very low | 27 | Very low | 183 Ų | 183 | 156.5 Ų | 156.5 | 86% | 0.855 | 80% | 0.804 | S | S | * | * | trans | -133.7 | 122.3 | 135.9 | -77.5 | -164.5 | 98.2 | 0 | 0 | 108.9 | ||||
| 119 | N | 26.6 | Very low | 26.8 | Very low | 168 Ų | 168 | 156.8 Ų | 156.8 | 90% | 0.898 | 81% | 0.806 | S | S | * | * | trans | 176.4 | 75.8 | 164.5 | -99.2 | -32.4 | 0 | 0 | 0 | 111.3 | ||||
| 120 | E | 25 | Very low | 26.6 | Very low | 186 Ų | 186 | 157.4 Ų | 157.4 | 87% | 0.869 | 81% | 0.806 | S | S | * | * | trans | -155.9 | 90.6 | 158.6 | -125.4 | 177.4 | 152.3 | 0 | 0 | 111.4 | ||||
| 121 | W | 26.3 | Very low | 26.6 | Very low | 250 Ų | 250 | 153.7 Ų | 153.7 | 95% | 0.947 | 80% | 0.801 | S | S | * | * | trans | -94.2 | 114.6 | 168.1 | -86.2 | 75 | 0 | 0 | 0 | 109.3 | ||||
| 122 | V | 26.9 | Very low | 26.6 | Very low | 136 Ų | 136 | 155.3 Ų | 155.3 | 82% | 0.824 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 134.8 | 176.2 | 178.2 | 0 | 0 | 0 | 0 | 110.5 | ||
| 123 | T | 28 | Very low | 26.5 | Very low | 127 Ų | 127 | 155 Ų | 155 | 78% | 0.779 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 140.3 | -165 | -36.8 | 0 | 0 | 0 | 0 | 113.7 | ||
| 124 | T | 25.9 | Very low | 26.6 | Very low | 115 Ų | 115 | 151.9 Ų | 151.9 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 137.7 | 165 | 48.9 | 0 | 0 | 0 | 0 | 111.3 | Q126 | T124-Q126 PolarHBondContact O-N 3.19Š|
| 125 | P | 28.4 | Very low | 26.6 | Very low | 132 Ų | 132 | 156.3 Ų | 156.3 | 86% | 0.857 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 121.3 | 178.5 | 28.2 | -33.6 | 0 | 0 | 0 | 111.3 | ||
| 126 | Q | 25.3 | Very low | 26.5 | Very low | 168 Ų | 168 | 152.4 Ų | 152.4 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 146.6 | 172.5 | -89.8 | -71.7 | 7.7 | 0 | 0 | 111.8 | T124 T128 | T124-Q126 PolarHBondContact O-N 3.19Å; Q126-T128 PolarHBondContact O-N 2.95Å |
| 127 | L | 25.5 | Very low | 26.4 | Very low | 158 Ų | 158 | 156 Ų | 156 | 83% | 0.827 | 80% | 0.796 | S | S | * | * | trans | -84.6 | 99.5 | 172.3 | -179.3 | 71.3 | 0 | 0 | 0 | 109.1 | E129 | L127-E129 PolarHBondContact O-N 3.28Š| ||
| 128 | T | 27.7 | Very low | 26.5 | Very low | 118 Ų | 118 | 153 Ų | 153 | 72% | 0.724 | 79% | 0.794 | S | S | * | * | trans | -80.1 | 107.9 | 171.7 | 48.9 | 0 | 0 | 0 | 0 | 111 | Q126 | Q126-T128 PolarHBondContact O-N 2.95Š| ||
| 129 | E | 27.8 | Very low | 26.5 | Very low | 184 Ų | 184 | 151.4 Ų | 151.4 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | -55.8 | 134.9 | 153.5 | -71.3 | -172.5 | 102.4 | 0 | 0 | 109.5 | L127 | L127-E129 PolarHBondContact O-N 3.28Š| ||
| 130 | F | 24.6 | Very low | 26.5 | Very low | 175 Ų | 175 | 152 Ų | 152 | 77% | 0.768 | 79% | 0.789 | S | S | * | * | trans | -137.7 | 84.8 | 167.5 | -139.5 | -87.7 | 0 | 0 | 0 | 110.1 | N132 | F130-N132 PolarHBondContact O-N 2.94Š| ||
| 131 | S | 26.2 | Very low | 26.7 | Very low | 109 Ų | 109 | 153.6 Ų | 153.6 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | trans | -68.6 | 121.9 | 170.2 | -177.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 132 | N | 25.7 | Very low | 26.9 | Very low | 131 Ų | 131 | 149 Ų | 149 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | trans | -147.8 | 112 | 163.9 | -117.4 | -24 | 0 | 0 | 0 | 110.9 | F130 | F130-N132 PolarHBondContact O-N 2.94Š| ||
| 133 | T | 27 | Very low | 26.9 | Very low | 124 Ų | 124 | 150.5 Ų | 150.5 | 76% | 0.761 | 78% | 0.779 | S | S | * | * | trans | -76.9 | 122 | -179.4 | -60.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 134 | T | 28 | Very low | 27.2 | Very low | 125 Ų | 125 | 151.9 Ų | 151.9 | 77% | 0.767 | 78% | 0.78 | S | S | * | * | trans | -138.9 | 116.4 | 161 | -54.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 135 | R | 24.9 | Very low | 27.5 | Very low | 193 Ų | 193 | 153.1 Ų | 153.1 | 73% | 0.728 | 78% | 0.782 | S | S | * | * | trans | -79 | 124.7 | 174.4 | -69.4 | 176.2 | 64.2 | 118.9 | -1.4 | 109.7 | E137 | R135-E137 IonicContact CZ-OE2 3.6Å; R135-E137 IonicContact NE-OE2 3.75Å; R135-E137 IonicContact NH2-OE1 3.92Å; R135-E137 IonicContact NH2-OE2 2.67Å; R135-E137 PolarHBondContact NH2-OE2 3.34Å | ||
| 136 | V | 27.3 | Very low | 27.7 | Very low | 120 Ų | 120 | 154.7 Ų | 154.7 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | trans | -134.4 | 113.6 | 154.7 | -178.6 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 137 | E | 24.5 | Very low | 28.3 | Very low | 151 Ų | 151 | 155.6 Ų | 155.6 | 71% | 0.706 | 79% | 0.787 | S | S | * | * | trans | -88 | 130 | 171.8 | -74.3 | 161.9 | 85.6 | 0 | 0 | 109.2 | R135 | R135-E137 IonicContact CZ-OE2 3.6Å; R135-E137 IonicContact NE-OE2 3.75Å; R135-E137 IonicContact NH2-OE1 3.92Å; R135-E137 IonicContact NH2-OE2 2.67Å; R135-E137 PolarHBondContact NH2-OE2 3.34Å | ||
| 138 | L | 28.9 | Very low | 28.6 | Very low | 159 Ų | 159 | 152.4 Ų | 152.4 | 83% | 0.832 | 78% | 0.783 | S | S | * | * | trans | -151.4 | 111.3 | 165.6 | -113.9 | 159.9 | 0 | 0 | 0 | 109.4 | ||||
| 139 | N | 25.9 | Very low | 28.5 | Very low | 150 Ų | 150 | 153.8 Ų | 153.8 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | trans | -68.6 | 139.2 | 176.6 | -73.7 | -47.9 | 0 | 0 | 0 | 110.9 | ||||
| 140 | H | 27.7 | Very low | 28.7 | Very low | 181 Ų | 181 | 151.3 Ų | 151.3 | 84% | 0.838 | 78% | 0.784 | S | S | * | * | -148.4 | 142.2 | 124.8 | -111.9 | 63.5 | 0 | 0 | 0 | 111 | |||||
| 141 | R | 27.9 | Very low | 29.2 | Very low | 220 Ų | 220 | 148 Ų | 148 | 83% | 0.83 | 78% | 0.782 | S | S | * | * | trans | -82.3 | 149.2 | 156.2 | -76.8 | 177.7 | 172.1 | 161.3 | -4.7 | 107.4 | ||||
| 142 | D | 30 | Very low | 29.6 | Very low | 153 Ų | 153 | 148.6 Ų | 148.6 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | -154.5 | 131.8 | 127.4 | -95.7 | -36.1 | 0 | 0 | 0 | 109.2 | |||||
| 143 | E | 28.5 | Very low | 30.3 | Very low | 168 Ų | 168 | 148.3 Ų | 148.3 | 79% | 0.785 | 78% | 0.782 | S | S | * | * | trans | -92.6 | 119 | 170.8 | -74 | -178 | 84.5 | 0 | 0 | 109.1 | ||||
| 144 | I | 34.4 | Very low | 31 | Very low | 155 Ų | 155 | 149 Ų | 149 | 80% | 0.795 | 78% | 0.781 | S | S | * | * | trans | -124.1 | 96.2 | 162.2 | -58.2 | -178.3 | 0 | 0 | 0 | 107.7 | L146 | I144-L146 PolarHBondContact O-N 2.84Š| ||
| 145 | N | 30.6 | Very low | 31.5 | Very low | 141 Ų | 141 | 150.1 Ų | 150.1 | 75% | 0.754 | 78% | 0.783 | S | S | * | * | trans | -68.8 | 117.4 | 167.7 | -84.9 | -79.4 | 0 | 0 | 0 | 109.2 | ||||
| 146 | L | 34.3 | Very low | 32.6 | Very low | 165 Ų | 165 | 149.2 Ų | 149.2 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | trans | -131.7 | 121.8 | 156.8 | -145.8 | 76.5 | 0 | 0 | 0 | 110.4 | I144 A148 | I144-L146 PolarHBondContact O-N 2.84Å; L146-A148 PolarHBondContact O-N 3.42Å | ||
| 147 | Q | 37.3 | Very low | 33.3 | Very low | 188 Ų | 188 | 145.2 Ų | 145.2 | 88% | 0.879 | 77% | 0.769 | S | S | * | * | trans | -79.4 | 104.8 | -166.3 | -176 | 177 | 1.3 | 0 | 0 | 111.2 | ||||
| 148 | A | 30.6 | Very low | 34 | Very low | 91 Ų | 91 | 144.2 Ų | 144.2 | 75% | 0.752 | 78% | 0.776 | S | S | * | * | trans | -104.2 | 128.7 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | L146 T150 | L146-A148 PolarHBondContact O-N 3.42Å; A148-T150 PolarHBondContact O-N 3.36Å | ||
| 149 | N | 27.3 | Very low | 34.8 | Very low | 146 Ų | 146 | 145.1 Ų | 145.1 | 78% | 0.781 | 77% | 0.774 | S | S | * | * | trans | -64.3 | 128.8 | -176.9 | -84 | -11.4 | 0 | 0 | 0 | 112.1 | S151 | N149-S151 PolarHBondContact O-N 3.44Š| ||
| 150 | T | 31.5 | Very low | 35.9 | Very low | 132 Ų | 132 | 143.1 Ų | 143.1 | 81% | 0.81 | 76% | 0.763 | S | S | * | * | trans | -69.9 | 91.8 | 157.8 | 46.4 | 0 | 0 | 0 | 0 | 109.6 | A148 | A148-T150 PolarHBondContact O-N 3.36Š| ||
| 151 | S | 34.9 | Very low | 37.2 | Very low | 105 Ų | 105 | 138.3 Ų | 138.3 | 73% | 0.734 | 75% | 0.748 | S | S | * | * | trans | -80.4 | 109 | 160.9 | 54.1 | 0 | 0 | 0 | 0 | 108.9 | N149 | N149-S151 PolarHBondContact O-N 3.44Š| ||
| 152 | N | 34.5 | Very low | 38.3 | Very low | 123 Ų | 123 | 134 Ų | 134 | 66% | 0.658 | 74% | 0.735 | S | S | * | * | trans | -58.9 | 133.6 | 172.5 | -66.4 | 11.1 | 0 | 0 | 0 | 109.9 | D154 | N152-D154 VanDerWaalsContact C-N 3.25Å; N152-D154 PolarHBondContact O-N 3.03Å | ||
| 153 | P | 40.6 | Very low | 39.1 | Very low | 125 Ų | 125 | 135 Ų | 135 | 81% | 0.812 | 73% | 0.729 | S | S | * | * | trans | -90 | 21.7 | 170.8 | 37.5 | -34.6 | 0 | 0 | 0 | 112.7 | D155 | P153-D155 PolarHBondContact O-N 3.28Š| ||
| 154 | D | 41.8 | Very low | 40.2 | Very low | 137 Ų | 137 | 131.1 Ų | 131.1 | 73% | 0.733 | 72% | 0.718 | S | S | * | * | trans | -82.2 | 61.8 | 176.9 | -62.7 | -44.4 | 0 | 0 | 0 | 111.2 | N152 | N152-D154 VanDerWaalsContact C-N 3.25Å; N152-D154 PolarHBondContact O-N 3.03Å | ||
| 155 | D | 39.1 | Very low | 41.1 | Very low | 150 Ų | 150 | 127 Ų | 127 | 80% | 0.802 | 70% | 0.697 | S | S | * | * | trans | -117.6 | 74 | 167.8 | -163.4 | 8.4 | 0 | 0 | 0 | 108.8 | P153 G157 | P153-D155 PolarHBondContact O-N 3.28Å; D155-G157 PolarHBondContact O-N 3.36Å | ||
| 156 | E | 47.1 | Very low | 42.2 | Very low | 174 Ų | 174 | 124.3 Ų | 124.3 | 81% | 0.813 | 69% | 0.686 | S | S | * | * | trans | -68.5 | 60.7 | 171.2 | -84.6 | -81.8 | 130.4 | 0 | 0 | 110.5 | ||||
| 157 | G | 42.6 | Very low | 43.1 | Very low | 35 Ų | 35 | 124.6 Ų | 124.6 | 36% | 0.361 | 68% | 0.683 | S | S | . | * | trans | -60 | 150.3 | 163.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | D155 F159 | D155-G157 PolarHBondContact O-N 3.36Å; G157-F159 PolarHBondContact O-N 3.06Å | ||
| 158 | P | 39.5 | Very low | 43.9 | Very low | 130 Ų | 130 | 119.8 Ų | 119.8 | 84% | 0.844 | 67% | 0.67 | S | S | * | * | trans | -57.7 | 114.1 | -174.3 | 23.4 | -34 | 0 | 0 | 0 | 110.8 | N160 | P158-N160 PolarHBondContact O-N 3.07Š| ||
| 159 | F | 45.2 | Very low | 45.6 | Very low | 179 Ų | 179 | 118 Ų | 118 | 79% | 0.785 | 65% | 0.652 | S | S | * | * | trans | -57.7 | 97.6 | -172.6 | -134.8 | -78.8 | 0 | 0 | 0 | 110.6 | G157 P161 | G157-F159 PolarHBondContact O-N 3.06Å; F159-P161 WeakPolarHBondContact O-CD 3.33Å | ||
| 160 | N | 48.6 | Very low | 48.2 | Very low | 108 Ų | 108 | 119.7 Ų | 119.7 | 58% | 0.578 | 65% | 0.649 | S | S | * | * | trans | -74.8 | 114.3 | -168.6 | -166.6 | 0.3 | 0 | 0 | 0 | 109.1 | P158 F162 Y163 | P158-N160 PolarHBondContact O-N 3.07Å; N160-F162 PolarHBondContact O-N 3.16Å; N160-Y163 PolarHBondContact O-N 2.95Å | ||
| 161 | P | 54.2 | Low | 50.5 | Low | 80 Ų | 80 | 117.4 Ų | 117.4 | 52% | 0.519 | 63% | 0.634 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74 | 19.4 | -165.6 | 31.1 | -37.5 | 0 | 0 | 0 | 114.7 | F159 | F159-P161 WeakPolarHBondContact O-CD 3.33Š|
| 162 | F | 52.5 | Low | 52.8 | Low | 129 Ų | 129 | 113.2 Ų | 113.2 | 57% | 0.566 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.7 | 20.2 | -175.8 | -60.8 | -72.3 | 0 | 0 | 0 | 112.9 | N160 L165 L231 | N160-F162 PolarHBondContact O-N 3.16Å; F162-L165 WeakPolarHBondContact O-CD1 3.22Å; F162-L231 HydrophobicContact CE1-CD2 4.27Å |
| 163 | Y | 45.8 | Very low | 55.2 | Low | 175 Ų | 175 | 114.3 Ų | 114.3 | 69% | 0.686 | 60% | 0.602 | S | S | * | * | trans | -138.1 | 141.6 | 178 | -138.2 | -105.9 | 0 | 0 | 0 | 111.3 | N160 V166 | N160-Y163 PolarHBondContact O-N 2.95Å; Y163-V166 HydrophobicContact CE1-CG2 4.31Å | ||
| 164 | P | 51.1 | Low | 57.4 | Low | 86 Ų | 86 | 111.3 Ų | 111.3 | 56% | 0.558 | 58% | 0.581 | S | S | * | * | cis | -94.4 | 135.6 | 6.2 | 35.6 | -31.9 | 0 | 0 | 0 | 114.3 | V166 | P164-V166 HydrophobicContact CB-CG2 4.41Š| ||
| 165 | L | 54.7 | Low | 59.6 | Low | 67 Ų | 67 | 106.1 Ų | 106.1 | 35% | 0.351 | 55% | 0.554 | S | S | . | * | trans | -97.4 | 11.5 | 175.4 | -83.7 | 164.7 | 0 | 0 | 0 | 113.9 | F162 A172 | F162-L165 WeakPolarHBondContact O-CD1 3.22Å; L165-A172 HydrophobicContact CD2-CB 4.22Å | ||
| 166 | V | 52.7 | Low | 62 | Low | 85 Ų | 85 | 103.4 Ų | 103.4 | 52% | 0.515 | 54% | 0.539 | S | S | . | . | trans | -85.6 | -36 | -151.3 | -173 | 0 | 0 | 0 | 0 | 114.4 | Y163 P164 | Y163-V166 HydrophobicContact CE1-CG2 4.31Å; P164-V166 HydrophobicContact CB-CG2 4.41Å | ||
| 167 | E | 52.7 | Low | 64.1 | Low | 171 Ų | 171 | 101.1 Ų | 101.1 | 80% | 0.799 | 53% | 0.532 | S | S | * | . | S | Bend | trans | -84.4 | -11.7 | -175.5 | -95.5 | 66.1 | -143 | 0 | 0 | 116.6 | ||
| 168 | S | 55.6 | Low | 66.4 | Low | 87 Ų | 87 | 102.4 Ų | 102.4 | 61% | 0.608 | 53% | 0.53 | S | S | * | . | trans | -152.3 | 35.7 | -175 | -77.3 | 0 | 0 | 0 | 0 | 115.1 | Y170 V171 A172 | S168-Y170 PolarHBondContact O-N 2.72Å; S168-Y170 VanDerWaalsContact O-N 3.16Å; S168-V171 PolarHBondContact O-N 3.35Å; S168-A172 PolarHBondContact O-N 3.28Å | ||
| 169 | S | 66.8 | Low | 69 | Low | 54 Ų | 54 | 97 Ų | 97 | 38% | 0.378 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -48.6 | -43.1 | -173 | 59.7 | 0 | 0 | 0 | 0 | 115.8 | V171 A172 Y173 | S169-V171 PolarHBondContact O-N 3.15Å; S169-A172 PolarHBondContact O-N 3.48Å; S169-Y173 WeakPolarHBondContact O-CD2 3.39Å; S169-Y173 PolarHBondContact O-N 3.43Å |
| 170 | Y | 80.7 | Confident | 71.3 | Confident | 182 Ų | 182 | 90.2 Ų | 90.2 | 71% | 0.714 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -61.5 | -43.6 | -177 | -177.4 | -99.3 | 0 | 0 | 0 | 113.2 | S168 Y173 V174 | S168-Y170 PolarHBondContact O-N 2.72Å; S168-Y170 VanDerWaalsContact O-N 3.16Å; Y170-Y173 PolarHBondContact O-N 3.14Å; Y170-V174 HydrophobicContact CD1-CG2 4.18Å; Y170-V174 HydrophobicContact CE1-CG2 3.74Å; Y170-V174 HydrophobicContact CE2-CG2 4.18Å; Y170-V174 WeakPolarHBondContact O-CG2 3.37Å; Y170-V174 PolarHBondContact O-N 3.17Å |
| 171 | V | 80.3 | Confident | 73.5 | Confident | 83 Ų | 83 | 89.7 Ų | 89.7 | 50% | 0.503 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -66.5 | -43.6 | 179.9 | -178.7 | 0 | 0 | 0 | 0 | 110.1 | S168 S169 Y173 V174 V175 | S168-V171 PolarHBondContact O-N 3.35Å; S169-V171 PolarHBondContact O-N 3.15Å; V171-Y173 PolarHBondContact O-N 3.15Å; V171-V174 PolarHBondContact O-N 2.89Å; V171-V175 HydrophobicContact CG1-CG2 4.33Å; V171-V175 WeakPolarHBondContact O-CG2 3.42Å; V171-V175 PolarHBondContact O-N 2.95Å |
| 172 | A | 82.3 | Confident | 75.5 | Confident | 17 Ų | 17 | 86.4 Ų | 86.4 | 14% | 0.14 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -56.7 | -46 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L165 S168 S169 L176 L234 | L165-A172 HydrophobicContact CD2-CB 4.22Å; S168-A172 PolarHBondContact O-N 3.28Å; S169-A172 PolarHBondContact O-N 3.48Å; A172-L176 WeakPolarHBondContact O-CB 3.49Å; A172-L176 PolarHBondContact O-N 3.04Å; A172-L234 HydrophobicContact CB-CD2 3.5Å |
| 173 | Y | 85.9 | Confident | 77.6 | Confident | 147 Ų | 147 | 82.7 Ų | 82.7 | 58% | 0.576 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -66.1 | -40.5 | 176.7 | -71.3 | -54.2 | 0 | 0 | 0 | 113.1 | S169 Y170 V171 L176 L177 | S169-Y173 WeakPolarHBondContact O-CD2 3.39Å; S169-Y173 PolarHBondContact O-N 3.43Å; Y170-Y173 PolarHBondContact O-N 3.14Å; V171-Y173 PolarHBondContact O-N 3.15Å; Y173-L176 PolarHBondContact O-N 3.3Å; Y173-L177 VanDerWaalsContact O-CB 3.24Å; Y173-L177 WeakPolarHBondContact O-CB 3.5Å; Y173-L177 PolarHBondContact O-N 2.8Å |
| 174 | V | 87.3 | Confident | 80 | Confident | 62 Ų | 62 | 77.1 Ų | 77.1 | 38% | 0.376 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -63.7 | -45.2 | 176.8 | 169.2 | 0 | 0 | 0 | 0 | 111 | Y170 V171 L177 L178 | Y170-V174 HydrophobicContact CD1-CG2 4.18Å; Y170-V174 HydrophobicContact CE1-CG2 3.74Å; Y170-V174 HydrophobicContact CE2-CG2 4.18Å; Y170-V174 WeakPolarHBondContact O-CG2 3.37Å; Y170-V174 PolarHBondContact O-N 3.17Å; V171-V174 PolarHBondContact O-N 2.89Å; V174-L177 PolarHBondContact O-N 3.43Å; V174-L178 WeakPolarHBondContact O-CB 3.37Å; V174-L178 PolarHBondContact O-N 3.25Å |
| 175 | V | 86.2 | Confident | 82.2 | Confident | 27 Ų | 27 | 76.2 Ų | 76.2 | 16% | 0.164 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -61.9 | -47 | 176.8 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | V171 L178 A179 L457 | V171-V175 HydrophobicContact CG1-CG2 4.33Å; V171-V175 WeakPolarHBondContact O-CG2 3.42Å; V171-V175 PolarHBondContact O-N 2.95Å; V175-L178 PolarHBondContact O-N 3.24Å; V175-A179 WeakPolarHBondContact O-CB 3.48Å; V175-A179 PolarHBondContact O-N 3.46Å; V175-L457 HydrophobicContact CG2-CD1 3.9Å |
| 176 | L | 89.6 | Confident | 84.2 | Confident | 93 Ų | 93 | 73 Ų | 73 | 49% | 0.487 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -63.7 | -42.9 | 179.9 | -176.1 | 64.2 | 0 | 0 | 0 | 112.5 | A172 Y173 G180 L234 | A172-L176 WeakPolarHBondContact O-CB 3.49Å; A172-L176 PolarHBondContact O-N 3.04Å; Y173-L176 PolarHBondContact O-N 3.3Å; L176-G180 PolarHBondContact O-N 3.29Å; L176-L234 HydrophobicContact CD1-CD1 4.24Å |
| 177 | L | 91.3 | Very high | 86.3 | Confident | 126 Ų | 126 | 70.8 Ų | 70.8 | 66% | 0.66 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -66.2 | -43.6 | 177.9 | -176.1 | 152.8 | 0 | 0 | 0 | 111.5 | Y173 V174 G180 L181 | Y173-L177 VanDerWaalsContact O-CB 3.24Å; Y173-L177 WeakPolarHBondContact O-CB 3.5Å; Y173-L177 PolarHBondContact O-N 2.8Å; V174-L177 PolarHBondContact O-N 3.43Å; L177-G180 PolarHBondContact O-N 3.21Å; L177-L181 WeakPolarHBondContact O-CB 3.49Å; L177-L181 PolarHBondContact O-N 3.44Å |
| 178 | L | 91.8 | Very high | 88.3 | Confident | 62 Ų | 62 | 67.1 Ų | 67.1 | 33% | 0.325 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -67.6 | -43.9 | 179.4 | -175.3 | 58.2 | 0 | 0 | 0 | 111.6 | V174 V175 L181 V182 F461 | V174-L178 WeakPolarHBondContact O-CB 3.37Å; V174-L178 PolarHBondContact O-N 3.25Å; V175-L178 PolarHBondContact O-N 3.24Å; L178-L181 PolarHBondContact O-N 3.36Å; L178-V182 WeakPolarHBondContact O-CB 3.32Å; L178-V182 VanDerWaalsContact O-CG2 3.3Å; L178-V182 WeakPolarHBondContact O-CG2 3.42Å; L178-V182 PolarHBondContact O-N 3.46Å; L178-F461 HydrophobicContact CD1-CE2 3.74Å; L178-F461 HydrophobicContact CD1-CZ 4.2Å; L178-F461 HydrophobicContact CD2-CD2 3.77Å; L178-F461 HydrophobicContact CD2-CE2 3.54Å; L178-F461 HydrophobicContact CD2-CG 4.49Å; L178-F461 HydrophobicContact CD2-CZ 4.06Å; L178-F461 HydrophobicContact CG-CD2 4.04Å; L178-F461 HydrophobicContact CG-CE2 3.61Å; L178-F461 HydrophobicContact CG-CZ 4.39Å |
| 179 | A | 92.9 | Very high | 90.2 | Very high | 17 Ų | 17 | 63.3 Ų | 63.3 | 14% | 0.14 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -61.6 | -44 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | V175 L181 V182 L183 L226 A230 | V175-A179 WeakPolarHBondContact O-CB 3.48Å; V175-A179 PolarHBondContact O-N 3.46Å; A179-L181 PolarHBondContact O-N 3.15Å; A179-V182 PolarHBondContact O-N 2.78Å; A179-L183 WeakPolarHBondContact O-CB 3.19Å; A179-L183 PolarHBondContact O-N 3.25Å; A179-L226 HydrophobicContact CB-CD2 4.01Å; A179-L226 HydrophobicContact CB-CG 4.46Å; A179-A230 HydrophobicContact CB-CB 4.4Å |
| 180 | G | 94.6 | Very high | 91.6 | Very high | 36 Ų | 36 | 60.7 Ų | 60.7 | 37% | 0.371 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.5 | -40.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | L176 L177 A184 | L176-G180 PolarHBondContact O-N 3.29Å; L177-G180 PolarHBondContact O-N 3.21Å; G180-A184 VanDerWaalsContact O-CB 3.31Å; G180-A184 WeakPolarHBondContact O-CB 3.45Å; G180-A184 PolarHBondContact O-N 3.22Å |
| 181 | L | 95.6 | Very high | 92.2 | Very high | 98 Ų | 98 | 56.4 Ų | 56.4 | 51% | 0.513 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -65.1 | -47.9 | 175.4 | 178.5 | 63 | 0 | 0 | 0 | 111.9 | L177 L178 A179 L183 A184 V185 | L177-L181 WeakPolarHBondContact O-CB 3.49Å; L177-L181 PolarHBondContact O-N 3.44Å; L178-L181 PolarHBondContact O-N 3.36Å; A179-L181 PolarHBondContact O-N 3.15Å; L181-L183 VanDerWaalsContact C-N 3.35Å; L181-A184 PolarHBondContact O-N 3.04Å; L181-V185 HydrophobicContact CD1-CG2 4.07Å; L181-V185 WeakPolarHBondContact O-CB 3.22Å; L181-V185 WeakPolarHBondContact O-CG2 3.49Å; L181-V185 PolarHBondContact O-N 3.39Å |
| 182 | V | 95.9 | Very high | 92.8 | Very high | 11 Ų | 11 | 52.9 Ų | 52.9 | 7% | 0.067 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.3 | -42.5 | 178 | 169 | 0 | 0 | 0 | 0 | 111 | L178 A179 G186 L222 L226 F461 F464 A468 | L178-V182 WeakPolarHBondContact O-CB 3.32Å; L178-V182 VanDerWaalsContact O-CG2 3.3Å; L178-V182 WeakPolarHBondContact O-CG2 3.42Å; L178-V182 PolarHBondContact O-N 3.46Å; A179-V182 PolarHBondContact O-N 2.78Å; V182-G186 PolarHBondContact O-N 2.92Å; V182-L222 HydrophobicContact CG1-CD2 4.03Å; V182-L226 HydrophobicContact CB-CD1 4.4Å; V182-L226 HydrophobicContact CG1-CD1 3.98Å; V182-F461 HydrophobicContact CG2-CE2 4.15Å; V182-F464 HydrophobicContact CG1-CB 3.74Å; V182-F464 WeakPolarHBondContact CG1-O 3.49Å; V182-A468 HydrophobicContact CG1-CB 4.03Å |
| 183 | L | 96.8 | Very high | 93.4 | Very high | 51 Ų | 51 | 52.1 Ų | 52.1 | 27% | 0.267 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -59.9 | -52.5 | 174.1 | 179.8 | 63.6 | 0 | 0 | 0 | 111.5 | A179 L181 G186 V187 L222 L226 | A179-L183 WeakPolarHBondContact O-CB 3.19Å; A179-L183 PolarHBondContact O-N 3.25Å; L181-L183 VanDerWaalsContact C-N 3.35Å; L183-G186 PolarHBondContact O-N 3.43Å; L183-V187 HydrophobicContact CD1-CG2 3.78Å; L183-V187 HydrophobicContact CG-CG2 4.44Å; L183-V187 VanDerWaalsContact O-CB 3.24Å; L183-V187 WeakPolarHBondContact O-CB 3.43Å; L183-V187 VanDerWaalsContact O-CG2 3.26Å; L183-V187 WeakPolarHBondContact O-CG2 3.44Å; L183-V187 PolarHBondContact O-N 3.44Å; L183-L222 HydrophobicContact CD1-CB 4.35Å; L183-L222 WeakPolarHBondContact CD1-O 3.33Å; L183-L226 HydrophobicContact CB-CD1 4.05Å; L183-L226 HydrophobicContact CB-CD2 4.03Å; L183-L226 HydrophobicContact CD1-CD2 4.45Å; L183-L226 HydrophobicContact CD2-CD2 4.3Å |
| 184 | A | 96.3 | Very high | 93.7 | Very high | 57 Ų | 57 | 47.6 Ų | 47.6 | 47% | 0.471 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -62.3 | -49.4 | -177 | 0 | 0 | 0 | 0 | 0 | 112.3 | G180 L181 V188 | G180-A184 VanDerWaalsContact O-CB 3.31Å; G180-A184 WeakPolarHBondContact O-CB 3.45Å; G180-A184 PolarHBondContact O-N 3.22Å; L181-A184 PolarHBondContact O-N 3.04Å; A184-V188 WeakPolarHBondContact O-CB 3.23Å; A184-V188 VanDerWaalsContact O-CG2 3.3Å; A184-V188 WeakPolarHBondContact O-CG2 3.47Å; A184-V188 PolarHBondContact O-N 3.32Å |
| 185 | V | 96.2 | Very high | 93.9 | Very high | 67 Ų | 67 | 47.9 Ų | 47.9 | 41% | 0.406 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.9 | -47.4 | 178.6 | 173.4 | 0 | 0 | 0 | 0 | 110.8 | L181 A189 V472 | L181-V185 HydrophobicContact CD1-CG2 4.07Å; L181-V185 WeakPolarHBondContact O-CB 3.22Å; L181-V185 WeakPolarHBondContact O-CG2 3.49Å; L181-V185 PolarHBondContact O-N 3.39Å; V185-A189 VanDerWaalsContact O-CB 3.24Å; V185-A189 WeakPolarHBondContact O-CB 3.5Å; V185-A189 PolarHBondContact O-N 3.4Å; V185-V472 HydrophobicContact CG1-CG2 3.92Å |
| 186 | G | 96.4 | Very high | 94 | Very high | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -69.2 | -38.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | V182 L183 N190 | V182-G186 PolarHBondContact O-N 2.92Å; L183-G186 PolarHBondContact O-N 3.43Å; G186-N190 VanDerWaalsContact O-CB 3.26Å; G186-N190 WeakPolarHBondContact O-CB 3.35Å; G186-N190 PolarHBondContact O-N 3.47Å; G186-N190 PolarHBondContact O-ND2 3.42Å |
| 187 | V | 96.6 | Very high | 94 | Very high | 39 Ų | 39 | 42.5 Ų | 42.5 | 24% | 0.236 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63.8 | -49.6 | 174.6 | 164.7 | 0 | 0 | 0 | 0 | 110.8 | L183 A189 M191 F219 V223 | L183-V187 HydrophobicContact CD1-CG2 3.78Å; L183-V187 HydrophobicContact CG-CG2 4.44Å; L183-V187 VanDerWaalsContact O-CB 3.24Å; L183-V187 WeakPolarHBondContact O-CB 3.43Å; L183-V187 VanDerWaalsContact O-CG2 3.26Å; L183-V187 WeakPolarHBondContact O-CG2 3.44Å; L183-V187 PolarHBondContact O-N 3.44Å; V187-A189 PolarHBondContact O-N 2.95Å; V187-M191 HydrophobicContact CG1-CG 4.44Å; V187-M191 VanDerWaalsContact O-CB 3.24Å; V187-M191 WeakPolarHBondContact O-CB 3.41Å; V187-M191 VanDerWaalsContact O-CG 3.24Å; V187-M191 WeakPolarHBondContact O-CG 3.27Å; V187-M191 PolarHBondContact O-N 3.04Å; V187-F219 HydrophobicContact CG1-CD2 4.49Å; V187-F219 HydrophobicContact CG1-CE2 4.13Å; V187-F219 HydrophobicContact CG2-CD2 4.43Å; V187-F219 HydrophobicContact CG2-CE2 4.49Å; V187-V223 HydrophobicContact CG2-CG2 3.8Å |
| 188 | V | 95.2 | Very high | 93.7 | Very high | 93 Ų | 93 | 45.5 Ų | 45.5 | 56% | 0.564 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -61.5 | -46.2 | 179.9 | 171.6 | 0 | 0 | 0 | 0 | 111 | A184 A192 | A184-V188 WeakPolarHBondContact O-CB 3.23Å; A184-V188 VanDerWaalsContact O-CG2 3.3Å; A184-V188 WeakPolarHBondContact O-CG2 3.47Å; A184-V188 PolarHBondContact O-N 3.32Å; V188-A192 VanDerWaalsContact O-CB 3.31Å; V188-A192 WeakPolarHBondContact O-CB 3.36Å; V188-A192 PolarHBondContact O-N 3.05Å |
| 189 | A | 95.2 | Very high | 93.3 | Very high | 7 Ų | 7 | 47 Ų | 47 | 6% | 0.058 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -68.9 | -43.2 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | V185 V187 A192 V193 P471 V472 L475 | V185-A189 VanDerWaalsContact O-CB 3.24Å; V185-A189 WeakPolarHBondContact O-CB 3.5Å; V185-A189 PolarHBondContact O-N 3.4Å; V187-A189 PolarHBondContact O-N 2.95Å; A189-A192 WeakPolarHBondContact O-CB 3.3Å; A189-A192 PolarHBondContact O-N 3.41Å; A189-V193 WeakPolarHBondContact O-CG2 3.42Å; A189-V193 PolarHBondContact O-N 3.43Å; A189-V193 VanDerWaalsContact O-N 3.09Å; A189-P471 HydrophobicContact CB-CB 3.74Å; A189-P471 HydrophobicContact CB-CG 3.55Å; A189-V472 HydrophobicContact CB-CG2 3.64Å; A189-L475 HydrophobicContact CB-CD1 4.28Å |
| 190 | N | 95.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -66 | -43.6 | 177.1 | -77.1 | -53.6 | 0 | 0 | 0 | 111.7 | G186 A192 V193 M194 A215 F219 C467 P471 | G186-N190 VanDerWaalsContact O-CB 3.26Å; G186-N190 WeakPolarHBondContact O-CB 3.35Å; G186-N190 PolarHBondContact O-N 3.47Å; G186-N190 PolarHBondContact O-ND2 3.42Å; N190-A192 VanDerWaalsContact C-N 3.31Å; N190-A192 PolarHBondContact O-N 3.32Å; N190-V193 PolarHBondContact O-N 2.79Å; N190-M194 WeakPolarHBondContact O-CG 3.48Å; N190-M194 PolarHBondContact O-N 3.07Å; N190-A215 HydrophobicContact CB-CB 4.26Å; N190-A215 WeakPolarHBondContact CB-O 3.36Å; N190-A215 WeakPolarHBondContact OD1-CA 3.44Å; N190-A215 WeakPolarHBondContact OD1-CB 3.12Å; N190-A215 PolarHBondContact OD1-O 2.79Å; N190-F219 HydrophobicContact CB-CB 3.88Å; N190-C467 PolarHBondContact ND2-O 3.49Å; N190-P471 HydrophobicContact CB-CG 4.47Å; N190-P471 WeakPolarHBondContact OD1-CB 3.41Å; N190-P471 VanDerWaalsContact OD1-CG 3.26Å; N190-P471 WeakPolarHBondContact OD1-CG 3.36Å |
| 191 | M | 94.6 | Very high | 91.7 | Very high | 91 Ų | 91 | 55.2 Ų | 55.2 | 45% | 0.448 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61.1 | -38.5 | 175.1 | -75.3 | -65 | -67.2 | 0 | 0 | 112.2 | V187 C195 F219 | V187-M191 HydrophobicContact CG1-CG 4.44Å; V187-M191 VanDerWaalsContact O-CB 3.24Å; V187-M191 WeakPolarHBondContact O-CB 3.41Å; V187-M191 VanDerWaalsContact O-CG 3.24Å; V187-M191 WeakPolarHBondContact O-CG 3.27Å; V187-M191 PolarHBondContact O-N 3.04Å; M191-C195 WeakPolarHBondContact O-CB 3.44Å; M191-C195 PolarHBondContact O-N 3.4Å; M191-F219 HydrophobicContact CG-CD2 3.89Å; M191-F219 HydrophobicContact CG-CE2 3.71Å; M191-F219 HydrophobicContact SD-CD2 4.03Å; M191-F219 HydrophobicContact SD-CE2 3.68Å; M191-F219 HydrophobicContact SD-CZ 4.07Å |
| 192 | A | 92.6 | Very high | 90.4 | Very high | 10 Ų | 10 | 60.7 Ų | 60.7 | 8% | 0.083 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.8 | -49.1 | 174 | 0 | 0 | 0 | 0 | 0 | 112.2 | V188 A189 N190 M194 C195 V196 L475 F485 | V188-A192 VanDerWaalsContact O-CB 3.31Å; V188-A192 WeakPolarHBondContact O-CB 3.36Å; V188-A192 PolarHBondContact O-N 3.05Å; A189-A192 WeakPolarHBondContact O-CB 3.3Å; A189-A192 PolarHBondContact O-N 3.41Å; N190-A192 VanDerWaalsContact C-N 3.31Å; N190-A192 PolarHBondContact O-N 3.32Å; A192-M194 PolarHBondContact O-N 2.73Å; A192-C195 PolarHBondContact O-N 3.46Å; A192-V196 WeakPolarHBondContact O-CG2 3.48Å; A192-V196 PolarHBondContact O-N 3Å; A192-L475 HydrophobicContact CB-CD1 4.17Å; A192-L475 HydrophobicContact CB-CD2 4.49Å; A192-F485 HydrophobicContact CB-CD2 3.46Å; A192-F485 VanDerWaalsContact CB-CD2 3.46Å; A192-F485 HydrophobicContact CB-CE2 3.67Å; A192-F485 HydrophobicContact CB-CG 4.38Å |
| 193 | V | 93.9 | Very high | 89.3 | Confident | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -59.8 | -47.8 | 177.9 | 172.2 | 0 | 0 | 0 | 0 | 111.1 | A189 N190 V197 A215 P471 L474 L475 | A189-V193 WeakPolarHBondContact O-CG2 3.42Å; A189-V193 PolarHBondContact O-N 3.43Å; A189-V193 VanDerWaalsContact O-N 3.09Å; N190-V193 PolarHBondContact O-N 2.79Å; V193-V197 WeakPolarHBondContact O-CG2 3.49Å; V193-V197 PolarHBondContact O-N 3Å; V193-A215 HydrophobicContact CB-CB 4.04Å; V193-A215 HydrophobicContact CG1-CB 3.85Å; V193-P471 HydrophobicContact CG2-CB 3.98Å; V193-L474 HydrophobicContact CG1-CD1 4.36Å; V193-L474 HydrophobicContact CG2-CB 4.39Å; V193-L475 HydrophobicContact CG2-CD1 4.49Å; V193-L475 HydrophobicContact CG2-CD2 4.11Å; V193-L475 HydrophobicContact CG2-CG 4Å |
| 194 | M | 93.1 | Very high | 88.4 | Confident | 53 Ų | 53 | 64 Ų | 64 | 26% | 0.261 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -60.1 | -46.7 | 176.7 | -71.2 | 175.6 | 62.1 | 0 | 0 | 112.1 | N190 A192 W198 A215 F216 | N190-M194 WeakPolarHBondContact O-CG 3.48Å; N190-M194 PolarHBondContact O-N 3.07Å; A192-M194 PolarHBondContact O-N 2.73Å; M194-W198 VanDerWaalsContact O-CB 3.31Å; M194-W198 WeakPolarHBondContact O-CB 3.47Å; M194-W198 PolarHBondContact O-N 3.48Å; M194-A215 HydrophobicContact CG-CB 4.1Å; M194-F216 HydrophobicContact CE-CB 4.26Å; M194-F216 HydrophobicContact CE-CD2 3.79Å; M194-F216 HydrophobicContact CE-CG 4.49Å; M194-F216 HydrophobicContact SD-CB 4.06Å; M194-F216 HydrophobicContact SD-CD2 4.35Å |
| 195 | C | 90.4 | Very high | 87.7 | Confident | 68 Ų | 68 | 63.5 Ų | 63.5 | 46% | 0.459 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62.6 | -46.1 | -179 | -177.5 | 0 | 0 | 0 | 0 | 112 | M191 A192 W198 N199 | M191-C195 WeakPolarHBondContact O-CB 3.44Å; M191-C195 PolarHBondContact O-N 3.4Å; A192-C195 PolarHBondContact O-N 3.46Å; C195-W198 PolarHBondContact O-N 2.95Å; C195-N199 VanDerWaalsContact O-CB 3.23Å; C195-N199 WeakPolarHBondContact O-CB 3.37Å; C195-N199 PolarHBondContact O-N 3.47Å |
| 196 | V | 89.9 | Confident | 87.2 | Confident | 4 Ų | 4 | 61.2 Ų | 61.2 | 2% | 0.024 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.9 | -46.8 | -179.6 | 170.4 | 0 | 0 | 0 | 0 | 111.6 | A192 W198 N199 N200 L481 A484 F485 | A192-V196 WeakPolarHBondContact O-CG2 3.48Å; A192-V196 PolarHBondContact O-N 3Å; V196-W198 VanDerWaalsContact C-N 3.33Å; V196-W198 PolarHBondContact O-N 3.32Å; V196-N199 PolarHBondContact O-N 3.36Å; V196-N200 WeakPolarHBondContact O-CB 3.31Å; V196-N200 PolarHBondContact O-N 3.28Å; V196-L481 HydrophobicContact CB-CD2 4.1Å; V196-L481 HydrophobicContact CG1-CD2 3.76Å; V196-A484 HydrophobicContact CG1-CB 3.55Å; V196-A484 HydrophobicContact CG2-CB 4.27Å; V196-F485 HydrophobicContact CG2-CB 4.2Å |
| 197 | V | 88.9 | Confident | 86.7 | Confident | 2 Ų | 2 | 61.6 Ų | 61.6 | 1% | 0.012 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66.1 | -36.4 | 178.9 | 176.8 | 0 | 0 | 0 | 0 | 111.6 | V193 N208 Y209 A212 L481 | V193-V197 WeakPolarHBondContact O-CG2 3.49Å; V193-V197 PolarHBondContact O-N 3Å; V197-N208 HydrophobicContact CG1-CB 4.14Å; V197-N208 HydrophobicContact CG2-CB 4.14Å; V197-Y209 HydrophobicContact CG1-CD1 4.46Å; V197-A212 HydrophobicContact CB-CB 4.07Å; V197-A212 HydrophobicContact CG1-CB 3.99Å; V197-A212 HydrophobicContact CG2-CB 4.23Å; V197-L481 HydrophobicContact CG2-CD2 3.92Å |
| 198 | W | 85.8 | Confident | 86.4 | Confident | 189 Ų | 189 | 60.5 Ų | 60.5 | 72% | 0.716 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -71.6 | -42.7 | 177.7 | -165.7 | -101.8 | 0 | 0 | 0 | 112.6 | M194 C195 V196 R204 | M194-W198 VanDerWaalsContact O-CB 3.31Å; M194-W198 WeakPolarHBondContact O-CB 3.47Å; M194-W198 PolarHBondContact O-N 3.48Å; C195-W198 PolarHBondContact O-N 2.95Å; V196-W198 VanDerWaalsContact C-N 3.33Å; V196-W198 PolarHBondContact O-N 3.32Å; W198-R204 PolarHBondContact O-NE 2.86Å; W198-R204 PolarHBondContact O-NH2 3.04Å |
| 199 | N | 83.4 | Confident | 86.2 | Confident | 94 Ų | 94 | 58.2 Ų | 58.2 | 50% | 0.503 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -79.1 | -45 | -173.8 | -163 | 41.4 | 0 | 0 | 0 | 112.7 | C195 V196 Y201 | C195-N199 VanDerWaalsContact O-CB 3.23Å; C195-N199 WeakPolarHBondContact O-CB 3.37Å; C195-N199 PolarHBondContact O-N 3.47Å; V196-N199 PolarHBondContact O-N 3.36Å; N199-Y201 PolarHBondContact O-N 3.05Å |
| 200 | N | 79.9 | Confident | 86 | Confident | 50 Ų | 50 | 58.2 Ų | 58.2 | 27% | 0.267 | 27% | 0.268 | S | S | . | . | trans | -82.3 | 109.3 | -174.2 | -173.3 | -18.7 | 0 | 0 | 0 | 111.8 | V196 Y202 M203 | V196-N200 WeakPolarHBondContact O-CB 3.31Å; V196-N200 PolarHBondContact O-N 3.28Å; N200-Y202 VanDerWaalsContact C-N 3.3Å; N200-Y202 PolarHBondContact O-N 3.3Å; N200-Y202 WeakPolarHBondContact OD1-CB 3.41Å; N200-Y202 PolarHBondContact OD1-N 3.19Å; N200-M203 HydrophobicContact CB-CB 4.06Å; N200-M203 HydrophobicContact CB-CG 3.91Å; N200-M203 PolarHBondContact O-N 2.73Å | ||
| 201 | Y | 73 | Confident | 85.9 | Confident | 175 Ų | 175 | 58.2 Ų | 58.2 | 69% | 0.686 | 27% | 0.268 | S | S | * | . | G | 310 helix | trans | -56.7 | -39.3 | 179.2 | -180 | -95.4 | 0 | 0 | 0 | 113.4 | N199 M203 R204 | N199-Y201 PolarHBondContact O-N 3.05Å; Y201-M203 PolarHBondContact O-N 3.49Å; Y201-R204 WeakPolarHBondContact O-CB 3.4Å; Y201-R204 PolarHBondContact O-N 3Å |
| 202 | Y | 67.9 | Low | 85.8 | Confident | 214 Ų | 214 | 54.7 Ų | 54.7 | 84% | 0.839 | 25% | 0.253 | S | S | * | . | G | 310 helix | trans | -68.3 | -20.5 | 179.9 | -60.6 | -82.9 | 0 | 0 | 0 | 112.7 | N200 R204 | N200-Y202 VanDerWaalsContact C-N 3.3Å; N200-Y202 PolarHBondContact O-N 3.3Å; N200-Y202 WeakPolarHBondContact OD1-CB 3.41Å; N200-Y202 PolarHBondContact OD1-N 3.19Å; Y202-R204 VanDerWaalsContact C-N 3.35Å |
| 203 | M | 73.9 | Confident | 85.9 | Confident | 21 Ų | 21 | 54.3 Ų | 54.3 | 10% | 0.103 | 25% | 0.25 | C | C | . | . | G | 310 helix | trans | -87.4 | 3 | 177 | -65.7 | -65.7 | -83.2 | 0 | 0 | 113.5 | N200 Y201 S205 N208 A480 L481 | N200-M203 HydrophobicContact CB-CB 4.06Å; N200-M203 HydrophobicContact CB-CG 3.91Å; N200-M203 PolarHBondContact O-N 2.73Å; Y201-M203 PolarHBondContact O-N 3.49Å; M203-S205 PolarHBondContact O-N 3.4Å; M203-N208 WeakPolarHBondContact O-CB 3.24Å; M203-N208 PolarHBondContact O-ND2 2.8Å; M203-A480 HydrophobicContact CE-CB 3.78Å; M203-A480 HydrophobicContact SD-CB 3.85Å; M203-L481 HydrophobicContact CE-CD2 4.2Å; M203-L481 HydrophobicContact CE-CG 3.75Å |
| 204 | R | 76.4 | Confident | 85.9 | Confident | 111 Ų | 111 | 54.6 Ų | 54.6 | 42% | 0.419 | 25% | 0.251 | S | S | . | . | trans | -81.7 | 55.8 | -178.4 | -65 | -179.7 | -179.1 | 169.9 | 2.4 | 113.3 | W198 Y201 Y202 Y209 | W198-R204 PolarHBondContact O-NE 2.86Å; W198-R204 PolarHBondContact O-NH2 3.04Å; Y201-R204 WeakPolarHBondContact O-CB 3.4Å; Y201-R204 PolarHBondContact O-N 3Å; Y202-R204 VanDerWaalsContact C-N 3.35Å; R204-Y209 HydrophobicContact CB-CE2 3.87Å; R204-Y209 HydrophobicContact CG-CE2 4.4Å | ||
| 205 | S | 82.8 | Confident | 86.1 | Confident | 46 Ų | 46 | 52.1 Ų | 52.1 | 32% | 0.322 | 24% | 0.239 | S | C | . | . | trans | -92.2 | 158.5 | 173.8 | 73.3 | 0 | 0 | 0 | 0 | 111.8 | M203 W207 N208 Y209 | M203-S205 PolarHBondContact O-N 3.4Å; S205-W207 PolarHBondContact O-N 3.19Å; S205-N208 PolarHBondContact O-N 3.23Å; S205-N208 VanDerWaalsContact O-N 3.17Å; S205-N208 WeakPolarHBondContact OG-CB 3.24Å; S205-N208 PolarHBondContact OG-N 2.94Å; S205-N208 VanDerWaalsContact OG-N 3.17Å; S205-N208 PolarHBondContact OG-ND2 2.9Å; S205-Y209 VanDerWaalsContact O-CD2 3.22Å; S205-Y209 WeakPolarHBondContact O-CD2 3.26Å; S205-Y209 PolarHBondContact O-N 3.24Å; S205-Y209 VanDerWaalsContact O-N 3.09Å | ||
| 206 | A | 84.8 | Confident | 86.3 | Confident | 18 Ų | 18 | 52.2 Ų | 52.2 | 15% | 0.149 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -55.1 | -43 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y209 L210 V291 | A206-Y209 PolarHBondContact O-N 2.96Å; A206-L210 PolarHBondContact O-N 3.32Å; A206-V291 HydrophobicContact CB-CG1 4.13Å; A206-V291 HydrophobicContact CB-CG2 3.71Å |
| 207 | W | 86.9 | Confident | 86.7 | Confident | 8 Ų | 8 | 53.1 Ų | 53.1 | 3% | 0.03 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -54.2 | -51.8 | 174.2 | -170.7 | -92.9 | 0 | 0 | 0 | 112.6 | S205 Y209 L210 L211 L266 R270 L415 L419 | S205-W207 PolarHBondContact O-N 3.19Å; W207-Y209 PolarHBondContact O-N 3.41Å; W207-L210 WeakPolarHBondContact O-CB 3.37Å; W207-L210 PolarHBondContact O-N 2.98Å; W207-L211 WeakPolarHBondContact O-CG 3.16Å; W207-L211 PolarHBondContact O-N 3.42Å; W207-L266 HydrophobicContact CD2-CD2 3.6Å; W207-L266 HydrophobicContact CE3-CB 4.44Å; W207-L266 HydrophobicContact CE3-CD2 3.34Å; W207-L266 HydrophobicContact CE3-CG 4.47Å; W207-L266 HydrophobicContact CG-CD2 4.32Å; W207-L266 HydrophobicContact CH2-CB 3.75Å; W207-L266 HydrophobicContact CH2-CD2 3.79Å; W207-L266 HydrophobicContact CH2-CG 4.26Å; W207-L266 HydrophobicContact CZ2-CD2 4.04Å; W207-L266 HydrophobicContact CZ3-CB 3.64Å; W207-L266 HydrophobicContact CZ3-CD2 3.41Å; W207-L266 VanDerWaalsContact CZ3-CD2 3.41Å; W207-L266 HydrophobicContact CZ3-CG 4.1Å; W207-L266 WeakPolarHBondContact CZ3-O 3.32Å; W207-R270 HydrophobicContact CH2-CG 3.52Å; W207-R270 HydrophobicContact CZ3-CG 3.55Å; W207-L415 HydrophobicContact CD2-CD2 4.36Å; W207-L415 HydrophobicContact CG-CD2 4.31Å; W207-L415 HydrophobicContact CZ2-CB 4.36Å; W207-L415 HydrophobicContact CZ2-CD2 4.48Å; W207-L419 HydrophobicContact CH2-CB 4.14Å; W207-L419 HydrophobicContact CH2-CD1 4.46Å; W207-L419 HydrophobicContact CH2-CD2 4.27Å; W207-L419 HydrophobicContact CZ2-CB 4.39Å |
| 208 | N | 89.7 | Confident | 87 | Confident | 17 Ų | 17 | 53 Ų | 53 | 9% | 0.091 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -72 | -29.8 | -174.8 | -67.2 | -11.9 | 0 | 0 | 0 | 112.6 | V197 M203 S205 L211 A212 | V197-N208 HydrophobicContact CG1-CB 4.14Å; V197-N208 HydrophobicContact CG2-CB 4.14Å; M203-N208 WeakPolarHBondContact O-CB 3.24Å; M203-N208 PolarHBondContact O-ND2 2.8Å; S205-N208 PolarHBondContact O-N 3.23Å; S205-N208 VanDerWaalsContact O-N 3.17Å; S205-N208 WeakPolarHBondContact OG-CB 3.24Å; S205-N208 PolarHBondContact OG-N 2.94Å; S205-N208 VanDerWaalsContact OG-N 3.17Å; S205-N208 PolarHBondContact OG-ND2 2.9Å; N208-L211 PolarHBondContact O-N 3.37Å; N208-A212 WeakPolarHBondContact O-CB 3.41Å; N208-A212 PolarHBondContact O-N 2.96Å |
| 209 | Y | 90.3 | Very high | 87.6 | Confident | 44 Ų | 44 | 46.3 Ų | 46.3 | 17% | 0.173 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -66.5 | -38.1 | 170.7 | -80 | -67.2 | 0 | 0 | 0 | 112.3 | V197 R204 S205 A206 W207 A212 S213 V291 | V197-Y209 HydrophobicContact CG1-CD1 4.46Å; R204-Y209 HydrophobicContact CB-CE2 3.87Å; R204-Y209 HydrophobicContact CG-CE2 4.4Å; S205-Y209 VanDerWaalsContact O-CD2 3.22Å; S205-Y209 WeakPolarHBondContact O-CD2 3.26Å; S205-Y209 PolarHBondContact O-N 3.24Å; S205-Y209 VanDerWaalsContact O-N 3.09Å; A206-Y209 PolarHBondContact O-N 2.96Å; W207-Y209 PolarHBondContact O-N 3.41Å; Y209-A212 PolarHBondContact O-N 3.47Å; Y209-S213 PolarHBondContact O-N 2.89Å; Y209-V291 HydrophobicContact CD2-CG1 3.86Å; Y209-V291 HydrophobicContact CG-CG1 4.14Å |
| 210 | L | 92.3 | Very high | 88.2 | Confident | 8 Ų | 8 | 44.1 Ų | 44.1 | 4% | 0.042 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64.3 | -44.6 | 172.9 | -72 | 174.5 | 0 | 0 | 0 | 111.3 | A206 W207 A212 S213 I214 T262 A265 L266 | A206-L210 PolarHBondContact O-N 3.32Å; W207-L210 WeakPolarHBondContact O-CB 3.37Å; W207-L210 PolarHBondContact O-N 2.98Å; L210-A212 PolarHBondContact O-N 2.96Å; L210-S213 PolarHBondContact O-N 3.44Å; L210-S213 VanDerWaalsContact O-N 3.12Å; L210-S213 PolarHBondContact O-OG 2.89Å; L210-I214 PolarHBondContact O-N 3.09Å; L210-I214 VanDerWaalsContact O-N 3.13Å; L210-T262 HydrophobicContact CB-CG2 3.82Å; L210-T262 HydrophobicContact CD2-CG2 4.23Å; L210-T262 HydrophobicContact CG-CG2 4.48Å; L210-A265 HydrophobicContact CD1-CB 4.14Å; L210-L266 HydrophobicContact CB-CD2 3.91Å; L210-L266 HydrophobicContact CB-CG 4.48Å; L210-L266 HydrophobicContact CD1-CD2 3.85Å; L210-L266 HydrophobicContact CD1-CG 4.29Å |
| 211 | L | 92.9 | Very high | 88.9 | Confident | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.1 | -42.9 | 173.6 | -65.9 | -176 | 0 | 0 | 0 | 113 | W207 N208 S213 I214 A215 L266 L422 L474 L481 | W207-L211 WeakPolarHBondContact O-CG 3.16Å; W207-L211 PolarHBondContact O-N 3.42Å; N208-L211 PolarHBondContact O-N 3.37Å; L211-S213 VanDerWaalsContact C-N 3.26Å; L211-S213 PolarHBondContact O-N 2.95Å; L211-I214 PolarHBondContact O-N 3.28Å; L211-A215 PolarHBondContact O-N 3Å; L211-A215 VanDerWaalsContact O-N 3.14Å; L211-L266 HydrophobicContact CD2-CD1 4.16Å; L211-L422 HydrophobicContact CD2-CD1 3.94Å; L211-L474 HydrophobicContact CB-CD1 4.17Å; L211-L474 HydrophobicContact CD1-CD2 3.97Å; L211-L474 HydrophobicContact CD2-CD1 4.16Å; L211-L474 HydrophobicContact CD2-CD2 3.84Å; L211-L474 HydrophobicContact CG-CD2 4.45Å; L211-L481 HydrophobicContact CD1-CD1 4.34Å |
| 212 | A | 93.4 | Very high | 90 | Very high | 16 Ų | 16 | 33.4 Ų | 33.4 | 13% | 0.132 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -65.9 | -28.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | V197 N208 Y209 L210 A215 F216 | V197-A212 HydrophobicContact CB-CB 4.07Å; V197-A212 HydrophobicContact CG1-CB 3.99Å; V197-A212 HydrophobicContact CG2-CB 4.23Å; N208-A212 WeakPolarHBondContact O-CB 3.41Å; N208-A212 PolarHBondContact O-N 2.96Å; Y209-A212 PolarHBondContact O-N 3.47Å; L210-A212 PolarHBondContact O-N 2.96Å; A212-A215 PolarHBondContact O-N 2.96Å; A212-F216 PolarHBondContact O-N 3.19Å |
| 213 | S | 94.1 | Very high | 91.3 | Very high | 3 Ų | 3 | 26.4 Ų | 26.4 | 2% | 0.021 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -71.8 | -35 | 174.4 | 75.3 | 0 | 0 | 0 | 0 | 112.8 | Y209 L210 L211 F216 W217 | Y209-S213 PolarHBondContact O-N 2.89Å; L210-S213 PolarHBondContact O-N 3.44Å; L210-S213 VanDerWaalsContact O-N 3.12Å; L210-S213 PolarHBondContact O-OG 2.89Å; L211-S213 VanDerWaalsContact C-N 3.26Å; L211-S213 PolarHBondContact O-N 2.95Å; S213-F216 PolarHBondContact O-N 3.44Å; S213-W217 VanDerWaalsContact O-CD1 3.31Å; S213-W217 PolarHBondContact O-N 3.49Å |
| 214 | I | 94.9 | Very high | 92.2 | Very high | 5 Ų | 5 | 28 Ų | 28 | 3% | 0.026 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -60.4 | -51.2 | 168.6 | -68.7 | 167.9 | 0 | 0 | 0 | 109.5 | L210 L211 F216 W217 D218 T259 T262 T470 | L210-I214 PolarHBondContact O-N 3.09Å; L210-I214 VanDerWaalsContact O-N 3.13Å; L211-I214 PolarHBondContact O-N 3.28Å; I214-F216 VanDerWaalsContact C-N 3.25Å; I214-F216 PolarHBondContact O-N 3.37Å; I214-W217 PolarHBondContact O-N 2.96Å; I214-W217 VanDerWaalsContact O-N 3.11Å; I214-D218 WeakPolarHBondContact CG2-OD2 3.5Å; I214-D218 WeakPolarHBondContact O-CB 3.44Å; I214-D218 PolarHBondContact O-N 3.26Å; I214-T259 HydrophobicContact CG1-CG2 4.35Å; I214-T259 HydrophobicContact CG2-CG2 3.97Å; I214-T262 HydrophobicContact CD1-CG2 3.6Å; I214-T262 HydrophobicContact CG1-CG2 3.81Å; I214-T470 HydrophobicContact CG2-CG2 3.72Å |
| 215 | A | 96.1 | Very high | 93.1 | Very high | 1 Ų | 1 | 22.7 Ų | 22.7 | 1% | 0.008 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.2 | -33.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | N190 V193 M194 L211 A212 F219 | N190-A215 HydrophobicContact CB-CB 4.26Å; N190-A215 WeakPolarHBondContact CB-O 3.36Å; N190-A215 WeakPolarHBondContact OD1-CA 3.44Å; N190-A215 WeakPolarHBondContact OD1-CB 3.12Å; N190-A215 PolarHBondContact OD1-O 2.79Å; V193-A215 HydrophobicContact CB-CB 4.04Å; V193-A215 HydrophobicContact CG1-CB 3.85Å; M194-A215 HydrophobicContact CG-CB 4.1Å; L211-A215 PolarHBondContact O-N 3Å; L211-A215 VanDerWaalsContact O-N 3.14Å; A212-A215 PolarHBondContact O-N 2.96Å; A215-F219 WeakPolarHBondContact O-CB 3.31Å; A215-F219 PolarHBondContact O-N 3.32Å |
| 216 | F | 96.1 | Very high | 93.6 | Very high | 70 Ų | 70 | 20.8 Ų | 20.8 | 31% | 0.307 | 11% | 0.109 | S | C | . | . | H | α-helix | trans | -65.8 | -43.6 | 174.6 | 173.3 | -108.3 | 0 | 0 | 0 | 113 | M194 A212 S213 I214 L220 W299 | M194-F216 HydrophobicContact CE-CB 4.26Å; M194-F216 HydrophobicContact CE-CD2 3.79Å; M194-F216 HydrophobicContact CE-CG 4.49Å; M194-F216 HydrophobicContact SD-CB 4.06Å; M194-F216 HydrophobicContact SD-CD2 4.35Å; A212-F216 PolarHBondContact O-N 3.19Å; S213-F216 PolarHBondContact O-N 3.44Å; I214-F216 VanDerWaalsContact C-N 3.25Å; I214-F216 PolarHBondContact O-N 3.37Å; F216-L220 WeakPolarHBondContact O-CB 3.3Å; F216-L220 PolarHBondContact O-N 3.4Å; F216-W299 HydrophobicContact CD1-CH2 4.17Å; F216-W299 HydrophobicContact CD1-CZ2 4.19Å; F216-W299 HydrophobicContact CE1-CH2 4.28Å |
| 217 | W | 96.4 | Very high | 93.9 | Very high | 23 Ų | 23 | 22 Ų | 22 | 9% | 0.087 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -77.4 | -34.4 | 179.7 | -76.4 | 93.7 | 0 | 0 | 0 | 112.6 | S213 I214 L220 V221 M251 I258 W299 L303 | S213-W217 VanDerWaalsContact O-CD1 3.31Å; S213-W217 PolarHBondContact O-N 3.49Å; I214-W217 PolarHBondContact O-N 2.96Å; I214-W217 VanDerWaalsContact O-N 3.11Å; W217-L220 HydrophobicContact CE3-CD2 4.17Å; W217-L220 HydrophobicContact CZ3-CD2 4.07Å; W217-L220 PolarHBondContact O-N 2.98Å; W217-V221 WeakPolarHBondContact O-CG2 3.44Å; W217-V221 PolarHBondContact O-N 2.88Å; W217-M251 HydrophobicContact CE3-CE 4.11Å; W217-M251 HydrophobicContact CZ3-CE 3.72Å; W217-M251 HydrophobicContact CZ3-SD 4.17Å; W217-I258 HydrophobicContact CB-CG2 4.34Å; W217-I258 HydrophobicContact CD2-CD1 4Å; W217-I258 HydrophobicContact CD2-CG1 4.13Å; W217-I258 HydrophobicContact CG-CB 4.45Å; W217-I258 HydrophobicContact CG-CD1 4.16Å; W217-I258 HydrophobicContact CG-CG1 4.14Å; W217-I258 HydrophobicContact CG-CG2 4.08Å; W217-I258 HydrophobicContact CZ2-CD1 4.17Å; W217-W299 AromaticContact NE1-CD2 3.93Å; W217-W299 AromaticContact NE1-CE2 3.55Å; W217-W299 AromaticContact NE1-CZ2 3.83Å; W217-W299 AromaticContact NE1-NE1 3.67Å; W217-L303 HydrophobicContact CH2-CD1 4.15Å; W217-L303 HydrophobicContact CH2-CD2 3.64Å; W217-L303 HydrophobicContact CH2-CG 4.41Å; W217-L303 HydrophobicContact CZ2-CD1 4.16Å; W217-L303 HydrophobicContact CZ2-CD2 4.3Å; W217-L303 HydrophobicContact CZ3-CD2 4.11Å |
| 218 | D | 96.5 | Very high | 94 | Very high | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -64.9 | -40.8 | 170.6 | -79 | -19.8 | 0 | 0 | 0 | 111.7 | I214 L222 K466 C467 | I214-D218 WeakPolarHBondContact CG2-OD2 3.5Å; I214-D218 WeakPolarHBondContact O-CB 3.44Å; I214-D218 PolarHBondContact O-N 3.26Å; D218-L222 WeakPolarHBondContact O-CB 3.31Å; D218-L222 WeakPolarHBondContact O-CD1 3.48Å; D218-L222 VanDerWaalsContact O-CG 3.24Å; D218-L222 WeakPolarHBondContact O-CG 3.37Å; D218-L222 PolarHBondContact O-N 3.19Å; D218-K466 IonicContact OD1-NZ 3.67Å; D218-K466 PolarHBondContact OD1-NZ 3.4Å; D218-K466 IonicContact OD2-NZ 3.16Å; D218-C467 HydrophobicContact CB-CB 3.86Å; D218-C467 PolarHBondContact OD1-SG 3.43Å |
| 219 | F | 97.1 | Very high | 94 | Very high | 49 Ų | 49 | 23 Ų | 23 | 22% | 0.215 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -59.6 | -45.2 | 170.3 | 169.9 | -94 | 0 | 0 | 0 | 112.2 | V187 N190 M191 A215 L222 V223 | V187-F219 HydrophobicContact CG1-CD2 4.49Å; V187-F219 HydrophobicContact CG1-CE2 4.13Å; V187-F219 HydrophobicContact CG2-CD2 4.43Å; V187-F219 HydrophobicContact CG2-CE2 4.49Å; N190-F219 HydrophobicContact CB-CB 3.88Å; M191-F219 HydrophobicContact CG-CD2 3.89Å; M191-F219 HydrophobicContact CG-CE2 3.71Å; M191-F219 HydrophobicContact SD-CD2 4.03Å; M191-F219 HydrophobicContact SD-CE2 3.68Å; M191-F219 HydrophobicContact SD-CZ 4.07Å; A215-F219 WeakPolarHBondContact O-CB 3.31Å; A215-F219 PolarHBondContact O-N 3.32Å; F219-L222 PolarHBondContact O-N 2.8Å; F219-V223 HydrophobicContact CD2-CG2 4.03Å; F219-V223 HydrophobicContact CE1-CG2 4.19Å; F219-V223 HydrophobicContact CE2-CG2 3.67Å; F219-V223 HydrophobicContact CG-CG2 4.44Å; F219-V223 HydrophobicContact CZ-CG2 3.76Å; F219-V223 WeakPolarHBondContact O-CG2 3.42Å; F219-V223 PolarHBondContact O-N 3.27Å |
| 220 | L | 96 | Very high | 93.8 | Very high | 48 Ų | 48 | 21.6 Ų | 21.6 | 25% | 0.251 | 12% | 0.12 | S | C | . | . | H | α-helix | trans | -66.5 | -40.2 | -176.6 | -173.2 | 57.4 | 0 | 0 | 0 | 112.1 | F216 W217 V224 M251 | F216-L220 WeakPolarHBondContact O-CB 3.3Å; F216-L220 PolarHBondContact O-N 3.4Å; W217-L220 HydrophobicContact CE3-CD2 4.17Å; W217-L220 HydrophobicContact CZ3-CD2 4.07Å; W217-L220 PolarHBondContact O-N 2.98Å; L220-V224 HydrophobicContact CD1-CG2 3.86Å; L220-V224 WeakPolarHBondContact O-CB 3.41Å; L220-V224 WeakPolarHBondContact O-CG2 3.4Å; L220-V224 PolarHBondContact O-N 3.28Å; L220-M251 HydrophobicContact CD2-CE 3.6Å; L220-M251 HydrophobicContact CG-CE 3.66Å |
| 221 | V | 95.8 | Very high | 93.5 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -63.9 | -43.1 | 171.8 | 168.1 | 0 | 0 | 0 | 0 | 111.6 | W217 C225 L226 L463 F464 | W217-V221 WeakPolarHBondContact O-CG2 3.44Å; W217-V221 PolarHBondContact O-N 2.88Å; V221-C225 HydrophobicContact CG1-CB 4.17Å; V221-C225 WeakPolarHBondContact O-CA 3.38Å; V221-C225 VanDerWaalsContact O-CB 3.29Å; V221-C225 WeakPolarHBondContact O-CB 3.33Å; V221-C225 PolarHBondContact O-N 3.37Å; V221-L226 PolarHBondContact O-N 2.91Å; V221-L463 HydrophobicContact CG1-CD2 3.73Å; V221-F464 HydrophobicContact CG1-CD1 3.98Å; V221-F464 HydrophobicContact CG1-CE1 3.81Å |
| 222 | L | 96.5 | Very high | 92.9 | Very high | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -66 | -38.2 | 178.2 | -73.4 | 167.6 | 0 | 0 | 0 | 112.9 | V182 L183 D218 F219 L226 P227 F464 C467 | V182-L222 HydrophobicContact CG1-CD2 4.03Å; L183-L222 HydrophobicContact CD1-CB 4.35Å; L183-L222 WeakPolarHBondContact CD1-O 3.33Å; D218-L222 WeakPolarHBondContact O-CB 3.31Å; D218-L222 WeakPolarHBondContact O-CD1 3.48Å; D218-L222 VanDerWaalsContact O-CG 3.24Å; D218-L222 WeakPolarHBondContact O-CG 3.37Å; D218-L222 PolarHBondContact O-N 3.19Å; F219-L222 PolarHBondContact O-N 2.8Å; L222-L226 HydrophobicContact CD2-CD1 3.76Å; L222-L226 WeakPolarHBondContact O-CB 3.37Å; L222-P227 WeakPolarHBondContact O-CD 3.34Å; L222-F464 HydrophobicContact CD2-CB 4.23Å; L222-C467 HydrophobicContact CD1-CB 3.87Å; L222-C467 HydrophobicContact CD2-CB 4.05Å; L222-C467 HydrophobicContact CG-CB 3.74Å |
| 223 | V | 95.6 | Very high | 92.3 | Very high | 67 Ų | 67 | 28.9 Ų | 28.9 | 41% | 0.406 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -81 | -29.4 | -178.4 | 174.3 | 0 | 0 | 0 | 0 | 112.7 | V187 F219 | V187-V223 HydrophobicContact CG2-CG2 3.8Å; F219-V223 HydrophobicContact CD2-CG2 4.03Å; F219-V223 HydrophobicContact CE1-CG2 4.19Å; F219-V223 HydrophobicContact CE2-CG2 3.67Å; F219-V223 HydrophobicContact CG-CG2 4.44Å; F219-V223 HydrophobicContact CZ-CG2 3.76Å; F219-V223 WeakPolarHBondContact O-CG2 3.42Å; F219-V223 PolarHBondContact O-N 3.27Å |
| 224 | V | 92.6 | Very high | 91.5 | Very high | 54 Ų | 54 | 30.8 Ų | 30.8 | 33% | 0.327 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -102.6 | -52.9 | -176.2 | -178.5 | 0 | 0 | 0 | 0 | 112.7 | L220 V228 | L220-V224 HydrophobicContact CD1-CG2 3.86Å; L220-V224 WeakPolarHBondContact O-CB 3.41Å; L220-V224 WeakPolarHBondContact O-CG2 3.4Å; L220-V224 PolarHBondContact O-N 3.28Å; V224-V228 VanDerWaalsContact O-CG2 3.28Å; V224-V228 WeakPolarHBondContact O-CG2 3.42Å |
| 225 | C | 93.8 | Very high | 90.4 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -77.1 | -48 | -172.6 | -57.9 | 0 | 0 | 0 | 0 | 112.1 | V221 V228 V229 V248 F464 | V221-C225 HydrophobicContact CG1-CB 4.17Å; V221-C225 WeakPolarHBondContact O-CA 3.38Å; V221-C225 VanDerWaalsContact O-CB 3.29Å; V221-C225 WeakPolarHBondContact O-CB 3.33Å; V221-C225 PolarHBondContact O-N 3.37Å; C225-V228 PolarHBondContact O-N 3.18Å; C225-V228 VanDerWaalsContact O-N 3.11Å; C225-V229 WeakPolarHBondContact O-CG2 3.39Å; C225-V229 PolarHBondContact O-N 3Å; C225-V248 HydrophobicContact CB-CG1 4.2Å; C225-F464 HydrophobicContact CB-CE1 3.94Å; C225-F464 HydrophobicContact CB-CZ 4.21Å |
| 226 | L | 93.3 | Very high | 89 | Confident | 5 Ų | 5 | 38.2 Ų | 38.2 | 3% | 0.026 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -56.9 | -47.2 | -174.8 | 177.5 | 166.8 | 0 | 0 | 0 | 113.3 | A179 V182 L183 V221 L222 V228 V229 A230 F464 | A179-L226 HydrophobicContact CB-CD2 4.01Å; A179-L226 HydrophobicContact CB-CG 4.46Å; V182-L226 HydrophobicContact CB-CD1 4.4Å; V182-L226 HydrophobicContact CG1-CD1 3.98Å; L183-L226 HydrophobicContact CB-CD1 4.05Å; L183-L226 HydrophobicContact CB-CD2 4.03Å; L183-L226 HydrophobicContact CD1-CD2 4.45Å; L183-L226 HydrophobicContact CD2-CD2 4.3Å; V221-L226 PolarHBondContact O-N 2.91Å; L222-L226 HydrophobicContact CD2-CD1 3.76Å; L222-L226 WeakPolarHBondContact O-CB 3.37Å; L226-V228 VanDerWaalsContact C-N 3.35Å; L226-V228 PolarHBondContact O-N 3.22Å; L226-V229 PolarHBondContact O-N 3.27Å; L226-A230 VanDerWaalsContact O-CB 3.26Å; L226-A230 WeakPolarHBondContact O-CB 3.48Å; L226-A230 PolarHBondContact O-N 3.42Å; L226-F464 HydrophobicContact CB-CD1 3.92Å; L226-F464 HydrophobicContact CB-CD2 4.11Å; L226-F464 HydrophobicContact CB-CE1 3.86Å; L226-F464 HydrophobicContact CB-CE2 4.04Å; L226-F464 HydrophobicContact CB-CG 4.07Å; L226-F464 HydrophobicContact CB-CZ 3.94Å; L226-F464 HydrophobicContact CD1-CB 4.06Å; L226-F464 HydrophobicContact CD1-CD1 4.45Å; L226-F464 HydrophobicContact CD1-CD2 4.21Å; L226-F464 HydrophobicContact CD1-CG 3.98Å; L226-F464 HydrophobicContact CG-CD2 4.05Å; L226-F464 HydrophobicContact CG-CE2 4.29Å; L226-F464 HydrophobicContact CG-CG 4.21Å |
| 227 | P | 91.4 | Very high | 87.5 | Confident | 43 Ų | 43 | 41 Ų | 41 | 28% | 0.279 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -64.9 | -37.6 | 176.7 | -23.3 | 35.6 | 0 | 0 | 0 | 112.7 | L222 L231 | L222-P227 WeakPolarHBondContact O-CD 3.34Å; P227-L231 VanDerWaalsContact O-CB 3.27Å; P227-L231 WeakPolarHBondContact O-CB 3.48Å; P227-L231 WeakPolarHBondContact O-CD1 3.26Å; P227-L231 WeakPolarHBondContact O-CG 3.44Å; P227-L231 PolarHBondContact O-N 3.21Å |
| 228 | V | 89.6 | Confident | 86.3 | Confident | 24 Ų | 24 | 42.9 Ų | 42.9 | 15% | 0.145 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67.3 | -45 | 178.3 | 170.3 | 0 | 0 | 0 | 0 | 111.2 | V224 C225 L226 L231 N232 T244 V248 | V224-V228 VanDerWaalsContact O-CG2 3.28Å; V224-V228 WeakPolarHBondContact O-CG2 3.42Å; C225-V228 PolarHBondContact O-N 3.18Å; C225-V228 VanDerWaalsContact O-N 3.11Å; L226-V228 VanDerWaalsContact C-N 3.35Å; L226-V228 PolarHBondContact O-N 3.22Å; V228-L231 PolarHBondContact O-N 3.12Å; V228-N232 WeakPolarHBondContact CG1-ND2 3.26Å; V228-N232 VanDerWaalsContact O-CB 3.26Å; V228-N232 WeakPolarHBondContact O-CB 3.24Å; V228-N232 PolarHBondContact O-N 2.89Å; V228-N232 PolarHBondContact O-ND2 2.89Å; V228-N232 VanDerWaalsContact O-ND2 3.14Å; V228-T244 HydrophobicContact CG1-CG2 3.6Å; V228-T244 HydrophobicContact CG2-CG2 4.18Å; V228-V248 HydrophobicContact CB-CG2 4.25Å; V228-V248 HydrophobicContact CG1-CG2 3.75Å |
| 229 | V | 88.8 | Confident | 84.7 | Confident | 24 Ų | 24 | 47.9 Ų | 47.9 | 15% | 0.145 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -64 | -47.1 | 176.7 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | C225 L226 L231 N232 H233 V248 H460 F464 | C225-V229 WeakPolarHBondContact O-CG2 3.39Å; C225-V229 PolarHBondContact O-N 3Å; L226-V229 PolarHBondContact O-N 3.27Å; V229-L231 PolarHBondContact O-N 2.67Å; V229-N232 PolarHBondContact O-N 3.1Å; V229-H233 WeakPolarHBondContact O-CB 3.24Å; V229-H233 PolarHBondContact O-N 3.44Å; V229-V248 HydrophobicContact CG2-CG1 3.74Å; V229-H460 HydrophobicContact CG1-CB 4.15Å; V229-F464 HydrophobicContact CB-CE2 4.17Å; V229-F464 HydrophobicContact CB-CZ 4.17Å; V229-F464 HydrophobicContact CG1-CE2 4.15Å; V229-F464 HydrophobicContact CG2-CE2 4.48Å; V229-F464 HydrophobicContact CG2-CZ 4.04Å |
| 230 | A | 87.8 | Confident | 83.5 | Confident | 13 Ų | 13 | 50.5 Ų | 50.5 | 11% | 0.107 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -60.5 | -44.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A179 L226 H233 L234 | A179-A230 HydrophobicContact CB-CB 4.4Å; L226-A230 VanDerWaalsContact O-CB 3.26Å; L226-A230 WeakPolarHBondContact O-CB 3.48Å; L226-A230 PolarHBondContact O-N 3.42Å; A230-H233 PolarHBondContact O-N 2.79Å; A230-L234 WeakPolarHBondContact O-CD1 3.33Å; A230-L234 VanDerWaalsContact O-CG 3.23Å; A230-L234 WeakPolarHBondContact O-CG 3.26Å; A230-L234 PolarHBondContact O-N 2.94Å |
| 231 | L | 84.7 | Confident | 82.8 | Confident | 67 Ų | 67 | 49.1 Ų | 49.1 | 35% | 0.351 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -66.1 | -45.7 | 176.8 | -73.4 | 168.4 | 0 | 0 | 0 | 112 | F162 P227 V228 V229 H233 L234 S235 I239 | F162-L231 HydrophobicContact CE1-CD2 4.27Å; P227-L231 VanDerWaalsContact O-CB 3.27Å; P227-L231 WeakPolarHBondContact O-CB 3.48Å; P227-L231 WeakPolarHBondContact O-CD1 3.26Å; P227-L231 WeakPolarHBondContact O-CG 3.44Å; P227-L231 PolarHBondContact O-N 3.21Å; V228-L231 PolarHBondContact O-N 3.12Å; V229-L231 PolarHBondContact O-N 2.67Å; L231-H233 PolarHBondContact O-N 3.47Å; L231-L234 PolarHBondContact O-N 3.39Å; L231-S235 WeakPolarHBondContact O-CB 3.43Å; L231-S235 PolarHBondContact O-N 3.08Å; L231-S235 PolarHBondContact O-OG 2.93Å; L231-I239 HydrophobicContact CB-CD1 3.88Å; L231-I239 HydrophobicContact CD1-CD1 3.99Å; L231-I239 HydrophobicContact CD2-CD1 4.48Å; L231-I239 HydrophobicContact CG-CD1 4.34Å |
| 232 | N | 81.4 | Confident | 82.2 | Confident | 25 Ų | 25 | 52 Ų | 52 | 13% | 0.134 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -59.8 | -35.1 | 178.2 | -71.4 | -23.1 | 0 | 0 | 0 | 112.6 | V228 V229 R238 | V228-N232 WeakPolarHBondContact CG1-ND2 3.26Å; V228-N232 VanDerWaalsContact O-CB 3.26Å; V228-N232 WeakPolarHBondContact O-CB 3.24Å; V228-N232 PolarHBondContact O-N 2.89Å; V228-N232 PolarHBondContact O-ND2 2.89Å; V228-N232 VanDerWaalsContact O-ND2 3.14Å; V229-N232 PolarHBondContact O-N 3.1Å; N232-R238 WeakPolarHBondContact OD1-CA 3.24Å |
| 233 | H | 79.3 | Confident | 81.7 | Confident | 85 Ų | 85 | 57.6 Ų | 57.6 | 39% | 0.394 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -72.4 | -29.7 | 176.1 | -171.7 | 76.6 | 0 | 0 | 0 | 112.8 | V229 A230 L231 | V229-H233 WeakPolarHBondContact O-CB 3.24Å; V229-H233 PolarHBondContact O-N 3.44Å; A230-H233 PolarHBondContact O-N 2.79Å; L231-H233 PolarHBondContact O-N 3.47Å |
| 234 | L | 78 | Confident | 81.3 | Confident | 44 Ų | 44 | 54.9 Ų | 54.9 | 23% | 0.23 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -88.6 | -31.8 | -179 | -69.8 | 169.4 | 0 | 0 | 0 | 114 | A172 L176 A230 L231 | A172-L234 HydrophobicContact CB-CD2 3.5Å; L176-L234 HydrophobicContact CD1-CD1 4.24Å; A230-L234 WeakPolarHBondContact O-CD1 3.33Å; A230-L234 VanDerWaalsContact O-CG 3.23Å; A230-L234 WeakPolarHBondContact O-CG 3.26Å; A230-L234 PolarHBondContact O-N 2.94Å; L231-L234 PolarHBondContact O-N 3.39Å |
| 235 | S | 71.9 | Confident | 81 | Confident | 31 Ų | 31 | 52.4 Ų | 52.4 | 22% | 0.217 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -91.2 | -18.9 | -173.4 | 65.8 | 0 | 0 | 0 | 0 | 114.5 | L231 R237 | L231-S235 WeakPolarHBondContact O-CB 3.43Å; L231-S235 PolarHBondContact O-N 3.08Å; L231-S235 PolarHBondContact O-OG 2.93Å; S235-R237 PolarHBondContact O-N 3.48Å; S235-R237 PolarHBondContact OG-N 3.36Å; S235-R237 PolarHBondContact OG-O 2.93Å |
| 236 | H | 66.7 | Low | 80.9 | Confident | 131 Ų | 131 | 53.5 Ų | 53.5 | 61% | 0.606 | 27% | 0.272 | S | S | * | . | S | Bend | trans | 50.7 | 18.3 | -163.4 | -59.6 | -78.9 | 0 | 0 | 0 | 114.4 | ||
| 237 | R | 64.8 | Low | 80.7 | Confident | 128 Ų | 128 | 56.6 Ų | 56.6 | 48% | 0.483 | 29% | 0.289 | S | S | . | . | S | Bend | trans | -143.2 | 118.9 | -174.6 | -76.1 | -62.5 | -159.9 | 177.6 | 1.1 | 110.4 | S235 I239 D328 | S235-R237 PolarHBondContact O-N 3.48Å; S235-R237 PolarHBondContact OG-N 3.36Å; S235-R237 PolarHBondContact OG-O 2.93Å; R237-I239 PolarHBondContact O-N 2.99Å; R237-I239 VanDerWaalsContact O-N 3.11Å; R237-D328 WeakPolarHBondContact CD-OD2 3.39Å; R237-D328 IonicContact CZ-OD2 3.72Å; R237-D328 IonicContact NE-OD2 2.98Å; R237-D328 IonicContact NH1-OD1 3.58Å; R237-D328 IonicContact NH1-OD2 2.82Å; R237-D328 PolarHBondContact NH1-OD2 2.85Å |
| 238 | R | 71.1 | Confident | 80.7 | Confident | 62 Ų | 62 | 55.1 Ų | 55.1 | 23% | 0.234 | 28% | 0.279 | C | S | . | . | trans | -75.5 | 102.3 | -177.1 | -75.1 | -173.4 | 154.1 | 83 | -2 | 111.5 | N232 L240 G241 D328 C330 | N232-R238 WeakPolarHBondContact OD1-CA 3.24Å; R238-L240 PolarHBondContact O-N 3.25Å; R238-G241 PolarHBondContact O-N 3.44Å; R238-D328 HydrophobicContact CB-CB 4.48Å; R238-D328 WeakPolarHBondContact CD-O 3.45Å; R238-D328 PolarHBondContact NH1-O 3.38Å; R238-C330 PolarHBondContact NE-SG 3.4Å | ||
| 239 | I | 63.4 | Low | 80.7 | Confident | 105 Ų | 105 | 54.7 Ų | 54.7 | 54% | 0.538 | 28% | 0.277 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.3 | -28 | -172.8 | -56.5 | 172.4 | 0 | 0 | 0 | 113.2 | L231 R237 | L231-I239 HydrophobicContact CB-CD1 3.88Å; L231-I239 HydrophobicContact CD1-CD1 3.99Å; L231-I239 HydrophobicContact CD2-CD1 4.48Å; L231-I239 HydrophobicContact CG-CD1 4.34Å; R237-I239 PolarHBondContact O-N 2.99Å; R237-I239 VanDerWaalsContact O-N 3.11Å |
| 240 | L | 70.8 | Confident | 80.9 | Confident | 105 Ų | 105 | 55.2 Ų | 55.2 | 55% | 0.55 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -120.3 | 14.2 | -179.2 | -75.9 | 142.6 | 0 | 0 | 0 | 112.8 | R238 I243 T244 | R238-L240 PolarHBondContact O-N 3.25Å; L240-I243 PolarHBondContact O-N 2.89Å; L240-T244 HydrophobicContact CB-CG2 3.49Å; L240-T244 VanDerWaalsContact CB-CG2 3.49Å; L240-T244 WeakPolarHBondContact CB-OG1 3.17Å; L240-T244 HydrophobicContact CD1-CG2 3.81Å; L240-T244 HydrophobicContact CG-CG2 4.28Å |
| 241 | G | 81.6 | Confident | 81.2 | Confident | 19 Ų | 19 | 55.5 Ų | 55.5 | 20% | 0.196 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | 49.8 | -134.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | R238 I243 T244 C245 | R238-G241 PolarHBondContact O-N 3.44Å; G241-I243 VanDerWaalsContact C-N 3.3Å; G241-I243 PolarHBondContact O-N 3.19Å; G241-T244 PolarHBondContact O-N 3.44Å; G241-T244 PolarHBondContact O-OG1 2.8Å; G241-C245 PolarHBondContact O-N 3.14Å; G241-C245 VanDerWaalsContact O-N 3.15Å |
| 242 | D | 82.4 | Confident | 81.6 | Confident | 59 Ų | 59 | 52.8 Ų | 52.8 | 32% | 0.316 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -62.1 | -30.5 | -174.9 | -176 | 77.9 | 0 | 0 | 0 | 113.6 | T244 C245 R246 L315 | D242-T244 PolarHBondContact O-N 3.27Å; D242-C245 WeakPolarHBondContact O-CA 3.43Å; D242-C245 VanDerWaalsContact O-CB 3.26Å; D242-C245 WeakPolarHBondContact O-CB 3.22Å; D242-C245 PolarHBondContact O-N 2.94Å; D242-C245 VanDerWaalsContact O-N 3.1Å; D242-R246 PolarHBondContact O-N 3.36Å; D242-R246 IonicContact OD1-CZ 3.92Å; D242-R246 IonicContact OD1-NE 3.45Å; D242-R246 PolarHBondContact OD1-NE 2.99Å; D242-R246 IonicContact OD1-NH2 3.12Å; D242-R246 PolarHBondContact OD1-NH2 3.13Å; D242-R246 IonicContact OD2-CZ 3.75Å; D242-R246 IonicContact OD2-NE 3.87Å; D242-R246 PolarHBondContact OD2-NE 3.47Å; D242-R246 IonicContact OD2-NH2 3.07Å; D242-R246 PolarHBondContact OD2-NH2 3.4Å; D242-L315 HydrophobicContact CB-CB 4.01Å; D242-L315 PolarHBondContact OD1-N 3.34Å |
| 243 | I | 86.3 | Confident | 82.1 | Confident | 118 Ų | 118 | 53 Ų | 53 | 61% | 0.605 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -61.3 | -51 | 178.2 | -59.3 | 177 | 0 | 0 | 0 | 110.1 | L240 G241 C245 R246 L247 | L240-I243 PolarHBondContact O-N 2.89Å; G241-I243 VanDerWaalsContact C-N 3.3Å; G241-I243 PolarHBondContact O-N 3.19Å; I243-C245 VanDerWaalsContact C-N 3.27Å; I243-C245 PolarHBondContact O-N 3.29Å; I243-R246 PolarHBondContact O-N 2.89Å; I243-L247 WeakPolarHBondContact O-CB 3.45Å; I243-L247 PolarHBondContact O-N 3.49Å |
| 244 | T | 87.3 | Confident | 82.9 | Confident | 10 Ų | 10 | 49 Ų | 49 | 6% | 0.061 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.1 | -29 | 174.5 | 34.7 | 0 | 0 | 0 | 0 | 113.1 | V228 L240 G241 D242 R246 V248 | V228-T244 HydrophobicContact CG1-CG2 3.6Å; V228-T244 HydrophobicContact CG2-CG2 4.18Å; L240-T244 HydrophobicContact CB-CG2 3.49Å; L240-T244 VanDerWaalsContact CB-CG2 3.49Å; L240-T244 WeakPolarHBondContact CB-OG1 3.17Å; L240-T244 HydrophobicContact CD1-CG2 3.81Å; L240-T244 HydrophobicContact CG-CG2 4.28Å; G241-T244 PolarHBondContact O-N 3.44Å; G241-T244 PolarHBondContact O-OG1 2.8Å; D242-T244 PolarHBondContact O-N 3.27Å; T244-R246 VanDerWaalsContact C-N 3.34Å; T244-R246 PolarHBondContact O-N 3.38Å; T244-V248 PolarHBondContact O-N 3.45Å; T244-V248 VanDerWaalsContact O-N 3.16Å |
| 245 | C | 87.7 | Confident | 83.6 | Confident | 2 Ų | 2 | 47 Ų | 47 | 1% | 0.014 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.6 | -37.9 | 177.9 | -162.4 | 0 | 0 | 0 | 0 | 112.7 | G241 D242 I243 P249 Q314 L315 C330 | G241-C245 PolarHBondContact O-N 3.14Å; G241-C245 VanDerWaalsContact O-N 3.15Å; D242-C245 WeakPolarHBondContact O-CA 3.43Å; D242-C245 VanDerWaalsContact O-CB 3.26Å; D242-C245 WeakPolarHBondContact O-CB 3.22Å; D242-C245 PolarHBondContact O-N 2.94Å; D242-C245 VanDerWaalsContact O-N 3.1Å; I243-C245 VanDerWaalsContact C-N 3.27Å; I243-C245 PolarHBondContact O-N 3.29Å; C245-P249 VanDerWaalsContact O-CD 3.31Å; C245-P249 WeakPolarHBondContact O-CD 3.37Å; C245-Q314 PolarHBondContact SG-O 3.16Å; C245-Q314 VanDerWaalsContact SG-O 3.39Å; C245-L315 HydrophobicContact CB-CD1 4.27Å; C245-C330 WeakPolarHBondContact CA-SG 3.24Å; C245-C330 HydrophobicContact CB-CB 4.46Å; C245-C330 WeakPolarHBondContact CB-SG 3.42Å; C245-C330 WeakPolarHBondContact SG-CA 3.49Å; C245-C330 WeakPolarHBondContact SG-CB 3.28Å; C245-C330 CovalentContact SG-SG 2.03Å; C245-C330 PolarHBondContact SG-SG 3.42Å |
| 246 | R | 89.8 | Confident | 84.6 | Confident | 23 Ų | 23 | 46.2 Ų | 46.2 | 9% | 0.087 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -84 | -40.7 | 174.8 | -61.7 | 175.4 | -167.7 | -64.5 | -27.4 | 112.7 | D242 I243 T244 Y250 I310 W313 | D242-R246 PolarHBondContact O-N 3.36Å; D242-R246 IonicContact OD1-CZ 3.92Å; D242-R246 IonicContact OD1-NE 3.45Å; D242-R246 PolarHBondContact OD1-NE 2.99Å; D242-R246 IonicContact OD1-NH2 3.12Å; D242-R246 PolarHBondContact OD1-NH2 3.13Å; D242-R246 IonicContact OD2-CZ 3.75Å; D242-R246 IonicContact OD2-NE 3.87Å; D242-R246 PolarHBondContact OD2-NE 3.47Å; D242-R246 IonicContact OD2-NH2 3.07Å; D242-R246 PolarHBondContact OD2-NH2 3.4Å; I243-R246 PolarHBondContact O-N 2.89Å; T244-R246 VanDerWaalsContact C-N 3.34Å; T244-R246 PolarHBondContact O-N 3.38Å; R246-Y250 WeakPolarHBondContact O-CB 3.44Å; R246-Y250 PolarHBondContact O-N 3.05Å; R246-I310 HydrophobicContact CB-CG2 4.47Å; R246-I310 WeakPolarHBondContact CD-O 3.49Å; R246-I310 PolarHBondContact NH1-O 2.96Å; R246-W313 PolarHBondContact NH1-O 3.01Å; R246-W313 PolarHBondContact NH2-O 3.44Å |
| 247 | L | 90.4 | Very high | 85.9 | Confident | 71 Ų | 71 | 40 Ų | 40 | 37% | 0.372 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -73.4 | -40.4 | -169 | -176.9 | 62.2 | 0 | 0 | 0 | 113.2 | I243 Y250 M251 | I243-L247 WeakPolarHBondContact O-CB 3.45Å; I243-L247 PolarHBondContact O-N 3.49Å; L247-Y250 HydrophobicContact CD1-CD1 4.48Å; L247-M251 HydrophobicContact CD1-CG 3.81Å; L247-M251 HydrophobicContact CD1-SD 4.39Å; L247-M251 HydrophobicContact CG-CG 4.12Å; L247-M251 WeakPolarHBondContact O-CB 3.48Å; L247-M251 WeakPolarHBondContact O-CG 3.47Å; L247-M251 PolarHBondContact O-N 3.25Å |
| 248 | V | 91.2 | Very high | 87.4 | Confident | 11 Ų | 11 | 33.9 Ų | 33.9 | 7% | 0.067 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -64.7 | -54.2 | -175.4 | 169.5 | 0 | 0 | 0 | 0 | 111.9 | C225 V228 V229 T244 Y250 M251 E252 | C225-V248 HydrophobicContact CB-CG1 4.2Å; V228-V248 HydrophobicContact CB-CG2 4.25Å; V228-V248 HydrophobicContact CG1-CG2 3.75Å; V229-V248 HydrophobicContact CG2-CG1 3.74Å; T244-V248 PolarHBondContact O-N 3.45Å; T244-V248 VanDerWaalsContact O-N 3.16Å; V248-Y250 VanDerWaalsContact C-N 3.3Å; V248-Y250 PolarHBondContact O-N 2.76Å; V248-M251 PolarHBondContact O-N 3.11Å; V248-M251 VanDerWaalsContact O-N 3.11Å; V248-E252 WeakPolarHBondContact CG1-OE1 3.44Å; V248-E252 WeakPolarHBondContact O-CG 2.91Å; V248-E252 PolarHBondContact O-N 3.37Å |
| 249 | P | 90.1 | Very high | 88.5 | Confident | 16 Ų | 16 | 31.3 Ų | 31.3 | 10% | 0.104 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -62.9 | -35.9 | 178.5 | -22.9 | 35.1 | 0 | 0 | 0 | 113 | C245 E252 I253 W313 | C245-P249 VanDerWaalsContact O-CD 3.31Å; C245-P249 WeakPolarHBondContact O-CD 3.37Å; P249-E252 PolarHBondContact O-N 3.48Å; P249-I253 WeakPolarHBondContact O-CB 3.46Å; P249-I253 PolarHBondContact O-N 2.95Å; P249-W313 HydrophobicContact CB-CD2 4.26Å; P249-W313 HydrophobicContact CB-CG 4.36Å; P249-W313 HydrophobicContact CB-CZ2 3.91Å; P249-W313 VanDerWaalsContact CB-NE1 3.26Å; P249-W313 HydrophobicContact CG-CD2 3.86Å; P249-W313 HydrophobicContact CG-CE3 4.48Å; P249-W313 HydrophobicContact CG-CG 4.12Å; P249-W313 HydrophobicContact CG-CH2 4.45Å; P249-W313 HydrophobicContact CG-CZ2 3.88Å |
| 250 | Y | 93 | Very high | 89.9 | Confident | 34 Ų | 34 | 26.3 Ų | 26.3 | 13% | 0.133 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.2 | -44.6 | 174 | 170.5 | -102.7 | 0 | 0 | 0 | 112.1 | R246 L247 V248 E252 A254 L303 S306 I310 | R246-Y250 WeakPolarHBondContact O-CB 3.44Å; R246-Y250 PolarHBondContact O-N 3.05Å; L247-Y250 HydrophobicContact CD1-CD1 4.48Å; V248-Y250 VanDerWaalsContact C-N 3.3Å; V248-Y250 PolarHBondContact O-N 2.76Å; Y250-E252 VanDerWaalsContact C-N 3.35Å; Y250-A254 WeakPolarHBondContact O-CB 3.22Å; Y250-A254 PolarHBondContact O-N 3.18Å; Y250-L303 HydrophobicContact CE1-CD2 4.47Å; Y250-L303 VanDerWaalsContact OH-CD2 3.31Å; Y250-L303 WeakPolarHBondContact OH-CD2 3.39Å; Y250-S306 WeakPolarHBondContact CD2-O 3.39Å; Y250-S306 WeakPolarHBondContact CE2-OG 3.34Å; Y250-I310 HydrophobicContact CD1-CD1 4.03Å; Y250-I310 HydrophobicContact CD1-CG1 4.26Å; Y250-I310 HydrophobicContact CD2-CD1 3.63Å; Y250-I310 HydrophobicContact CD2-CG1 3.53Å; Y250-I310 HydrophobicContact CE1-CD1 4.15Å; Y250-I310 HydrophobicContact CE2-CD1 3.75Å; Y250-I310 HydrophobicContact CE2-CG1 4.17Å; Y250-I310 HydrophobicContact CG-CD1 3.76Å; Y250-I310 HydrophobicContact CG-CG1 3.56Å |
| 251 | M | 94.2 | Very high | 91.1 | Very high | 19 Ų | 19 | 23 Ų | 23 | 9% | 0.094 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -68.3 | -34.8 | 179.7 | -75.2 | -63.2 | -59.4 | 0 | 0 | 112.5 | W217 L220 L247 V248 S255 | W217-M251 HydrophobicContact CE3-CE 4.11Å; W217-M251 HydrophobicContact CZ3-CE 3.72Å; W217-M251 HydrophobicContact CZ3-SD 4.17Å; L220-M251 HydrophobicContact CD2-CE 3.6Å; L220-M251 HydrophobicContact CG-CE 3.66Å; L247-M251 HydrophobicContact CD1-CG 3.81Å; L247-M251 HydrophobicContact CD1-SD 4.39Å; L247-M251 HydrophobicContact CG-CG 4.12Å; L247-M251 WeakPolarHBondContact O-CB 3.48Å; L247-M251 WeakPolarHBondContact O-CG 3.47Å; L247-M251 PolarHBondContact O-N 3.25Å; V248-M251 PolarHBondContact O-N 3.11Å; V248-M251 VanDerWaalsContact O-N 3.11Å; M251-S255 WeakPolarHBondContact O-CB 3.06Å; M251-S255 PolarHBondContact O-N 2.86Å |
| 252 | E | 92.9 | Very high | 91.7 | Very high | 10 Ų | 10 | 22.1 Ų | 22.1 | 5% | 0.047 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -67.4 | -51.4 | 176.4 | -74.7 | 166.2 | 166.5 | 0 | 0 | 111.2 | V248 P249 Y250 A254 S255 L256 H460 L463 | V248-E252 WeakPolarHBondContact CG1-OE1 3.44Å; V248-E252 WeakPolarHBondContact O-CG 2.91Å; V248-E252 PolarHBondContact O-N 3.37Å; P249-E252 PolarHBondContact O-N 3.48Å; Y250-E252 VanDerWaalsContact C-N 3.35Å; E252-A254 PolarHBondContact O-N 2.87Å; E252-S255 PolarHBondContact O-N 3.18Å; E252-L256 PolarHBondContact O-N 2.99Å; E252-H460 IonicContact OE1-CD2 2.71Å; E252-L463 HydrophobicContact CB-CD1 3.72Å; E252-L463 HydrophobicContact CG-CD1 3.83Å; E252-L463 HydrophobicContact CG-CD2 3.98Å |
| 253 | I | 92.3 | Very high | 92.3 | Very high | 30 Ų | 30 | 19.6 Ų | 19.6 | 15% | 0.154 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -69.8 | -31.8 | 177.4 | -68 | 167.4 | 0 | 0 | 0 | 111.6 | P249 L256 G257 E309 Y365 | P249-I253 WeakPolarHBondContact O-CB 3.46Å; P249-I253 PolarHBondContact O-N 2.95Å; I253-L256 PolarHBondContact O-N 3.4Å; I253-G257 PolarHBondContact O-N 2.92Å; I253-E309 VanDerWaalsContact CD1-CD 3.48Å; I253-E309 HydrophobicContact CD1-CG 3.63Å; I253-E309 WeakPolarHBondContact CD1-OE2 3.24Å; I253-E309 HydrophobicContact CG2-CG 4.49Å; I253-Y365 HydrophobicContact CG2-CE2 3.82Å |
| 254 | A | 94.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -61.2 | -47.8 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y250 E252 L256 G257 I258 L303 | Y250-A254 WeakPolarHBondContact O-CB 3.22Å; Y250-A254 PolarHBondContact O-N 3.18Å; E252-A254 PolarHBondContact O-N 2.87Å; A254-L256 VanDerWaalsContact C-N 3.34Å; A254-L256 PolarHBondContact O-N 3.46Å; A254-G257 CarbonylContact O-C 3.57Å; A254-G257 PolarHBondContact O-N 3.42Å; A254-G257 VanDerWaalsContact O-N 3.14Å; A254-I258 WeakPolarHBondContact O-CG1 3.33Å; A254-I258 PolarHBondContact O-N 3.29Å; A254-L303 HydrophobicContact CB-CD2 3.88Å |
| 255 | S | 94.4 | Very high | 92.9 | Very high | 2 Ų | 2 | 15.4 Ų | 15.4 | 1% | 0.014 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -63.8 | -38.2 | 177.9 | -173.1 | 0 | 0 | 0 | 0 | 112.5 | M251 E252 I258 T259 | M251-S255 WeakPolarHBondContact O-CB 3.06Å; M251-S255 PolarHBondContact O-N 2.86Å; E252-S255 PolarHBondContact O-N 3.18Å; S255-I258 PolarHBondContact O-N 2.72Å; S255-T259 PolarHBondContact O-N 2.98Å; S255-T259 PolarHBondContact O-OG1 2.96Å |
| 256 | L | 92.4 | Very high | 93.1 | Very high | 16 Ų | 16 | 15.3 Ų | 15.3 | 8% | 0.084 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -58.8 | -45.6 | 170.6 | -165.8 | 76.9 | 0 | 0 | 0 | 111.3 | E252 I253 A254 T259 S260 Y365 Y426 A430 | E252-L256 PolarHBondContact O-N 2.99Å; I253-L256 PolarHBondContact O-N 3.4Å; A254-L256 VanDerWaalsContact C-N 3.34Å; A254-L256 PolarHBondContact O-N 3.46Å; L256-T259 PolarHBondContact O-OG1 3.17Å; L256-T259 VanDerWaalsContact O-OG1 3.04Å; L256-S260 VanDerWaalsContact O-CB 3.22Å; L256-S260 WeakPolarHBondContact O-CB 3.19Å; L256-S260 PolarHBondContact O-N 3.17Å; L256-S260 PolarHBondContact O-OG 3.02Å; L256-Y365 HydrophobicContact CD2-CD2 4.06Å; L256-Y365 HydrophobicContact CD2-CG 4.2Å; L256-Y426 HydrophobicContact CD1-CE2 3.77Å; L256-Y426 WeakPolarHBondContact CD1-OH 3.24Å; L256-A430 HydrophobicContact CD1-CB 4.4Å |
| 257 | G | 94.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -66.2 | -38.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | I253 A254 S260 F261 Y365 | I253-G257 PolarHBondContact O-N 2.92Å; A254-G257 CarbonylContact O-C 3.57Å; A254-G257 PolarHBondContact O-N 3.42Å; A254-G257 VanDerWaalsContact O-N 3.14Å; G257-S260 WeakPolarHBondContact O-CB 3.18Å; G257-F261 WeakPolarHBondContact O-CD2 3.26Å; G257-F261 WeakPolarHBondContact O-CG 3.18Å; G257-F261 PolarHBondContact O-N 2.89Å; G257-Y365 VanDerWaalsContact CA-CE1 3.5Å |
| 258 | I | 95.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -66.7 | -46.5 | 177.6 | -59.4 | -97.7 | 0 | 0 | 0 | 109.6 | W217 A254 S255 T262 W299 A302 | W217-I258 HydrophobicContact CB-CG2 4.34Å; W217-I258 HydrophobicContact CD2-CD1 4Å; W217-I258 HydrophobicContact CD2-CG1 4.13Å; W217-I258 HydrophobicContact CG-CB 4.45Å; W217-I258 HydrophobicContact CG-CD1 4.16Å; W217-I258 HydrophobicContact CG-CG1 4.14Å; W217-I258 HydrophobicContact CG-CG2 4.08Å; W217-I258 HydrophobicContact CZ2-CD1 4.17Å; A254-I258 WeakPolarHBondContact O-CG1 3.33Å; A254-I258 PolarHBondContact O-N 3.29Å; S255-I258 PolarHBondContact O-N 2.72Å; I258-T262 WeakPolarHBondContact O-CB 3.38Å; I258-T262 PolarHBondContact O-N 3.4Å; I258-T262 PolarHBondContact O-OG1 3.14Å; I258-W299 HydrophobicContact CD1-CB 4.3Å; I258-W299 HydrophobicContact CD1-CG 4.08Å; I258-A302 HydrophobicContact CB-CB 4.4Å; I258-A302 HydrophobicContact CD1-CB 3.76Å; I258-A302 HydrophobicContact CG1-CB 3.67Å |
| 259 | T | 94.3 | Very high | 93.1 | Very high | 7 Ų | 7 | 16.3 Ų | 16.3 | 4% | 0.043 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -64.7 | -44 | 177 | 47.1 | 0 | 0 | 0 | 0 | 111.4 | I214 S255 L256 T262 L263 Y426 | I214-T259 HydrophobicContact CG1-CG2 4.35Å; I214-T259 HydrophobicContact CG2-CG2 3.97Å; S255-T259 PolarHBondContact O-N 2.98Å; S255-T259 PolarHBondContact O-OG1 2.96Å; L256-T259 PolarHBondContact O-OG1 3.17Å; L256-T259 VanDerWaalsContact O-OG1 3.04Å; T259-T262 PolarHBondContact O-N 3.46Å; T259-L263 WeakPolarHBondContact O-CB 3.46Å; T259-L263 WeakPolarHBondContact O-CG 3.38Å; T259-L263 PolarHBondContact O-N 3Å; T259-Y426 WeakPolarHBondContact OG1-CE2 3.4Å |
| 260 | S | 94 | Very high | 92.9 | Very high | 0 Ų | 0 | 16.7 Ų | 16.7 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -49.7 | -61.5 | 170.9 | -69.2 | 0 | 0 | 0 | 0 | 113.2 | L256 G257 T262 L263 C264 Y365 Y426 | L256-S260 VanDerWaalsContact O-CB 3.22Å; L256-S260 WeakPolarHBondContact O-CB 3.19Å; L256-S260 PolarHBondContact O-N 3.17Å; L256-S260 PolarHBondContact O-OG 3.02Å; G257-S260 WeakPolarHBondContact O-CB 3.18Å; S260-T262 VanDerWaalsContact C-N 3.32Å; S260-T262 PolarHBondContact O-N 3.41Å; S260-L263 WeakPolarHBondContact O-CB 3.31Å; S260-L263 PolarHBondContact O-N 2.95Å; S260-C264 PolarHBondContact O-N 3.43Å; S260-C264 VanDerWaalsContact O-N 3.09Å; S260-Y365 WeakPolarHBondContact OG-CA 3.3Å; S260-Y365 PolarHBondContact OG-O 2.9Å; S260-Y426 PolarHBondContact OG-OH 2.74Å |
| 261 | F | 94.7 | Very high | 92.6 | Very high | 37 Ų | 37 | 19 Ų | 19 | 16% | 0.162 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -73.1 | -26.2 | -174.1 | -62.1 | -40.7 | 0 | 0 | 0 | 112.4 | G257 A265 V298 S301 A302 L305 Y365 | G257-F261 WeakPolarHBondContact O-CD2 3.26Å; G257-F261 WeakPolarHBondContact O-CG 3.18Å; G257-F261 PolarHBondContact O-N 2.89Å; F261-A265 WeakPolarHBondContact O-CB 3.49Å; F261-A265 PolarHBondContact O-N 3.21Å; F261-V298 HydrophobicContact CB-CG1 3.99Å; F261-V298 HydrophobicContact CB-CG2 4.47Å; F261-S301 WeakPolarHBondContact CD2-OG 3.19Å; F261-A302 HydrophobicContact CD2-CB 4.06Å; F261-A302 HydrophobicContact CE2-CB 4.41Å; F261-L305 HydrophobicContact CE2-CD2 4.14Å; F261-L305 HydrophobicContact CZ-CD2 3.73Å; F261-Y365 HydrophobicContact CE2-CE1 4.19Å; F261-Y365 HydrophobicContact CZ-CD1 4.47Å; F261-Y365 HydrophobicContact CZ-CE1 4.11Å |
| 262 | T | 94.9 | Very high | 92.2 | Very high | 0 Ų | 0 | 23.4 Ų | 23.4 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -68.1 | -43.7 | 170 | -55.4 | 0 | 0 | 0 | 0 | 111.5 | L210 I214 I258 T259 S260 C264 A265 L266 | L210-T262 HydrophobicContact CB-CG2 3.82Å; L210-T262 HydrophobicContact CD2-CG2 4.23Å; L210-T262 HydrophobicContact CG-CG2 4.48Å; I214-T262 HydrophobicContact CD1-CG2 3.6Å; I214-T262 HydrophobicContact CG1-CG2 3.81Å; I258-T262 WeakPolarHBondContact O-CB 3.38Å; I258-T262 PolarHBondContact O-N 3.4Å; I258-T262 PolarHBondContact O-OG1 3.14Å; T259-T262 PolarHBondContact O-N 3.46Å; S260-T262 VanDerWaalsContact C-N 3.32Å; S260-T262 PolarHBondContact O-N 3.41Å; T262-C264 VanDerWaalsContact C-N 3.32Å; T262-C264 PolarHBondContact O-N 3.09Å; T262-A265 PolarHBondContact O-N 2.91Å; T262-A265 VanDerWaalsContact O-N 3.16Å; T262-L266 HydrophobicContact CG2-CD1 3.95Å; T262-L266 HydrophobicContact CG2-CG 4.18Å; T262-L266 WeakPolarHBondContact O-CB 3.47Å; T262-L266 WeakPolarHBondContact O-CG 3.29Å; T262-L266 PolarHBondContact O-N 3.02Å |
| 263 | L | 93.9 | Very high | 91.7 | Very high | 6 Ų | 6 | 24.1 Ų | 24.1 | 3% | 0.031 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -57.1 | -44.7 | 173.9 | -79.4 | 172.9 | 0 | 0 | 0 | 111.4 | T259 S260 L266 G267 T373 L419 L422 Y426 | T259-L263 WeakPolarHBondContact O-CB 3.46Å; T259-L263 WeakPolarHBondContact O-CG 3.38Å; T259-L263 PolarHBondContact O-N 3Å; S260-L263 WeakPolarHBondContact O-CB 3.31Å; S260-L263 PolarHBondContact O-N 2.95Å; L263-L266 PolarHBondContact O-N 3.36Å; L263-G267 PolarHBondContact O-N 3.29Å; L263-T373 HydrophobicContact CB-CG2 3.97Å; L263-T373 WeakPolarHBondContact O-CG2 3.45Å; L263-L419 HydrophobicContact CD2-CD1 3.85Å; L263-L422 HydrophobicContact CD2-CB 3.9Å; L263-Y426 HydrophobicContact CD1-CD1 3.96Å; L263-Y426 HydrophobicContact CD1-CD2 4.24Å; L263-Y426 HydrophobicContact CD1-CG 3.77Å |
| 264 | C | 94.3 | Very high | 91.2 | Very high | 14 Ų | 14 | 23.7 Ų | 23.7 | 10% | 0.095 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -59.5 | -48.1 | 172.5 | -67.9 | 0 | 0 | 0 | 0 | 112.7 | S260 T262 L266 G267 I268 F372 | S260-C264 PolarHBondContact O-N 3.43Å; S260-C264 VanDerWaalsContact O-N 3.09Å; T262-C264 VanDerWaalsContact C-N 3.32Å; T262-C264 PolarHBondContact O-N 3.09Å; C264-L266 VanDerWaalsContact C-N 3.33Å; C264-L266 PolarHBondContact O-N 3.12Å; C264-G267 WeakPolarHBondContact O-CA 3.43Å; C264-G267 PolarHBondContact O-N 2.73Å; C264-G267 VanDerWaalsContact O-N 3.11Å; C264-I268 WeakPolarHBondContact O-CG1 3.42Å; C264-I268 PolarHBondContact O-N 3.32Å; C264-F372 HydrophobicContact CB-CD1 4.18Å; C264-F372 HydrophobicContact CB-CE1 4.37Å |
| 265 | A | 93.3 | Very high | 90.6 | Very high | 25 Ų | 25 | 27.6 Ų | 27.6 | 21% | 0.207 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -61.6 | -39.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L210 F261 T262 D269 V298 | L210-A265 HydrophobicContact CD1-CB 4.14Å; F261-A265 WeakPolarHBondContact O-CB 3.49Å; F261-A265 PolarHBondContact O-N 3.21Å; T262-A265 PolarHBondContact O-N 2.91Å; T262-A265 VanDerWaalsContact O-N 3.16Å; A265-D269 WeakPolarHBondContact O-CB 3.21Å; A265-D269 PolarHBondContact O-N 3.17Å; A265-V298 HydrophobicContact CB-CG2 4.29Å |
| 266 | L | 92.2 | Very high | 89.8 | Confident | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -65.2 | -40.8 | 172.8 | -66 | 169.3 | 0 | 0 | 0 | 111.2 | W207 L210 L211 T262 L263 C264 D269 R270 L419 | W207-L266 HydrophobicContact CD2-CD2 3.6Å; W207-L266 HydrophobicContact CE3-CB 4.44Å; W207-L266 HydrophobicContact CE3-CD2 3.34Å; W207-L266 HydrophobicContact CE3-CG 4.47Å; W207-L266 HydrophobicContact CG-CD2 4.32Å; W207-L266 HydrophobicContact CH2-CB 3.75Å; W207-L266 HydrophobicContact CH2-CD2 3.79Å; W207-L266 HydrophobicContact CH2-CG 4.26Å; W207-L266 HydrophobicContact CZ2-CD2 4.04Å; W207-L266 HydrophobicContact CZ3-CB 3.64Å; W207-L266 HydrophobicContact CZ3-CD2 3.41Å; W207-L266 VanDerWaalsContact CZ3-CD2 3.41Å; W207-L266 HydrophobicContact CZ3-CG 4.1Å; W207-L266 WeakPolarHBondContact CZ3-O 3.32Å; L210-L266 HydrophobicContact CB-CD2 3.91Å; L210-L266 HydrophobicContact CB-CG 4.48Å; L210-L266 HydrophobicContact CD1-CD2 3.85Å; L210-L266 HydrophobicContact CD1-CG 4.29Å; L211-L266 HydrophobicContact CD2-CD1 4.16Å; T262-L266 HydrophobicContact CG2-CD1 3.95Å; T262-L266 HydrophobicContact CG2-CG 4.18Å; T262-L266 WeakPolarHBondContact O-CB 3.47Å; T262-L266 WeakPolarHBondContact O-CG 3.29Å; T262-L266 PolarHBondContact O-N 3.02Å; L263-L266 PolarHBondContact O-N 3.36Å; C264-L266 VanDerWaalsContact C-N 3.33Å; C264-L266 PolarHBondContact O-N 3.12Å; L266-D269 PolarHBondContact O-N 3.23Å; L266-R270 WeakPolarHBondContact O-CG 3.47Å; L266-R270 PolarHBondContact O-N 2.97Å; L266-L419 HydrophobicContact CB-CD1 3.68Å; L266-L419 HydrophobicContact CD1-CD1 4.15Å |
| 267 | G | 91.6 | Very high | 88.2 | Confident | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -58.7 | -47.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | L263 C264 R270 F271 | L263-G267 PolarHBondContact O-N 3.29Å; C264-G267 WeakPolarHBondContact O-CA 3.43Å; C264-G267 PolarHBondContact O-N 2.73Å; C264-G267 VanDerWaalsContact O-N 3.11Å; G267-R270 PolarHBondContact O-N 2.95Å; G267-F271 WeakPolarHBondContact O-CB 3.38Å; G267-F271 PolarHBondContact O-N 3.5Å |
| 268 | I | 90.4 | Very high | 86.3 | Confident | 96 Ų | 96 | 35.5 Ų | 35.5 | 49% | 0.492 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -59 | -47.3 | 174.5 | -66 | 165.2 | 0 | 0 | 0 | 110.5 | C264 R270 F271 H272 F372 | C264-I268 WeakPolarHBondContact O-CG1 3.42Å; C264-I268 PolarHBondContact O-N 3.32Å; I268-R270 PolarHBondContact O-N 3.42Å; I268-F271 PolarHBondContact O-N 2.98Å; I268-H272 VanDerWaalsContact O-CB 3.29Å; I268-H272 WeakPolarHBondContact O-CB 3.24Å; I268-H272 PolarHBondContact O-N 3.47Å; I268-F372 HydrophobicContact CD1-CE1 4.45Å; I268-F372 HydrophobicContact CD1-CZ 4.26Å; I268-F372 HydrophobicContact CG1-CE1 3.76Å; I268-F372 HydrophobicContact CG1-CZ 3.59Å |
| 269 | D | 87.6 | Confident | 84 | Confident | 31 Ų | 31 | 43.9 Ų | 43.9 | 17% | 0.166 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.9 | -38.9 | -177.7 | -170.5 | 76.9 | 0 | 0 | 0 | 112.2 | A265 L266 S273 | A265-D269 WeakPolarHBondContact O-CB 3.21Å; A265-D269 PolarHBondContact O-N 3.17Å; L266-D269 PolarHBondContact O-N 3.23Å; D269-S273 VanDerWaalsContact O-CB 3.23Å; D269-S273 WeakPolarHBondContact O-CB 3.13Å; D269-S273 PolarHBondContact O-N 2.93Å |
| 270 | R | 87.6 | Confident | 81.8 | Confident | 24 Ų | 24 | 49.9 Ų | 49.9 | 9% | 0.091 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -66.9 | -48 | 172 | -67.4 | -53.9 | 86.7 | -142.6 | 1.7 | 112.4 | W207 L266 G267 I268 H272 S273 A274 N416 L419 | W207-R270 HydrophobicContact CH2-CG 3.52Å; W207-R270 HydrophobicContact CZ3-CG 3.55Å; L266-R270 WeakPolarHBondContact O-CG 3.47Å; L266-R270 PolarHBondContact O-N 2.97Å; G267-R270 PolarHBondContact O-N 2.95Å; I268-R270 PolarHBondContact O-N 3.42Å; R270-H272 PolarHBondContact O-N 3.49Å; R270-S273 CarbonylContact O-C 3.59Å; R270-S273 WeakPolarHBondContact O-CB 3.47Å; R270-S273 PolarHBondContact O-N 2.8Å; R270-S273 VanDerWaalsContact O-N 3.16Å; R270-A274 PolarHBondContact O-N 3.4Å; R270-N416 VanDerWaalsContact CD-OD1 3.29Å; R270-N416 WeakPolarHBondContact CD-OD1 3.4Å; R270-N416 WeakPolarHBondContact CG-OD1 3.35Å; R270-L419 HydrophobicContact CG-CD2 3.94Å |
| 271 | F | 87.1 | Confident | 79.7 | Confident | 82 Ų | 82 | 53 Ų | 53 | 36% | 0.36 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.5 | -43.4 | -179.8 | 174.8 | -110.4 | 0 | 0 | 0 | 112 | G267 I268 S273 A274 T275 C376 A379 | G267-F271 WeakPolarHBondContact O-CB 3.38Å; G267-F271 PolarHBondContact O-N 3.5Å; I268-F271 PolarHBondContact O-N 2.98Å; F271-S273 VanDerWaalsContact C-N 3.35Å; F271-S273 PolarHBondContact O-N 2.85Å; F271-A274 PolarHBondContact O-N 2.86Å; F271-T275 PolarHBondContact O-N 2.98Å; F271-T275 PolarHBondContact O-OG1 3.35Å; F271-C376 HydrophobicContact CB-CB 4.31Å; F271-A379 HydrophobicContact CD2-CB 3.84Å; F271-A379 HydrophobicContact CE2-CB 3.77Å |
| 272 | H | 85.3 | Confident | 77.3 | Confident | 111 Ų | 111 | 55.9 Ų | 55.9 | 51% | 0.514 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63.7 | -39.1 | 173.8 | -174.7 | -77.9 | 0 | 0 | 0 | 111.6 | I268 R270 A274 S276 | I268-H272 VanDerWaalsContact O-CB 3.29Å; I268-H272 WeakPolarHBondContact O-CB 3.24Å; I268-H272 PolarHBondContact O-N 3.47Å; R270-H272 PolarHBondContact O-N 3.49Å; H272-A274 VanDerWaalsContact C-N 3.34Å; H272-S276 PolarHBondContact CE1-OG 2.9Å; H272-S276 PolarHBondContact ND1-OG 3.42Å; H272-S276 WeakPolarHBondContact O-CB 3.23Å; H272-S276 PolarHBondContact O-N 3.07Å; H272-S276 PolarHBondContact O-OG 3.05Å |
| 273 | S | 81.4 | Confident | 74.6 | Confident | 25 Ų | 25 | 66.8 Ų | 66.8 | 18% | 0.175 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -64.2 | -35.3 | 173.4 | -168 | 0 | 0 | 0 | 0 | 112.6 | D269 R270 F271 K281 E412 | D269-S273 VanDerWaalsContact O-CB 3.23Å; D269-S273 WeakPolarHBondContact O-CB 3.13Å; D269-S273 PolarHBondContact O-N 2.93Å; R270-S273 CarbonylContact O-C 3.59Å; R270-S273 WeakPolarHBondContact O-CB 3.47Å; R270-S273 PolarHBondContact O-N 2.8Å; R270-S273 VanDerWaalsContact O-N 3.16Å; F271-S273 VanDerWaalsContact C-N 3.35Å; F271-S273 PolarHBondContact O-N 2.85Å; S273-K281 WeakPolarHBondContact O-CE 3.29Å; S273-K281 PolarHBondContact O-NZ 3.37Å; S273-E412 PolarHBondContact OG-OE1 3.42Å |
| 274 | A | 82.3 | Confident | 72.5 | Confident | 22 Ų | 22 | 75.8 Ų | 75.8 | 18% | 0.182 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -69.8 | -47.6 | 178 | 0 | 0 | 0 | 0 | 0 | 111.9 | R270 F271 H272 T380 V383 | R270-A274 PolarHBondContact O-N 3.4Å; F271-A274 PolarHBondContact O-N 2.86Å; H272-A274 VanDerWaalsContact C-N 3.34Å; A274-T380 HydrophobicContact CB-CG2 3.88Å; A274-V383 HydrophobicContact CB-CG1 4.47Å; A274-V383 WeakPolarHBondContact O-CG1 3.39Å |
| 275 | T | 82 | Confident | 70.6 | Confident | 81 Ų | 81 | 81.9 Ų | 81.9 | 50% | 0.497 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -79.5 | -21.5 | -175.1 | -52.8 | 0 | 0 | 0 | 0 | 113.1 | F271 S277 | F271-T275 PolarHBondContact O-N 2.98Å; F271-T275 PolarHBondContact O-OG1 3.35Å; T275-S277 PolarHBondContact O-N 3.2Å |
| 276 | S | 76.9 | Confident | 69.2 | Low | 22 Ų | 22 | 83.5 Ų | 83.5 | 15% | 0.154 | 43% | 0.428 | C | S | . | . | S | Bend | trans | -69.7 | 126.6 | 176.8 | -69 | 0 | 0 | 0 | 0 | 112.6 | H272 K281 | H272-S276 PolarHBondContact CE1-OG 2.9Å; H272-S276 PolarHBondContact ND1-OG 3.42Å; H272-S276 WeakPolarHBondContact O-CB 3.23Å; H272-S276 PolarHBondContact O-N 3.07Å; H272-S276 PolarHBondContact O-OG 3.05Å; S276-K281 WeakPolarHBondContact O-CE 3.43Å |
| 277 | S | 58.7 | Low | 68.3 | Low | 61 Ų | 61 | 93.7 Ų | 93.7 | 43% | 0.427 | 47% | 0.466 | S | S | . | . | trans | -51.9 | 136.6 | 175.6 | 174.4 | 0 | 0 | 0 | 0 | 112.1 | T275 Q279 Q280 K281 | T275-S277 PolarHBondContact O-N 3.2Å; S277-Q279 PolarHBondContact O-N 3.43Å; S277-Q280 PolarHBondContact O-N 2.85Å; S277-K281 PolarHBondContact O-N 3.03Å | ||
| 278 | P | 55.3 | Low | 67.4 | Low | 101 Ų | 101 | 96.2 Ų | 96.2 | 66% | 0.656 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -51.8 | -32.1 | -179.1 | -29.1 | 35.4 | 0 | 0 | 0 | 114.4 | Q280 K281 | P278-Q280 VanDerWaalsContact C-N 3.27Å; P278-Q280 PolarHBondContact O-N 3.5Å; P278-K281 WeakPolarHBondContact O-CB 3.43Å; P278-K281 PolarHBondContact O-N 2.96Å |
| 279 | Q | 45.3 | Very low | 67 | Low | 176 Ų | 176 | 101.8 Ų | 101.8 | 82% | 0.822 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -71.7 | -19.5 | -179.3 | -158.6 | 167.3 | 6.4 | 0 | 0 | 113.3 | S277 | S277-Q279 PolarHBondContact O-N 3.43Å |
| 280 | Q | 49 | Very low | 66.9 | Low | 134 Ų | 134 | 102.8 Ų | 102.8 | 63% | 0.626 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -87.7 | -29.8 | 171.7 | -68.8 | -176.2 | -25.3 | 0 | 0 | 112.7 | S277 P278 A282 R283 | S277-Q280 PolarHBondContact O-N 2.85Å; P278-Q280 VanDerWaalsContact C-N 3.27Å; P278-Q280 PolarHBondContact O-N 3.5Å; Q280-A282 PolarHBondContact O-N 2.94Å; Q280-R283 PolarHBondContact O-N 3.25Å |
| 281 | K | 49.9 | Very low | 66.8 | Low | 65 Ų | 65 | 102 Ų | 102 | 28% | 0.283 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -55 | -35.3 | 178.1 | -64 | -170 | -179.9 | -169.2 | 0 | 112.3 | S273 S276 S277 P278 R283 H408 E412 | S273-K281 WeakPolarHBondContact O-CE 3.29Å; S273-K281 PolarHBondContact O-NZ 3.37Å; S276-K281 WeakPolarHBondContact O-CE 3.43Å; S277-K281 PolarHBondContact O-N 3.03Å; P278-K281 WeakPolarHBondContact O-CB 3.43Å; P278-K281 PolarHBondContact O-N 2.96Å; K281-R283 VanDerWaalsContact C-N 3.28Å; K281-R283 PolarHBondContact O-N 3.44Å; K281-H408 PolarHBondContact NZ-NE2 2.93Å; K281-E412 VanDerWaalsContact NZ-CD 3.32Å; K281-E412 IonicContact NZ-OE1 3.47Å; K281-E412 PolarHBondContact NZ-OE1 2.97Å; K281-E412 IonicContact NZ-OE2 2.73Å; K281-E412 PolarHBondContact NZ-OE2 3.47Å |
| 282 | A | 44.4 | Very low | 66.7 | Low | 97 Ų | 97 | 101.9 Ų | 101.9 | 80% | 0.802 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.8 | -9.9 | -175.7 | 0 | 0 | 0 | 0 | 0 | 116.2 | Q280 | Q280-A282 PolarHBondContact O-N 2.94Š|
| 283 | R | 38.5 | Very low | 67 | Low | 230 Ų | 230 | 101.3 Ų | 101.3 | 87% | 0.868 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -125.4 | -11.4 | -170.1 | -174.4 | 163.8 | -82.4 | -140.8 | -2.2 | 116 | Q280 K281 V285 | Q280-R283 PolarHBondContact O-N 3.25Å; K281-R283 VanDerWaalsContact C-N 3.28Å; K281-R283 PolarHBondContact O-N 3.44Å; R283-V285 PolarHBondContact O-N 3.01Å |
| 284 | R | 48.5 | Very low | 67.3 | Low | 194 Ų | 194 | 103.4 Ų | 103.4 | 73% | 0.732 | 51% | 0.514 | S | S | * | . | trans | -100.4 | 71.4 | -178.8 | -163.3 | 174.3 | -70.7 | -148.8 | 2 | 112.8 | E286 | R284-E286 PolarHBondContact O-N 3.43Å; R284-E286 VanDerWaalsContact O-N 3.12Å | ||
| 285 | V | 56 | Low | 67.7 | Low | 142 Ų | 142 | 103.9 Ų | 103.9 | 86% | 0.861 | 51% | 0.513 | S | S | * | . | trans | -62.9 | 109.8 | 155.2 | 176.3 | 0 | 0 | 0 | 0 | 106.9 | R283 R287 | R283-V285 PolarHBondContact O-N 3.01Å; V285-R287 PolarHBondContact O-N 3.06Å | ||
| 286 | E | 63.5 | Low | 68.2 | Low | 60 Ų | 60 | 104 Ų | 104 | 28% | 0.28 | 51% | 0.51 | S | S | . | . | trans | -61.7 | 124.8 | 177 | -68.7 | -153.7 | 143.2 | 0 | 0 | 109.8 | R284 C288 V291 K294 | R284-E286 PolarHBondContact O-N 3.43Å; R284-E286 VanDerWaalsContact O-N 3.12Å; E286-C288 PolarHBondContact O-N 3.48Å; E286-V291 HydrophobicContact CB-CG2 3.99Å; E286-K294 IonicContact OE1-NZ 2.72Å; E286-K294 PolarHBondContact OE1-NZ 3.05Å; E286-K294 IonicContact OE2-NZ 3.18Å; E286-K294 PolarHBondContact OE2-NZ 3.32Å | ||
| 287 | R | 73.3 | Confident | 69 | Low | 214 Ų | 214 | 108 Ų | 108 | 81% | 0.808 | 53% | 0.529 | S | S | * | . | trans | -61.6 | 132.9 | 179.8 | -145.9 | 173.2 | -162.7 | 165.1 | 5.7 | 108 | V285 R289 S290 | V285-R287 PolarHBondContact O-N 3.06Å; R287-R289 PolarHBondContact O-N 2.95Å; R287-S290 WeakPolarHBondContact O-CA 3.46Å; R287-S290 VanDerWaalsContact O-CB 3.24Å; R287-S290 WeakPolarHBondContact O-CB 3.18Å; R287-S290 PolarHBondContact O-N 3.03Å | ||
| 288 | C | 73.1 | Confident | 70.7 | Confident | 52 Ų | 52 | 105.8 Ų | 105.8 | 35% | 0.351 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -48.1 | -38.3 | -174.1 | -170.4 | 0 | 0 | 0 | 0 | 113.7 | E286 S290 V291 L292 | E286-C288 PolarHBondContact O-N 3.48Å; C288-S290 VanDerWaalsContact C-N 3.28Å; C288-S290 PolarHBondContact O-N 3.5Å; C288-V291 PolarHBondContact O-N 3.23Å; C288-V291 VanDerWaalsContact O-N 3.17Å; C288-L292 WeakPolarHBondContact O-CG 3.43Å; C288-L292 PolarHBondContact O-N 3.21Å |
| 289 | R | 82.3 | Confident | 72.6 | Confident | 213 Ų | 213 | 103.7 Ų | 103.7 | 80% | 0.804 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -56.7 | -34.7 | 174 | -177.1 | 173.1 | 177.1 | 163.4 | -0.1 | 114 | R287 L293 | R287-R289 PolarHBondContact O-N 2.95Å; R289-L293 WeakPolarHBondContact O-CB 3.38Å; R289-L293 PolarHBondContact O-N 3.13Å |
| 290 | S | 84.8 | Confident | 75.1 | Confident | 52 Ų | 52 | 100.2 Ų | 100.2 | 36% | 0.364 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -71.7 | -37.4 | 177.1 | -161.4 | 0 | 0 | 0 | 0 | 112.2 | R287 C288 L293 K294 | R287-S290 WeakPolarHBondContact O-CA 3.46Å; R287-S290 VanDerWaalsContact O-CB 3.24Å; R287-S290 WeakPolarHBondContact O-CB 3.18Å; R287-S290 PolarHBondContact O-N 3.03Å; C288-S290 VanDerWaalsContact C-N 3.28Å; C288-S290 PolarHBondContact O-N 3.5Å; S290-L293 PolarHBondContact O-N 2.84Å; S290-K294 WeakPolarHBondContact O-CG 3.41Å; S290-K294 PolarHBondContact O-N 3.23Å |
| 291 | V | 84.3 | Confident | 77.2 | Confident | 9 Ų | 9 | 95.8 Ų | 95.8 | 6% | 0.055 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -68.2 | -46.8 | 175.4 | -179.1 | 0 | 0 | 0 | 0 | 110.3 | A206 Y209 E286 C288 L293 K294 M295 | A206-V291 HydrophobicContact CB-CG1 4.13Å; A206-V291 HydrophobicContact CB-CG2 3.71Å; Y209-V291 HydrophobicContact CD2-CG1 3.86Å; Y209-V291 HydrophobicContact CG-CG1 4.14Å; E286-V291 HydrophobicContact CB-CG2 3.99Å; C288-V291 PolarHBondContact O-N 3.23Å; C288-V291 VanDerWaalsContact O-N 3.17Å; V291-L293 VanDerWaalsContact C-N 3.26Å; V291-L293 PolarHBondContact O-N 2.94Å; V291-K294 PolarHBondContact O-N 3.05Å; V291-M295 PolarHBondContact O-N 3.15Å |
| 292 | L | 86.9 | Confident | 79.4 | Confident | 79 Ų | 79 | 92.7 Ų | 92.7 | 41% | 0.414 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -61.3 | -35.1 | 175.2 | -66.8 | 171.7 | 0 | 0 | 0 | 111.9 | C288 M295 L296 | C288-L292 WeakPolarHBondContact O-CG 3.43Å; C288-L292 PolarHBondContact O-N 3.21Å; L292-M295 HydrophobicContact CD2-CE 4.46Å; L292-L296 WeakPolarHBondContact O-CB 3.42Å; L292-L296 PolarHBondContact O-N 2.68Å |
| 293 | L | 89.7 | Confident | 81.8 | Confident | 99 Ų | 99 | 90.1 Ų | 90.1 | 52% | 0.518 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -66.3 | -46.1 | 173.5 | -164.3 | 79.8 | 0 | 0 | 0 | 111.9 | R289 S290 V291 M295 L296 L297 | R289-L293 WeakPolarHBondContact O-CB 3.38Å; R289-L293 PolarHBondContact O-N 3.13Å; S290-L293 PolarHBondContact O-N 2.84Å; V291-L293 VanDerWaalsContact C-N 3.26Å; V291-L293 PolarHBondContact O-N 2.94Å; L293-M295 VanDerWaalsContact C-N 3.34Å; L293-M295 PolarHBondContact O-N 3Å; L293-L296 PolarHBondContact O-N 2.86Å; L293-L297 HydrophobicContact CG-CD1 4.21Å; L293-L297 WeakPolarHBondContact O-CB 3.21Å; L293-L297 VanDerWaalsContact O-CG 3.26Å; L293-L297 WeakPolarHBondContact O-CG 3.41Å; L293-L297 PolarHBondContact O-N 3.48Å |
| 294 | K | 87.8 | Confident | 84.4 | Confident | 69 Ų | 69 | 84.8 Ų | 84.8 | 30% | 0.3 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -56.2 | -48.2 | 174.4 | -74.6 | 176.4 | 178.7 | 174 | 0 | 111.3 | E286 S290 V291 L297 V298 | E286-K294 IonicContact OE1-NZ 2.72Å; E286-K294 PolarHBondContact OE1-NZ 3.05Å; E286-K294 IonicContact OE2-NZ 3.18Å; E286-K294 PolarHBondContact OE2-NZ 3.32Å; S290-K294 WeakPolarHBondContact O-CG 3.41Å; S290-K294 PolarHBondContact O-N 3.23Å; V291-K294 PolarHBondContact O-N 3.05Å; K294-L297 PolarHBondContact O-N 3.16Å; K294-V298 WeakPolarHBondContact O-CG2 3.44Å; K294-V298 PolarHBondContact O-N 2.89Å; K294-V298 VanDerWaalsContact O-N 3.09Å |
| 295 | M | 91.3 | Very high | 86.4 | Confident | 32 Ų | 32 | 78 Ų | 78 | 16% | 0.158 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -63.4 | -45.4 | 179.3 | -170.3 | -168.2 | 81 | 0 | 0 | 111.9 | V291 L292 L293 L297 V298 W299 | V291-M295 PolarHBondContact O-N 3.15Å; L292-M295 HydrophobicContact CD2-CE 4.46Å; L293-M295 VanDerWaalsContact C-N 3.34Å; L293-M295 PolarHBondContact O-N 3Å; M295-L297 VanDerWaalsContact C-N 3.34Å; M295-L297 PolarHBondContact O-N 3.01Å; M295-V298 PolarHBondContact O-N 3.26Å; M295-W299 HydrophobicContact CE-CD2 4.32Å; M295-W299 HydrophobicContact CE-CE3 4.19Å; M295-W299 HydrophobicContact CE-CH2 3.6Å; M295-W299 HydrophobicContact CE-CZ2 3.72Å; M295-W299 HydrophobicContact CE-CZ3 3.85Å; M295-W299 HydrophobicContact CG-CD2 4.4Å; M295-W299 HydrophobicContact CG-CZ2 4.11Å; M295-W299 PolarHBondContact O-N 2.93Å; M295-W299 HydrophobicContact SD-CH2 4.22Å; M295-W299 HydrophobicContact SD-CZ2 3.78Å |
| 296 | L | 93.7 | Very high | 88.2 | Confident | 84 Ų | 84 | 71.2 Ų | 71.2 | 44% | 0.44 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.9 | -39.4 | 177.7 | -179.1 | 63.2 | 0 | 0 | 0 | 112 | L292 L293 W299 L300 | L292-L296 WeakPolarHBondContact O-CB 3.42Å; L292-L296 PolarHBondContact O-N 2.68Å; L293-L296 PolarHBondContact O-N 2.86Å; L296-W299 PolarHBondContact O-N 2.89Å; L296-L300 HydrophobicContact CD1-CD1 4Å; L296-L300 HydrophobicContact CD1-CG 4.02Å; L296-L300 HydrophobicContact CG-CD1 3.87Å; L296-L300 HydrophobicContact CG-CG 4.29Å; L296-L300 WeakPolarHBondContact O-CB 3.43Å; L296-L300 VanDerWaalsContact O-CG 3.27Å; L296-L300 WeakPolarHBondContact O-CG 3.5Å; L296-L300 PolarHBondContact O-N 3.22Å |
| 297 | L | 93.7 | Very high | 89.5 | Confident | 105 Ų | 105 | 70.1 Ų | 70.1 | 55% | 0.55 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -62.7 | -44.7 | 175.1 | -73.4 | 166.6 | 0 | 0 | 0 | 111.6 | L293 K294 M295 W299 L300 S301 | L293-L297 HydrophobicContact CG-CD1 4.21Å; L293-L297 WeakPolarHBondContact O-CB 3.21Å; L293-L297 VanDerWaalsContact O-CG 3.26Å; L293-L297 WeakPolarHBondContact O-CG 3.41Å; L293-L297 PolarHBondContact O-N 3.48Å; K294-L297 PolarHBondContact O-N 3.16Å; M295-L297 VanDerWaalsContact C-N 3.34Å; M295-L297 PolarHBondContact O-N 3.01Å; L297-W299 VanDerWaalsContact C-N 3.35Å; L297-W299 PolarHBondContact O-N 3.45Å; L297-L300 PolarHBondContact O-N 3.11Å; L297-S301 WeakPolarHBondContact O-CB 3.38Å; L297-S301 PolarHBondContact O-N 3.13Å; L297-S301 PolarHBondContact O-OG 3.12Å |
| 298 | V | 93.9 | Very high | 90.2 | Very high | 14 Ų | 14 | 61.1 Ų | 61.1 | 9% | 0.085 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61.1 | -41.1 | 175.5 | 165.3 | 0 | 0 | 0 | 0 | 111.9 | F261 A265 K294 M295 S301 A302 | F261-V298 HydrophobicContact CB-CG1 3.99Å; F261-V298 HydrophobicContact CB-CG2 4.47Å; A265-V298 HydrophobicContact CB-CG2 4.29Å; K294-V298 WeakPolarHBondContact O-CG2 3.44Å; K294-V298 PolarHBondContact O-N 2.89Å; K294-V298 VanDerWaalsContact O-N 3.09Å; M295-V298 PolarHBondContact O-N 3.26Å; V298-S301 PolarHBondContact O-OG 3.03Å; V298-S301 VanDerWaalsContact O-OG 3.14Å; V298-A302 WeakPolarHBondContact O-CB 3.29Å; V298-A302 PolarHBondContact O-N 3.45Å; V298-A302 VanDerWaalsContact O-N 3.09Å |
| 299 | W | 95.6 | Very high | 91 | Very high | 58 Ų | 58 | 58.6 Ų | 58.6 | 22% | 0.22 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -69.2 | -47.1 | 177.5 | -69 | 4.8 | 0 | 0 | 0 | 112.2 | F216 W217 I258 M295 L296 L297 S301 A302 L303 | F216-W299 HydrophobicContact CD1-CH2 4.17Å; F216-W299 HydrophobicContact CD1-CZ2 4.19Å; F216-W299 HydrophobicContact CE1-CH2 4.28Å; W217-W299 AromaticContact NE1-CD2 3.93Å; W217-W299 AromaticContact NE1-CE2 3.55Å; W217-W299 AromaticContact NE1-CZ2 3.83Å; W217-W299 AromaticContact NE1-NE1 3.67Å; I258-W299 HydrophobicContact CD1-CB 4.3Å; I258-W299 HydrophobicContact CD1-CG 4.08Å; M295-W299 HydrophobicContact CE-CD2 4.32Å; M295-W299 HydrophobicContact CE-CE3 4.19Å; M295-W299 HydrophobicContact CE-CH2 3.6Å; M295-W299 HydrophobicContact CE-CZ2 3.72Å; M295-W299 HydrophobicContact CE-CZ3 3.85Å; M295-W299 HydrophobicContact CG-CD2 4.4Å; M295-W299 HydrophobicContact CG-CZ2 4.11Å; M295-W299 PolarHBondContact O-N 2.93Å; M295-W299 HydrophobicContact SD-CH2 4.22Å; M295-W299 HydrophobicContact SD-CZ2 3.78Å; L296-W299 PolarHBondContact O-N 2.89Å; L297-W299 VanDerWaalsContact C-N 3.35Å; L297-W299 PolarHBondContact O-N 3.45Å; W299-S301 VanDerWaalsContact C-N 3.35Å; W299-S301 PolarHBondContact O-N 2.71Å; W299-A302 PolarHBondContact O-N 3.31Å; W299-L303 WeakPolarHBondContact O-CB 3.43Å; W299-L303 VanDerWaalsContact O-CG 3.25Å; W299-L303 WeakPolarHBondContact O-CG 3.34Å; W299-L303 PolarHBondContact O-N 3.42Å |
| 300 | L | 96.2 | Very high | 91.3 | Very high | 103 Ų | 103 | 50.9 Ų | 50.9 | 54% | 0.539 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -64.3 | -38.6 | 178.3 | -70.5 | 174.7 | 0 | 0 | 0 | 111.8 | L296 L297 L304 | L296-L300 HydrophobicContact CD1-CD1 4Å; L296-L300 HydrophobicContact CD1-CG 4.02Å; L296-L300 HydrophobicContact CG-CD1 3.87Å; L296-L300 HydrophobicContact CG-CG 4.29Å; L296-L300 WeakPolarHBondContact O-CB 3.43Å; L296-L300 VanDerWaalsContact O-CG 3.27Å; L296-L300 WeakPolarHBondContact O-CG 3.5Å; L296-L300 PolarHBondContact O-N 3.22Å; L297-L300 PolarHBondContact O-N 3.11Å; L300-L304 WeakPolarHBondContact O-CB 3.23Å; L300-L304 PolarHBondContact O-N 3.23Å |
| 301 | S | 94.3 | Very high | 91.3 | Very high | 41 Ų | 41 | 50.9 Ų | 50.9 | 29% | 0.287 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -68.6 | -38.9 | 176.5 | 67.9 | 0 | 0 | 0 | 0 | 112.3 | F261 L297 V298 W299 L305 | F261-S301 WeakPolarHBondContact CD2-OG 3.19Å; L297-S301 WeakPolarHBondContact O-CB 3.38Å; L297-S301 PolarHBondContact O-N 3.13Å; L297-S301 PolarHBondContact O-OG 3.12Å; V298-S301 PolarHBondContact O-OG 3.03Å; V298-S301 VanDerWaalsContact O-OG 3.14Å; W299-S301 VanDerWaalsContact C-N 3.35Å; W299-S301 PolarHBondContact O-N 2.71Å; S301-L305 WeakPolarHBondContact O-CB 3.47Å; S301-L305 WeakPolarHBondContact O-CD1 3.33Å; S301-L305 PolarHBondContact O-N 3.48Å |
| 302 | A | 95.2 | Very high | 91.4 | Very high | 0 Ų | 0 | 50.4 Ų | 50.4 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.4 | -54.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | I258 F261 V298 W299 L304 L305 S306 | I258-A302 HydrophobicContact CB-CB 4.4Å; I258-A302 HydrophobicContact CD1-CB 3.76Å; I258-A302 HydrophobicContact CG1-CB 3.67Å; F261-A302 HydrophobicContact CD2-CB 4.06Å; F261-A302 HydrophobicContact CE2-CB 4.41Å; V298-A302 WeakPolarHBondContact O-CB 3.29Å; V298-A302 PolarHBondContact O-N 3.45Å; V298-A302 VanDerWaalsContact O-N 3.09Å; W299-A302 PolarHBondContact O-N 3.31Å; A302-L304 VanDerWaalsContact C-N 3.31Å; A302-L304 PolarHBondContact O-N 2.95Å; A302-L305 PolarHBondContact O-N 3.46Å; A302-S306 PolarHBondContact O-N 2.97Å; A302-S306 PolarHBondContact O-OG 3.03Å |
| 303 | L | 94.9 | Very high | 91.3 | Very high | 42 Ų | 42 | 48.8 Ų | 48.8 | 22% | 0.22 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -66.9 | -30.9 | -175 | -64 | 167.5 | 0 | 0 | 0 | 112.7 | W217 Y250 A254 W299 S306 S307 | W217-L303 HydrophobicContact CH2-CD1 4.15Å; W217-L303 HydrophobicContact CH2-CD2 3.64Å; W217-L303 HydrophobicContact CH2-CG 4.41Å; W217-L303 HydrophobicContact CZ2-CD1 4.16Å; W217-L303 HydrophobicContact CZ2-CD2 4.3Å; W217-L303 HydrophobicContact CZ3-CD2 4.11Å; Y250-L303 HydrophobicContact CE1-CD2 4.47Å; Y250-L303 VanDerWaalsContact OH-CD2 3.31Å; Y250-L303 WeakPolarHBondContact OH-CD2 3.39Å; A254-L303 HydrophobicContact CB-CD2 3.88Å; W299-L303 WeakPolarHBondContact O-CB 3.43Å; W299-L303 VanDerWaalsContact O-CG 3.25Å; W299-L303 WeakPolarHBondContact O-CG 3.34Å; W299-L303 PolarHBondContact O-N 3.42Å; L303-S306 PolarHBondContact O-OG 3.3Å; L303-S307 WeakPolarHBondContact O-CB 3.29Å; L303-S307 PolarHBondContact O-N 3.46Å |
| 304 | L | 92.7 | Very high | 91.1 | Very high | 119 Ų | 119 | 45.9 Ų | 45.9 | 62% | 0.623 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -70.3 | -43.4 | 172.8 | -177.3 | 62.2 | 0 | 0 | 0 | 111.7 | L300 A302 S307 | L300-L304 WeakPolarHBondContact O-CB 3.23Å; L300-L304 PolarHBondContact O-N 3.23Å; A302-L304 VanDerWaalsContact C-N 3.31Å; A302-L304 PolarHBondContact O-N 2.95Å; L304-S307 WeakPolarHBondContact O-CB 3.44Å; L304-S307 PolarHBondContact O-N 2.71Å; L304-S307 PolarHBondContact O-OG 2.98Å |
| 305 | L | 92.1 | Very high | 90.9 | Very high | 51 Ų | 51 | 45.1 Ų | 45.1 | 27% | 0.267 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -76.1 | -22.3 | -178.4 | -87.6 | 56.7 | 0 | 0 | 0 | 113.3 | F261 S301 A302 P308 W360 Y365 | F261-L305 HydrophobicContact CE2-CD2 4.14Å; F261-L305 HydrophobicContact CZ-CD2 3.73Å; S301-L305 WeakPolarHBondContact O-CB 3.47Å; S301-L305 WeakPolarHBondContact O-CD1 3.33Å; S301-L305 PolarHBondContact O-N 3.48Å; A302-L305 PolarHBondContact O-N 3.46Å; L305-P308 WeakPolarHBondContact O-CD 3.21Å; L305-W360 HydrophobicContact CD2-CZ2 3.87Å; L305-W360 HydrophobicContact CG-CZ2 4.02Å; L305-Y365 VanDerWaalsContact C-OH 3.29Å; L305-Y365 WeakPolarHBondContact CB-OH 3.36Å; L305-Y365 PolarHBondContact O-OH 2.68Å |
| 306 | S | 92.5 | Very high | 90.2 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -85.9 | -13.8 | 170 | 66 | 0 | 0 | 0 | 0 | 113.6 | Y250 A302 L303 P308 E309 Y365 | Y250-S306 WeakPolarHBondContact CD2-O 3.39Å; Y250-S306 WeakPolarHBondContact CE2-OG 3.34Å; A302-S306 PolarHBondContact O-N 2.97Å; A302-S306 PolarHBondContact O-OG 3.03Å; L303-S306 PolarHBondContact O-OG 3.3Å; S306-P308 VanDerWaalsContact C-N 3.34Å; S306-E309 WeakPolarHBondContact O-CB 3.36Å; S306-E309 PolarHBondContact O-N 3.02Å; S306-Y365 PolarHBondContact N-OH 3.46Å |
| 307 | S | 91 | Very high | 89.4 | Confident | 37 Ų | 37 | 47.7 Ų | 47.7 | 26% | 0.259 | 25% | 0.248 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55 | -30.1 | -176.7 | 70.6 | 0 | 0 | 0 | 0 | 116.8 | L303 L304 E309 I310 F311 | L303-S307 WeakPolarHBondContact O-CB 3.29Å; L303-S307 PolarHBondContact O-N 3.46Å; L304-S307 WeakPolarHBondContact O-CB 3.44Å; L304-S307 PolarHBondContact O-N 2.71Å; L304-S307 PolarHBondContact O-OG 2.98Å; S307-E309 PolarHBondContact O-N 3.16Å; S307-I310 PolarHBondContact O-N 2.96Å; S307-F311 WeakPolarHBondContact O-CD2 3.49Å |
| 308 | P | 89.3 | Confident | 88.2 | Confident | 24 Ų | 24 | 44.8 Ų | 44.8 | 16% | 0.156 | 24% | 0.239 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58 | -30.4 | 176.1 | -28.4 | 38.5 | 0 | 0 | 0 | 114.4 | L305 S306 I310 F311 L312 L350 Y353 | L305-P308 WeakPolarHBondContact O-CD 3.21Å; S306-P308 VanDerWaalsContact C-N 3.34Å; P308-I310 VanDerWaalsContact C-N 3.31Å; P308-I310 PolarHBondContact O-N 3.46Å; P308-F311 PolarHBondContact O-N 2.73Å; P308-F311 VanDerWaalsContact O-N 3.1Å; P308-L312 PolarHBondContact O-N 3.36Å; P308-L312 VanDerWaalsContact O-N 3.11Å; P308-L350 HydrophobicContact CB-CD1 3.97Å; P308-Y353 HydrophobicContact CB-CD1 3.49Å; P308-Y353 VanDerWaalsContact CB-CD1 3.49Å; P308-Y353 HydrophobicContact CB-CD2 4.1Å; P308-Y353 HydrophobicContact CB-CE1 3.63Å; P308-Y353 HydrophobicContact CB-CE2 4.21Å; P308-Y353 HydrophobicContact CB-CG 3.73Å; P308-Y353 HydrophobicContact CG-CD1 4.23Å; P308-Y353 HydrophobicContact CG-CD2 3.91Å; P308-Y353 HydrophobicContact CG-CE1 4.33Å; P308-Y353 HydrophobicContact CG-CE2 4.01Å; P308-Y353 HydrophobicContact CG-CG 4.02Å |
| 309 | E | 88.9 | Confident | 87.2 | Confident | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61 | -36.8 | -176.4 | -69.2 | -70.8 | 121.9 | 0 | 0 | 112.5 | I253 S306 S307 F311 L312 W313 Y353 R357 | I253-E309 VanDerWaalsContact CD1-CD 3.48Å; I253-E309 HydrophobicContact CD1-CG 3.63Å; I253-E309 WeakPolarHBondContact CD1-OE2 3.24Å; I253-E309 HydrophobicContact CG2-CG 4.49Å; S306-E309 WeakPolarHBondContact O-CB 3.36Å; S306-E309 PolarHBondContact O-N 3.02Å; S307-E309 PolarHBondContact O-N 3.16Å; E309-F311 PolarHBondContact O-N 3.25Å; E309-F311 VanDerWaalsContact O-N 3.11Å; E309-L312 PolarHBondContact O-N 3.2Å; E309-L312 VanDerWaalsContact O-N 3.08Å; E309-W313 VanDerWaalsContact O-CD1 3.29Å; E309-W313 PolarHBondContact O-N 3.17Å; E309-W313 VanDerWaalsContact O-N 3.14Å; E309-W313 PolarHBondContact OE2-NE1 2.97Å; E309-Y353 WeakPolarHBondContact OE1-CE1 3.33Å; E309-R357 WeakPolarHBondContact OE1-CD 3.46Å; E309-R357 IonicContact OE1-CZ 3.05Å; E309-R357 IonicContact OE1-NE 2.74Å; E309-R357 IonicContact OE1-NH1 3.84Å; E309-R357 PolarHBondContact OE1-NH1 3.04Å; E309-R357 VanDerWaalsContact OE1-NH1 3.12Å; E309-R357 IonicContact OE2-NH1 3.68Å; E309-R357 PolarHBondContact OE2-NH1 2.68Å |
| 310 | I | 88.1 | Confident | 85.7 | Confident | 51 Ų | 51 | 46.5 Ų | 46.5 | 26% | 0.262 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -58 | -30.6 | 178.4 | -61.3 | 174.5 | 0 | 0 | 0 | 111.7 | R246 Y250 S307 P308 L338 | R246-I310 HydrophobicContact CB-CG2 4.47Å; R246-I310 WeakPolarHBondContact CD-O 3.49Å; R246-I310 PolarHBondContact NH1-O 2.96Å; Y250-I310 HydrophobicContact CD1-CD1 4.03Å; Y250-I310 HydrophobicContact CD1-CG1 4.26Å; Y250-I310 HydrophobicContact CD2-CD1 3.63Å; Y250-I310 HydrophobicContact CD2-CG1 3.53Å; Y250-I310 HydrophobicContact CE1-CD1 4.15Å; Y250-I310 HydrophobicContact CE2-CD1 3.75Å; Y250-I310 HydrophobicContact CE2-CG1 4.17Å; Y250-I310 HydrophobicContact CG-CD1 3.76Å; Y250-I310 HydrophobicContact CG-CG1 3.56Å; S307-I310 PolarHBondContact O-N 2.96Å; P308-I310 VanDerWaalsContact C-N 3.31Å; P308-I310 PolarHBondContact O-N 3.46Å; I310-L338 HydrophobicContact CG2-CD2 4.28Å |
| 311 | F | 85.9 | Confident | 84 | Confident | 51 Ų | 51 | 46.1 Ų | 46.1 | 22% | 0.224 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -93 | -23.8 | -179.8 | -54 | -79.1 | 0 | 0 | 0 | 112.9 | S307 P308 E309 S336 L338 L342 L350 | S307-F311 WeakPolarHBondContact O-CD2 3.49Å; P308-F311 PolarHBondContact O-N 2.73Å; P308-F311 VanDerWaalsContact O-N 3.1Å; E309-F311 PolarHBondContact O-N 3.25Å; E309-F311 VanDerWaalsContact O-N 3.11Å; F311-S336 WeakPolarHBondContact O-CB 3.26Å; F311-S336 PolarHBondContact O-OG 3.2Å; F311-L338 HydrophobicContact CD1-CB 4.48Å; F311-L338 HydrophobicContact CD1-CD2 3.63Å; F311-L338 HydrophobicContact CD1-CG 3.73Å; F311-L338 HydrophobicContact CE1-CD2 3.77Å; F311-L338 HydrophobicContact CE1-CG 3.92Å; F311-L342 HydrophobicContact CD1-CD1 3.76Å; F311-L342 HydrophobicContact CD1-CD2 4.16Å; F311-L342 HydrophobicContact CE1-CD1 3.67Å; F311-L342 HydrophobicContact CE1-CD2 4.41Å; F311-L342 HydrophobicContact CG-CD2 4.31Å; F311-L342 HydrophobicContact CZ-CD1 4.48Å; F311-L350 HydrophobicContact CB-CD1 3.94Å; F311-L350 HydrophobicContact CB-CD2 3.84Å |
| 312 | L | 85.8 | Confident | 82.4 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -77 | -42.2 | -179.8 | -114.9 | 68.8 | 0 | 0 | 0 | 113.4 | P308 E309 I332 T333 L350 Y353 H354 | P308-L312 PolarHBondContact O-N 3.36Å; P308-L312 VanDerWaalsContact O-N 3.11Å; E309-L312 PolarHBondContact O-N 3.2Å; E309-L312 VanDerWaalsContact O-N 3.08Å; L312-I332 HydrophobicContact CB-CG2 4.08Å; L312-I332 HydrophobicContact CD2-CG2 3.74Å; L312-I332 HydrophobicContact CG-CG2 3.78Å; L312-I332 WeakPolarHBondContact O-CA 3.41Å; L312-T333 PolarHBondContact O-N 2.9Å; L312-L350 HydrophobicContact CD1-CD1 3.42Å; L312-L350 VanDerWaalsContact CD1-CD1 3.42Å; L312-L350 HydrophobicContact CD1-CD2 4.18Å; L312-L350 HydrophobicContact CD1-CG 3.55Å; L312-Y353 HydrophobicContact CD1-CD1 4.31Å; L312-Y353 HydrophobicContact CD2-CD1 3.97Å; L312-Y353 HydrophobicContact CD2-CE1 4.05Å; L312-H354 HydrophobicContact CD2-CB 4.47Å |
| 313 | W | 84.9 | Confident | 80.9 | Confident | 45 Ų | 45 | 53.3 Ų | 53.3 | 17% | 0.17 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.9 | 144 | -178.6 | -71 | 93.7 | 0 | 0 | 0 | 111.6 | R246 P249 E309 C330 I332 | R246-W313 PolarHBondContact NH1-O 3.01Å; R246-W313 PolarHBondContact NH2-O 3.44Å; P249-W313 HydrophobicContact CB-CD2 4.26Å; P249-W313 HydrophobicContact CB-CG 4.36Å; P249-W313 HydrophobicContact CB-CZ2 3.91Å; P249-W313 VanDerWaalsContact CB-NE1 3.26Å; P249-W313 HydrophobicContact CG-CD2 3.86Å; P249-W313 HydrophobicContact CG-CE3 4.48Å; P249-W313 HydrophobicContact CG-CG 4.12Å; P249-W313 HydrophobicContact CG-CH2 4.45Å; P249-W313 HydrophobicContact CG-CZ2 3.88Å; E309-W313 VanDerWaalsContact O-CD1 3.29Å; E309-W313 PolarHBondContact O-N 3.17Å; E309-W313 VanDerWaalsContact O-N 3.14Å; E309-W313 PolarHBondContact OE2-NE1 2.97Å; W313-C330 HydrophobicContact CE3-CB 3.77Å; W313-C330 HydrophobicContact CZ3-CB 3.82Å; W313-I332 HydrophobicContact CD2-CD1 4.33Å; W313-I332 HydrophobicContact CD2-CG1 3.78Å; W313-I332 HydrophobicContact CE3-CD1 4.12Å; W313-I332 HydrophobicContact CE3-CG1 3.88Å; W313-I332 HydrophobicContact CG-CG1 4.45Å; W313-I332 HydrophobicContact CH2-CD1 3.49Å; W313-I332 VanDerWaalsContact CH2-CD1 3.49Å; W313-I332 HydrophobicContact CH2-CG1 4.04Å; W313-I332 HydrophobicContact CZ2-CD1 3.66Å; W313-I332 HydrophobicContact CZ2-CG1 3.87Å; W313-I332 HydrophobicContact CZ3-CD1 3.7Å; W313-I332 HydrophobicContact CZ3-CG1 4.01Å |
| 314 | Q | 84.6 | Confident | 79.6 | Confident | 38 Ų | 38 | 54.2 Ų | 54.2 | 18% | 0.178 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146 | 154.8 | 166.7 | 68.1 | 174.5 | 9.1 | 0 | 0 | 111.7 | C245 T331 T333 P337 | C245-Q314 PolarHBondContact SG-O 3.16Å; C245-Q314 VanDerWaalsContact SG-O 3.39Å; Q314-T331 PolarHBondContact N-O 3.14Å; Q314-T331 PolarHBondContact O-N 3.48Å; Q314-T333 WeakPolarHBondContact CG-OG1 3.39Å; Q314-T333 PolarHBondContact NE2-OG1 2.98Å; Q314-T333 VanDerWaalsContact NE2-OG1 3.09Å; Q314-P337 VanDerWaalsContact OE1-CD 3.3Å |
| 315 | L | 83.6 | Confident | 78.5 | Confident | 52 Ų | 52 | 56.8 Ų | 56.8 | 27% | 0.272 | 33% | 0.328 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.8 | 131.4 | 167.9 | -160.4 | 73.7 | 0 | 0 | 0 | 110.2 | D242 C245 D328 | D242-L315 HydrophobicContact CB-CB 4.01Å; D242-L315 PolarHBondContact OD1-N 3.34Å; C245-L315 HydrophobicContact CB-CD1 4.27Å; L315-D328 HydrophobicContact CD1-CB 4.16Å |
| 316 | S | 78.1 | Confident | 77.4 | Confident | 46 Ų | 46 | 59.2 Ų | 59.2 | 32% | 0.322 | 34% | 0.34 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.7 | 140.4 | 175 | -174.9 | 0 | 0 | 0 | 0 | 109.7 | T329 | S316-T329 PolarHBondContact N-O 3.43Å; S316-T329 PolarHBondContact O-N 2.94Å |
| 317 | Q | 77 | Confident | 76.5 | Confident | 124 Ų | 124 | 60.6 Ų | 60.6 | 58% | 0.579 | 35% | 0.348 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -94.3 | 121 | 176.9 | -71.5 | -174 | -19.9 | 0 | 0 | 109.8 | D328 | Q317-D328 WeakPolarHBondContact CG-OD1 3.48Å; Q317-D328 PolarHBondContact NE2-OD1 3.48Å |
| 318 | A | 68.5 | Low | 75.8 | Confident | 44 Ų | 44 | 59.8 Ų | 59.8 | 36% | 0.364 | 34% | 0.341 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 144.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110 | S320 V327 | A318-S320 PolarHBondContact O-N 2.92Å; A318-V327 PolarHBondContact N-O 3.18Å; A318-V327 PolarHBondContact O-N 3.43Å |
| 319 | V | 72.1 | Confident | 75.2 | Confident | 85 Ų | 85 | 61 Ų | 61 | 52% | 0.515 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.5 | 119 | 170.9 | -178.4 | 0 | 0 | 0 | 0 | 108.2 | P321 M326 | V319-P321 WeakPolarHBondContact O-CD 3.23Å; V319-M326 HydrophobicContact CG2-CE 3.9Å; V319-M326 HydrophobicContact CG2-SD 3.72Å |
| 320 | S | 64.8 | Low | 75 | Confident | 23 Ų | 23 | 62 Ų | 62 | 16% | 0.161 | 35% | 0.354 | C | S | . | . | trans | -65.8 | 118.3 | 174.7 | 162.5 | 0 | 0 | 0 | 0 | 109.9 | A318 S322 T323 G324 R325 | A318-S320 PolarHBondContact O-N 2.92Å; S320-S322 PolarHBondContact O-N 3.25Å; S320-S322 PolarHBondContact OG-OG 2.99Å; S320-T323 VanDerWaalsContact CB-OG1 3.24Å; S320-T323 WeakPolarHBondContact CB-OG1 3.35Å; S320-T323 PolarHBondContact O-N 3.42Å; S320-T323 PolarHBondContact OG-OG1 3.46Å; S320-G324 WeakPolarHBondContact O-CA 3.18Å; S320-G324 PolarHBondContact O-N 3.25Å; S320-R325 PolarHBondContact N-O 2.89Å | ||
| 321 | P | 59.8 | Low | 74.8 | Confident | 96 Ų | 96 | 61.7 Ų | 61.7 | 62% | 0.623 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.9 | -18.6 | -175.2 | 26.9 | -34 | 0 | 0 | 0 | 113.3 | V319 E449 | V319-P321 WeakPolarHBondContact O-CD 3.23Å; P321-E449 WeakPolarHBondContact CG-OE2 3.44Å |
| 322 | S | 59.7 | Low | 74.6 | Confident | 107 Ų | 107 | 61.6 Ų | 61.6 | 75% | 0.748 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -16.1 | 175.6 | 54.9 | 0 | 0 | 0 | 0 | 114.5 | S320 | S320-S322 PolarHBondContact O-N 3.25Å; S320-S322 PolarHBondContact OG-OG 2.99Å |
| 323 | T | 64.2 | Low | 74.2 | Confident | 85 Ų | 85 | 63 Ų | 63 | 52% | 0.521 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -132.9 | -9.6 | -174.6 | 63.9 | 0 | 0 | 0 | 0 | 115.1 | S320 R325 | S320-T323 VanDerWaalsContact CB-OG1 3.24Å; S320-T323 WeakPolarHBondContact CB-OG1 3.35Å; S320-T323 PolarHBondContact O-N 3.42Å; S320-T323 PolarHBondContact OG-OG1 3.46Å; T323-R325 PolarHBondContact O-N 3.38Å; T323-R325 VanDerWaalsContact O-N 3.15Å |
| 324 | G | 67.2 | Low | 73.5 | Confident | 60 Ų | 60 | 63 Ų | 63 | 62% | 0.619 | 37% | 0.37 | S | S | * | . | trans | 66.4 | 6.6 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | S320 | S320-G324 WeakPolarHBondContact O-CA 3.18Å; S320-G324 PolarHBondContact O-N 3.25Å | ||
| 325 | R | 69.8 | Low | 72.7 | Confident | 173 Ų | 173 | 65.6 Ų | 65.6 | 65% | 0.653 | 39% | 0.393 | S | S | * | . | trans | -97.5 | 147.4 | -175.4 | -72.7 | 179.7 | 166.9 | -172.7 | -5.4 | 112.2 | S320 T323 V327 | S320-R325 PolarHBondContact N-O 2.89Å; T323-R325 PolarHBondContact O-N 3.38Å; T323-R325 VanDerWaalsContact O-N 3.15Å; R325-V327 PolarHBondContact O-N 3.34Å | ||
| 326 | M | 69.3 | Low | 72.1 | Confident | 103 Ų | 103 | 63.2 Ų | 63.2 | 51% | 0.507 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.4 | 122.3 | 168.7 | -66.6 | -67.7 | -176.4 | 0 | 0 | 110.2 | V319 | V319-M326 HydrophobicContact CG2-CE 3.9Å; V319-M326 HydrophobicContact CG2-SD 3.72Å |
| 327 | V | 73.9 | Confident | 71.8 | Confident | 29 Ų | 29 | 65.3 Ų | 65.3 | 18% | 0.176 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 138.1 | 178.5 | 171.5 | 0 | 0 | 0 | 0 | 109.5 | A318 R325 T329 | A318-V327 PolarHBondContact N-O 3.18Å; A318-V327 PolarHBondContact O-N 3.43Å; R325-V327 PolarHBondContact O-N 3.34Å; V327-T329 PolarHBondContact O-N 2.97Å |
| 328 | D | 77.4 | Confident | 71.5 | Confident | 19 Ų | 19 | 62.7 Ų | 62.7 | 10% | 0.102 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.1 | 88.6 | -175.6 | -53.9 | -76 | 0 | 0 | 0 | 110.8 | R237 R238 L315 Q317 | R237-D328 WeakPolarHBondContact CD-OD2 3.39Å; R237-D328 IonicContact CZ-OD2 3.72Å; R237-D328 IonicContact NE-OD2 2.98Å; R237-D328 IonicContact NH1-OD1 3.58Å; R237-D328 IonicContact NH1-OD2 2.82Å; R237-D328 PolarHBondContact NH1-OD2 2.85Å; R238-D328 HydrophobicContact CB-CB 4.48Å; R238-D328 WeakPolarHBondContact CD-O 3.45Å; R238-D328 PolarHBondContact NH1-O 3.38Å; L315-D328 HydrophobicContact CD1-CB 4.16Å; Q317-D328 WeakPolarHBondContact CG-OD1 3.48Å; Q317-D328 PolarHBondContact NE2-OD1 3.48Å |
| 329 | T | 76.6 | Confident | 71.8 | Confident | 50 Ų | 50 | 60.6 Ų | 60.6 | 31% | 0.307 | 37% | 0.366 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.3 | 148.5 | -175.7 | -62.6 | 0 | 0 | 0 | 0 | 111.5 | S316 V327 T331 | S316-T329 PolarHBondContact N-O 3.43Å; S316-T329 PolarHBondContact O-N 2.94Å; V327-T329 PolarHBondContact O-N 2.97Å; T329-T331 HydrophobicContact CG2-CG2 4.17Å |
| 330 | C | 84.1 | Confident | 71.8 | Confident | 20 Ų | 20 | 63.8 Ų | 63.8 | 14% | 0.135 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.9 | 124 | 169.7 | -76.2 | 0 | 0 | 0 | 0 | 109.7 | R238 C245 W313 | R238-C330 PolarHBondContact NE-SG 3.4Å; C245-C330 WeakPolarHBondContact CA-SG 3.24Å; C245-C330 HydrophobicContact CB-CB 4.46Å; C245-C330 WeakPolarHBondContact CB-SG 3.42Å; C245-C330 WeakPolarHBondContact SG-CA 3.49Å; C245-C330 WeakPolarHBondContact SG-CB 3.28Å; C245-C330 CovalentContact SG-SG 2.03Å; C245-C330 PolarHBondContact SG-SG 3.42Å; W313-C330 HydrophobicContact CE3-CB 3.77Å; W313-C330 HydrophobicContact CZ3-CB 3.82Å |
| 331 | T | 82.9 | Confident | 72.5 | Confident | 45 Ų | 45 | 72.5 Ų | 72.5 | 28% | 0.276 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 146.5 | 177.7 | 55.4 | 0 | 0 | 0 | 0 | 110.6 | Q314 T329 | Q314-T331 PolarHBondContact N-O 3.14Å; Q314-T331 PolarHBondContact O-N 3.48Å; T329-T331 HydrophobicContact CG2-CG2 4.17Å |
| 332 | I | 82.9 | Confident | 73.6 | Confident | 50 Ų | 50 | 69.6 Ų | 69.6 | 26% | 0.256 | 39% | 0.389 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.8 | 124.8 | 170.4 | -60.1 | 107.8 | 0 | 0 | 0 | 108.7 | L312 W313 | L312-I332 HydrophobicContact CB-CG2 4.08Å; L312-I332 HydrophobicContact CD2-CG2 3.74Å; L312-I332 HydrophobicContact CG-CG2 3.78Å; L312-I332 WeakPolarHBondContact O-CA 3.41Å; W313-I332 HydrophobicContact CD2-CD1 4.33Å; W313-I332 HydrophobicContact CD2-CG1 3.78Å; W313-I332 HydrophobicContact CE3-CD1 4.12Å; W313-I332 HydrophobicContact CE3-CG1 3.88Å; W313-I332 HydrophobicContact CG-CG1 4.45Å; W313-I332 HydrophobicContact CH2-CD1 3.49Å; W313-I332 VanDerWaalsContact CH2-CD1 3.49Å; W313-I332 HydrophobicContact CH2-CG1 4.04Å; W313-I332 HydrophobicContact CZ2-CD1 3.66Å; W313-I332 HydrophobicContact CZ2-CG1 3.87Å; W313-I332 HydrophobicContact CZ3-CD1 3.7Å; W313-I332 HydrophobicContact CZ3-CG1 4.01Å |
| 333 | T | 77.1 | Confident | 74.8 | Confident | 30 Ų | 30 | 68.3 Ų | 68.3 | 18% | 0.184 | 38% | 0.378 | C | S | . | . | trans | -148.3 | 133 | 177.9 | 54.6 | 0 | 0 | 0 | 0 | 110.7 | L312 Q314 S335 | L312-T333 PolarHBondContact O-N 2.9Å; Q314-T333 WeakPolarHBondContact CG-OG1 3.39Å; Q314-T333 PolarHBondContact NE2-OG1 2.98Å; Q314-T333 VanDerWaalsContact NE2-OG1 3.09Å; T333-S335 PolarHBondContact O-N 3.07Å | ||
| 334 | P | 70.6 | Confident | 75.7 | Confident | 43 Ų | 43 | 71 Ų | 71 | 28% | 0.279 | 39% | 0.389 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.2 | -22.9 | 177.7 | 27.2 | -34.5 | 0 | 0 | 0 | 113.4 | S336 S339 L351 | P334-S336 VanDerWaalsContact C-N 3.32Å; P334-S336 PolarHBondContact O-N 3.37Å; P334-S339 WeakPolarHBondContact O-CB 3.47Å; P334-S339 PolarHBondContact O-OG 2.86Å; P334-L351 HydrophobicContact CB-CD1 3.77Å; P334-L351 HydrophobicContact CB-CG 4.31Å |
| 335 | S | 67.8 | Low | 76.6 | Confident | 94 Ų | 94 | 72 Ų | 72 | 66% | 0.657 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.7 | 23.5 | -176.6 | 49.4 | 0 | 0 | 0 | 0 | 114.7 | T333 | T333-S335 PolarHBondContact O-N 3.07Š|
| 336 | S | 71.3 | Confident | 77.3 | Confident | 1 Ų | 1 | 67.9 Ų | 67.9 | 1% | 0.007 | 38% | 0.377 | C | S | . | . | trans | -61.4 | 148.3 | 179.6 | 84 | 0 | 0 | 0 | 0 | 112 | F311 P334 L338 S339 L340 | F311-S336 WeakPolarHBondContact O-CB 3.26Å; F311-S336 PolarHBondContact O-OG 3.2Å; P334-S336 VanDerWaalsContact C-N 3.32Å; P334-S336 PolarHBondContact O-N 3.37Å; S336-L338 PolarHBondContact O-N 3.41Å; S336-L338 VanDerWaalsContact O-N 3.12Å; S336-S339 WeakPolarHBondContact O-CA 3.49Å; S336-S339 WeakPolarHBondContact O-CB 3.4Å; S336-S339 PolarHBondContact O-N 2.89Å; S336-S339 WeakPolarHBondContact OG-CB 3.36Å; S336-S339 PolarHBondContact OG-N 2.99Å; S336-L340 PolarHBondContact O-N 2.9Å | ||
| 337 | P | 70.7 | Confident | 77.9 | Confident | 91 Ų | 91 | 66.1 Ų | 66.1 | 59% | 0.591 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -24 | -178 | 24.1 | -34.1 | 0 | 0 | 0 | 113 | Q314 | Q314-P337 VanDerWaalsContact OE1-CD 3.3Š|
| 338 | L | 71.3 | Confident | 78.5 | Confident | 68 Ų | 68 | 67.1 Ų | 67.1 | 36% | 0.356 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | -34.9 | 173.7 | -167.4 | 66.9 | 0 | 0 | 0 | 112 | I310 F311 S336 L340 Y341 L342 | I310-L338 HydrophobicContact CG2-CD2 4.28Å; F311-L338 HydrophobicContact CD1-CB 4.48Å; F311-L338 HydrophobicContact CD1-CD2 3.63Å; F311-L338 HydrophobicContact CD1-CG 3.73Å; F311-L338 HydrophobicContact CE1-CD2 3.77Å; F311-L338 HydrophobicContact CE1-CG 3.92Å; S336-L338 PolarHBondContact O-N 3.41Å; S336-L338 VanDerWaalsContact O-N 3.12Å; L338-L340 PolarHBondContact O-N 3.36Å; L338-Y341 PolarHBondContact O-N 3.17Å; L338-Y341 VanDerWaalsContact O-N 3.16Å; L338-L342 WeakPolarHBondContact O-CD1 3.33Å |
| 339 | S | 74.3 | Confident | 78.9 | Confident | 1 Ų | 1 | 70.9 Ų | 70.9 | 1% | 0.007 | 40% | 0.396 | C | S | . | . | G | 310 helix | trans | -59.7 | -32.4 | 174.5 | -176.5 | 0 | 0 | 0 | 0 | 112.5 | P334 S336 Y341 L342 H347 L350 | P334-S339 WeakPolarHBondContact O-CB 3.47Å; P334-S339 PolarHBondContact O-OG 2.86Å; S336-S339 WeakPolarHBondContact O-CA 3.49Å; S336-S339 WeakPolarHBondContact O-CB 3.4Å; S336-S339 PolarHBondContact O-N 2.89Å; S336-S339 WeakPolarHBondContact OG-CB 3.36Å; S336-S339 PolarHBondContact OG-N 2.99Å; S339-Y341 PolarHBondContact O-N 3.3Å; S339-L342 PolarHBondContact O-N 3.27Å; S339-H347 PolarHBondContact OG-CE1 3.42Å; S339-H347 VanDerWaalsContact OG-CE1 3.26Å; S339-H347 PolarHBondContact OG-ND1 2.91Å; S339-L350 VanDerWaalsContact OG-CD2 3.29Å; S339-L350 WeakPolarHBondContact OG-CD2 3.33Å |
| 340 | L | 73.1 | Confident | 79.4 | Confident | 151 Ų | 151 | 68.9 Ų | 68.9 | 79% | 0.791 | 38% | 0.383 | S | S | * | . | G | 310 helix | trans | -73.4 | -10.5 | 178.7 | -163.9 | 134.4 | 0 | 0 | 0 | 113.9 | S336 L338 | S336-L340 PolarHBondContact O-N 2.9Å; L338-L340 PolarHBondContact O-N 3.36Å |
| 341 | Y | 79.4 | Confident | 79.4 | Confident | 206 Ų | 206 | 71.7 Ų | 71.7 | 81% | 0.808 | 40% | 0.396 | S | S | * | . | G | 310 helix | trans | -92.8 | -0.1 | 175.1 | -119.9 | -87.4 | 0 | 0 | 0 | 113.6 | L338 S339 | L338-Y341 PolarHBondContact O-N 3.17Å; L338-Y341 VanDerWaalsContact O-N 3.16Å; S339-Y341 PolarHBondContact O-N 3.3Å |
| 342 | L | 81.3 | Confident | 79.7 | Confident | 36 Ų | 36 | 77.3 Ų | 77.3 | 19% | 0.188 | 41% | 0.412 | C | S | . | . | S | Bend | trans | -90.3 | 147.5 | 180 | -88.2 | 58.9 | 0 | 0 | 0 | 111.3 | F311 L338 S339 L346 | F311-L342 HydrophobicContact CD1-CD1 3.76Å; F311-L342 HydrophobicContact CD1-CD2 4.16Å; F311-L342 HydrophobicContact CE1-CD1 3.67Å; F311-L342 HydrophobicContact CE1-CD2 4.41Å; F311-L342 HydrophobicContact CG-CD2 4.31Å; F311-L342 HydrophobicContact CZ-CD1 4.48Å; L338-L342 WeakPolarHBondContact O-CD1 3.33Å; S339-L342 PolarHBondContact O-N 3.27Å; L342-L346 HydrophobicContact CB-CB 4.25Å; L342-L346 HydrophobicContact CD2-CB 4.03Å; L342-L346 HydrophobicContact CG-CB 4.35Å; L342-L346 HydrophobicContact CG-CD1 4.46Å |
| 343 | P | 86.4 | Confident | 79.9 | Confident | 79 Ų | 79 | 76.1 Ų | 76.1 | 51% | 0.513 | 41% | 0.405 | S | S | . | . | trans | -57.5 | 147 | 166.7 | -23.2 | 33.6 | 0 | 0 | 0 | 112.2 | S345 L346 H347 | P343-S345 PolarHBondContact O-N 3Å; P343-L346 WeakPolarHBondContact O-CA 3.2Å; P343-L346 PolarHBondContact O-N 3.41Å; P343-H347 PolarHBondContact O-N 3.02Å; P343-H347 VanDerWaalsContact O-N 3.12Å | ||
| 344 | D | 83.3 | Confident | 80.4 | Confident | 143 Ų | 143 | 77.8 Ų | 77.8 | 77% | 0.765 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -54 | -36.3 | -172.9 | -41.6 | -67.5 | 0 | 0 | 0 | 113 | L346 H347 S348 | D344-L346 VanDerWaalsContact C-N 3.34Å; D344-L346 PolarHBondContact O-N 3.12Å; D344-H347 PolarHBondContact O-N 2.92Å; D344-S348 PolarHBondContact O-N 3.49Å |
| 345 | S | 84.6 | Confident | 81.1 | Confident | 81 Ų | 81 | 83.3 Ų | 83.3 | 57% | 0.566 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -60.3 | -39 | 175.7 | 57.8 | 0 | 0 | 0 | 0 | 113.2 | P343 S348 L349 | P343-S345 PolarHBondContact O-N 3Å; S345-S348 PolarHBondContact O-OG 3.46Å; S345-L349 PolarHBondContact O-N 2.92Å |
| 346 | L | 84.2 | Confident | 82 | Confident | 86 Ų | 86 | 80 Ų | 80 | 45% | 0.45 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -77.1 | -35.2 | 175.3 | -59.5 | -171.3 | 0 | 0 | 0 | 111.6 | L342 P343 D344 S348 L349 L350 | L342-L346 HydrophobicContact CB-CB 4.25Å; L342-L346 HydrophobicContact CD2-CB 4.03Å; L342-L346 HydrophobicContact CG-CB 4.35Å; L342-L346 HydrophobicContact CG-CD1 4.46Å; P343-L346 WeakPolarHBondContact O-CA 3.2Å; P343-L346 PolarHBondContact O-N 3.41Å; D344-L346 VanDerWaalsContact C-N 3.34Å; D344-L346 PolarHBondContact O-N 3.12Å; L346-S348 VanDerWaalsContact C-N 3.33Å; L346-S348 PolarHBondContact O-N 3.39Å; L346-L349 WeakPolarHBondContact O-CB 3.37Å; L346-L349 PolarHBondContact O-N 2.94Å; L346-L349 VanDerWaalsContact O-N 3.09Å; L346-L350 PolarHBondContact O-N 3.47Å |
| 347 | H | 83.8 | Confident | 82.7 | Confident | 65 Ų | 65 | 81.9 Ų | 81.9 | 30% | 0.301 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61.5 | -42 | 173.2 | -166.8 | 82.3 | 0 | 0 | 0 | 111.2 | S339 P343 D344 L349 L350 L351 | S339-H347 PolarHBondContact OG-CE1 3.42Å; S339-H347 VanDerWaalsContact OG-CE1 3.26Å; S339-H347 PolarHBondContact OG-ND1 2.91Å; P343-H347 PolarHBondContact O-N 3.02Å; P343-H347 VanDerWaalsContact O-N 3.12Å; D344-H347 PolarHBondContact O-N 2.92Å; H347-L349 PolarHBondContact O-N 3.18Å; H347-L350 WeakPolarHBondContact O-CB 3.49Å; H347-L350 PolarHBondContact O-N 2.93Å; H347-L350 VanDerWaalsContact O-N 3.09Å; H347-L351 WeakPolarHBondContact NE2-CD1 3.46Å; H347-L351 PolarHBondContact O-N 3.48Å |
| 348 | S | 85.5 | Confident | 83.4 | Confident | 51 Ų | 51 | 80.6 Ų | 80.6 | 36% | 0.357 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -61.3 | -29.7 | 173.1 | 87.4 | 0 | 0 | 0 | 0 | 113.6 | D344 S345 L346 R352 | D344-S348 PolarHBondContact O-N 3.49Å; S345-S348 PolarHBondContact O-OG 3.46Å; L346-S348 VanDerWaalsContact C-N 3.33Å; L346-S348 PolarHBondContact O-N 3.39Å; S348-R352 WeakPolarHBondContact O-CG 3.2Å; S348-R352 PolarHBondContact O-N 3.47Å; S348-R352 PolarHBondContact O-NE 2.79Å; S348-R352 PolarHBondContact OG-NH2 3.49Å |
| 349 | L | 85.9 | Confident | 84.2 | Confident | 98 Ų | 98 | 84.5 Ų | 84.5 | 51% | 0.513 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -77.7 | -36.3 | 175.7 | -176.8 | 63.9 | 0 | 0 | 0 | 110.5 | S345 L346 H347 R352 Y353 | S345-L349 PolarHBondContact O-N 2.92Å; L346-L349 WeakPolarHBondContact O-CB 3.37Å; L346-L349 PolarHBondContact O-N 2.94Å; L346-L349 VanDerWaalsContact O-N 3.09Å; H347-L349 PolarHBondContact O-N 3.18Å; L349-R352 PolarHBondContact O-N 3.31Å; L349-Y353 WeakPolarHBondContact O-CB 3.27Å; L349-Y353 PolarHBondContact O-N 3.07Å |
| 350 | L | 86.2 | Confident | 84.9 | Confident | 8 Ų | 8 | 89.2 Ų | 89.2 | 4% | 0.042 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -66.6 | -42.2 | 179 | -161.6 | 71.9 | 0 | 0 | 0 | 112.3 | P308 F311 L312 S339 L346 H347 Y353 H354 | P308-L350 HydrophobicContact CB-CD1 3.97Å; F311-L350 HydrophobicContact CB-CD1 3.94Å; F311-L350 HydrophobicContact CB-CD2 3.84Å; L312-L350 HydrophobicContact CD1-CD1 3.42Å; L312-L350 VanDerWaalsContact CD1-CD1 3.42Å; L312-L350 HydrophobicContact CD1-CD2 4.18Å; L312-L350 HydrophobicContact CD1-CG 3.55Å; S339-L350 VanDerWaalsContact OG-CD2 3.29Å; S339-L350 WeakPolarHBondContact OG-CD2 3.33Å; L346-L350 PolarHBondContact O-N 3.47Å; H347-L350 WeakPolarHBondContact O-CB 3.49Å; H347-L350 PolarHBondContact O-N 2.93Å; H347-L350 VanDerWaalsContact O-N 3.09Å; L350-Y353 PolarHBondContact O-N 3.26Å; L350-H354 WeakPolarHBondContact O-CB 3.42Å; L350-H354 PolarHBondContact O-N 3.11Å |
| 351 | L | 85.9 | Confident | 85.6 | Confident | 79 Ų | 79 | 82.6 Ų | 82.6 | 41% | 0.414 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -63 | -43.3 | 173 | -94.2 | 65.1 | 0 | 0 | 0 | 112 | P334 H347 Y353 H354 Q355 | P334-L351 HydrophobicContact CB-CD1 3.77Å; P334-L351 HydrophobicContact CB-CG 4.31Å; H347-L351 WeakPolarHBondContact NE2-CD1 3.46Å; H347-L351 PolarHBondContact O-N 3.48Å; L351-Y353 VanDerWaalsContact C-N 3.33Å; L351-Y353 PolarHBondContact O-N 2.65Å; L351-H354 WeakPolarHBondContact O-CB 3.28Å; L351-H354 PolarHBondContact O-N 2.83Å; L351-Q355 PolarHBondContact O-N 2.87Å |
| 352 | R | 87.8 | Confident | 86.1 | Confident | 163 Ų | 163 | 75.9 Ų | 75.9 | 62% | 0.615 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -65.4 | -36.6 | 175.6 | -76.3 | 179.4 | -73.4 | 168.4 | -7.1 | 112.3 | S348 L349 G356 | S348-R352 WeakPolarHBondContact O-CG 3.2Å; S348-R352 PolarHBondContact O-N 3.47Å; S348-R352 PolarHBondContact O-NE 2.79Å; S348-R352 PolarHBondContact OG-NH2 3.49Å; L349-R352 PolarHBondContact O-N 3.31Å; R352-G356 PolarHBondContact O-N 3Å |
| 353 | Y | 88.1 | Confident | 86.5 | Confident | 24 Ų | 24 | 75.4 Ų | 75.4 | 9% | 0.094 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -64.6 | -47.1 | 172.1 | -176.9 | -91.5 | 0 | 0 | 0 | 111.2 | P308 E309 L312 L349 L350 L351 Q355 G356 R357 W360 | P308-Y353 HydrophobicContact CB-CD1 3.49Å; P308-Y353 VanDerWaalsContact CB-CD1 3.49Å; P308-Y353 HydrophobicContact CB-CD2 4.1Å; P308-Y353 HydrophobicContact CB-CE1 3.63Å; P308-Y353 HydrophobicContact CB-CE2 4.21Å; P308-Y353 HydrophobicContact CB-CG 3.73Å; P308-Y353 HydrophobicContact CG-CD1 4.23Å; P308-Y353 HydrophobicContact CG-CD2 3.91Å; P308-Y353 HydrophobicContact CG-CE1 4.33Å; P308-Y353 HydrophobicContact CG-CE2 4.01Å; P308-Y353 HydrophobicContact CG-CG 4.02Å; E309-Y353 WeakPolarHBondContact OE1-CE1 3.33Å; L312-Y353 HydrophobicContact CD1-CD1 4.31Å; L312-Y353 HydrophobicContact CD2-CD1 3.97Å; L312-Y353 HydrophobicContact CD2-CE1 4.05Å; L349-Y353 WeakPolarHBondContact O-CB 3.27Å; L349-Y353 PolarHBondContact O-N 3.07Å; L350-Y353 PolarHBondContact O-N 3.26Å; L351-Y353 VanDerWaalsContact C-N 3.33Å; L351-Y353 PolarHBondContact O-N 2.65Å; Y353-Q355 PolarHBondContact O-N 2.7Å; Y353-G356 CarbonylContact O-C 3.46Å; Y353-G356 PolarHBondContact O-N 2.83Å; Y353-R357 HydrophobicContact CE1-CB 4.28Å; Y353-R357 HydrophobicContact CE1-CG 3.88Å; Y353-R357 VanDerWaalsContact O-CA 3.28Å; Y353-R357 WeakPolarHBondContact O-CA 3.29Å; Y353-R357 VanDerWaalsContact O-CB 3.3Å; Y353-R357 WeakPolarHBondContact O-CB 3.43Å; Y353-R357 PolarHBondContact O-N 3.31Å; Y353-W360 AromaticContact CE2-CD1 3.8Å; Y353-W360 HydrophobicContact CE2-CG 4.24Å |
| 354 | H | 87.3 | Confident | 86.7 | Confident | 66 Ų | 66 | 73.2 Ų | 73.2 | 31% | 0.306 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -53.8 | -53.7 | 177 | -179.8 | -87.7 | 0 | 0 | 0 | 111.9 | L312 L350 L351 G356 R357 | L312-H354 HydrophobicContact CD2-CB 4.47Å; L350-H354 WeakPolarHBondContact O-CB 3.42Å; L350-H354 PolarHBondContact O-N 3.11Å; L351-H354 WeakPolarHBondContact O-CB 3.28Å; L351-H354 PolarHBondContact O-N 2.83Å; H354-G356 VanDerWaalsContact C-N 3.31Å; H354-G356 PolarHBondContact O-N 3.26Å; H354-R357 PolarHBondContact O-N 3.36Å |
| 355 | Q | 85.3 | Confident | 87 | Confident | 158 Ų | 158 | 66.4 Ų | 66.4 | 74% | 0.738 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -65 | -34.8 | 178.7 | -164.4 | 67.9 | 1.3 | 0 | 0 | 112.7 | L351 Y353 | L351-Q355 PolarHBondContact O-N 2.87Å; Y353-Q355 PolarHBondContact O-N 2.7Å |
| 356 | G | 85.8 | Confident | 87.3 | Confident | 26 Ų | 26 | 63.7 Ų | 63.7 | 27% | 0.268 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -85.3 | -9.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | R352 Y353 H354 M358 W359 W360 | R352-G356 PolarHBondContact O-N 3Å; Y353-G356 CarbonylContact O-C 3.46Å; Y353-G356 PolarHBondContact O-N 2.83Å; H354-G356 VanDerWaalsContact C-N 3.31Å; H354-G356 PolarHBondContact O-N 3.26Å; G356-M358 PolarHBondContact O-N 2.93Å; G356-W359 CarbonylContact O-C 3.59Å; G356-W359 WeakPolarHBondContact O-CB 3.39Å; G356-W359 PolarHBondContact O-N 3.41Å; G356-W359 VanDerWaalsContact O-N 3.11Å; G356-W360 WeakPolarHBondContact O-CB 3.4Å; G356-W360 PolarHBondContact O-N 2.89Å |
| 357 | R | 87.1 | Confident | 87.7 | Confident | 39 Ų | 39 | 61.1 Ų | 61.1 | 15% | 0.147 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -58 | -46.9 | -158 | -176.3 | 175.5 | 63.1 | 161.5 | 2.5 | 114.3 | E309 Y353 H354 W359 W360 C361 | E309-R357 WeakPolarHBondContact OE1-CD 3.46Å; E309-R357 IonicContact OE1-CZ 3.05Å; E309-R357 IonicContact OE1-NE 2.74Å; E309-R357 IonicContact OE1-NH1 3.84Å; E309-R357 PolarHBondContact OE1-NH1 3.04Å; E309-R357 VanDerWaalsContact OE1-NH1 3.12Å; E309-R357 IonicContact OE2-NH1 3.68Å; E309-R357 PolarHBondContact OE2-NH1 2.68Å; Y353-R357 HydrophobicContact CE1-CB 4.28Å; Y353-R357 HydrophobicContact CE1-CG 3.88Å; Y353-R357 VanDerWaalsContact O-CA 3.28Å; Y353-R357 WeakPolarHBondContact O-CA 3.29Å; Y353-R357 VanDerWaalsContact O-CB 3.3Å; Y353-R357 WeakPolarHBondContact O-CB 3.43Å; Y353-R357 PolarHBondContact O-N 3.31Å; H354-R357 PolarHBondContact O-N 3.36Å; R357-W359 VanDerWaalsContact C-N 3.33Å; R357-W359 PolarHBondContact O-N 3.09Å; R357-W360 PolarHBondContact O-N 2.79Å; R357-C361 PolarHBondContact O-N 2.93Å; R357-C361 PolarHBondContact O-SG 3.43Å |
| 358 | M | 85.1 | Confident | 88 | Confident | 64 Ų | 64 | 62.2 Ų | 62.2 | 32% | 0.315 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.7 | -44.8 | -178.7 | -58 | -51.8 | -151.6 | 0 | 0 | 110.9 | G356 F362 N437 | G356-M358 PolarHBondContact O-N 2.93Å; M358-F362 WeakPolarHBondContact O-CB 3.43Å; M358-F362 PolarHBondContact O-N 3.42Å; M358-N437 HydrophobicContact CE-CB 3.84Å; M358-N437 HydrophobicContact SD-CB 3.95Å |
| 359 | W | 88.1 | Confident | 88.3 | Confident | 150 Ų | 150 | 59.8 Ų | 59.8 | 57% | 0.568 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -67 | -36.7 | 176 | -56.9 | 103.4 | 0 | 0 | 0 | 112.5 | G356 R357 G363 | G356-W359 CarbonylContact O-C 3.59Å; G356-W359 WeakPolarHBondContact O-CB 3.39Å; G356-W359 PolarHBondContact O-N 3.41Å; G356-W359 VanDerWaalsContact O-N 3.11Å; R357-W359 VanDerWaalsContact C-N 3.33Å; R357-W359 PolarHBondContact O-N 3.09Å; W359-G363 WeakPolarHBondContact O-CA 3.2Å; W359-G363 PolarHBondContact O-N 2.94Å |
| 360 | W | 88.9 | Confident | 88.5 | Confident | 100 Ų | 100 | 56.3 Ų | 56.3 | 38% | 0.379 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -65.8 | -47.4 | 175.9 | -179.3 | -91.1 | 0 | 0 | 0 | 111.7 | L305 Y353 G356 R357 G363 C364 | L305-W360 HydrophobicContact CD2-CZ2 3.87Å; L305-W360 HydrophobicContact CG-CZ2 4.02Å; Y353-W360 AromaticContact CE2-CD1 3.8Å; Y353-W360 HydrophobicContact CE2-CG 4.24Å; G356-W360 WeakPolarHBondContact O-CB 3.4Å; G356-W360 PolarHBondContact O-N 2.89Å; R357-W360 PolarHBondContact O-N 2.79Å; W360-G363 PolarHBondContact O-N 3.11Å; W360-C364 HydrophobicContact CD2-CB 4.44Å; W360-C364 VanDerWaalsContact O-CB 3.23Å; W360-C364 WeakPolarHBondContact O-CB 3.42Å; W360-C364 PolarHBondContact O-N 3.25Å |
| 361 | C | 88 | Confident | 88.8 | Confident | 13 Ų | 13 | 61 Ų | 61 | 9% | 0.088 | 30% | 0.295 | C | S | . | . | I | π-helix | trans | -66.6 | -47.8 | 179.8 | -63 | 0 | 0 | 0 | 0 | 111 | R357 G363 Y365 F366 | R357-C361 PolarHBondContact O-N 2.93Å; R357-C361 PolarHBondContact O-SG 3.43Å; C361-G363 VanDerWaalsContact C-N 3.35Å; C361-G363 PolarHBondContact O-N 2.86Å; C361-Y365 HydrophobicContact CB-CD2 4.18Å; C361-Y365 WeakPolarHBondContact O-CA 3.46Å; C361-Y365 WeakPolarHBondContact O-CB 3.05Å; C361-Y365 PolarHBondContact O-N 3.16Å; C361-F366 PolarHBondContact O-N 3.41Å; C361-F366 VanDerWaalsContact O-N 3.11Å |
| 362 | F | 89.9 | Confident | 89.2 | Confident | 64 Ų | 64 | 60.6 Ų | 60.6 | 28% | 0.281 | 29% | 0.29 | S | S | . | . | I | π-helix | trans | -63.2 | -37.6 | 175.8 | 178.8 | -113.4 | 0 | 0 | 0 | 113.1 | M358 F366 C367 H434 I438 | M358-F362 WeakPolarHBondContact O-CB 3.43Å; M358-F362 PolarHBondContact O-N 3.42Å; F362-F366 HydrophobicContact CD2-CB 4.33Å; F362-F366 AromaticContact CD2-CD1 3.91Å; F362-F366 HydrophobicContact CD2-CD1 3.91Å; F362-F366 HydrophobicContact CD2-CG 4.39Å; F362-F366 AromaticContact CE2-CD1 3.75Å; F362-F366 HydrophobicContact CE2-CD1 3.75Å; F362-F366 HydrophobicContact CE2-CE1 4.19Å; F362-F366 WeakPolarHBondContact O-CB 3.3Å; F362-C367 VanDerWaalsContact CE1-SG 3.52Å; F362-C367 WeakPolarHBondContact CZ-SG 3.44Å; F362-C367 WeakPolarHBondContact O-CB 3.26Å; F362-C367 PolarHBondContact O-N 3.43Å; F362-C367 PolarHBondContact O-SG 3.02Å; F362-H434 HydrophobicContact CD2-CB 3.9Å; F362-I438 HydrophobicContact CB-CD1 3.78Å; F362-I438 HydrophobicContact CD1-CD1 3.57Å; F362-I438 HydrophobicContact CD2-CD1 3.79Å; F362-I438 HydrophobicContact CE1-CD1 4.01Å; F362-I438 HydrophobicContact CE2-CD1 4.21Å; F362-I438 HydrophobicContact CG-CD1 3.43Å; F362-I438 VanDerWaalsContact CG-CD1 3.43Å; F362-I438 HydrophobicContact CZ-CD1 4.31Å |
| 363 | G | 90.4 | Very high | 89.4 | Confident | 27 Ų | 27 | 52.8 Ų | 52.8 | 28% | 0.278 | 26% | 0.261 | S | S | . | . | I | π-helix | trans | -74.6 | -57.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | W359 W360 C361 L368 | W359-G363 WeakPolarHBondContact O-CA 3.2Å; W359-G363 PolarHBondContact O-N 2.94Å; W360-G363 PolarHBondContact O-N 3.11Å; C361-G363 VanDerWaalsContact C-N 3.35Å; C361-G363 PolarHBondContact O-N 2.86Å; G363-L368 VanDerWaalsContact O-CB 3.31Å; G363-L368 WeakPolarHBondContact O-CB 3.23Å; G363-L368 PolarHBondContact O-N 2.93Å |
| 364 | C | 89.4 | Confident | 89.5 | Confident | 33 Ų | 33 | 55.1 Ų | 55.1 | 22% | 0.223 | 27% | 0.274 | C | S | . | . | I | π-helix | trans | -86.6 | -32.3 | -167.8 | -62.6 | 0 | 0 | 0 | 0 | 114.1 | W360 P369 | W360-C364 HydrophobicContact CD2-CB 4.44Å; W360-C364 VanDerWaalsContact O-CB 3.23Å; W360-C364 WeakPolarHBondContact O-CB 3.42Å; W360-C364 PolarHBondContact O-N 3.25Å; C364-P369 WeakPolarHBondContact O-CD 3.39Å |
| 365 | Y | 90.1 | Very high | 89.8 | Confident | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 29% | 0.287 | C | S | . | . | I | π-helix | trans | -98.1 | -34.1 | 177.9 | -59.5 | -49 | 0 | 0 | 0 | 112.9 | I253 L256 G257 S260 F261 L305 S306 C361 P369 Y426 | I253-Y365 HydrophobicContact CG2-CE2 3.82Å; L256-Y365 HydrophobicContact CD2-CD2 4.06Å; L256-Y365 HydrophobicContact CD2-CG 4.2Å; G257-Y365 VanDerWaalsContact CA-CE1 3.5Å; S260-Y365 WeakPolarHBondContact OG-CA 3.3Å; S260-Y365 PolarHBondContact OG-O 2.9Å; F261-Y365 HydrophobicContact CE2-CE1 4.19Å; F261-Y365 HydrophobicContact CZ-CD1 4.47Å; F261-Y365 HydrophobicContact CZ-CE1 4.11Å; L305-Y365 VanDerWaalsContact C-OH 3.29Å; L305-Y365 WeakPolarHBondContact CB-OH 3.36Å; L305-Y365 PolarHBondContact O-OH 2.68Å; S306-Y365 PolarHBondContact N-OH 3.46Å; C361-Y365 HydrophobicContact CB-CD2 4.18Å; C361-Y365 WeakPolarHBondContact O-CA 3.46Å; C361-Y365 WeakPolarHBondContact O-CB 3.05Å; C361-Y365 PolarHBondContact O-N 3.16Å; Y365-P369 WeakPolarHBondContact O-CD 3.27Å; Y365-P369 VanDerWaalsContact O-CG 3.29Å; Y365-P369 WeakPolarHBondContact O-CG 3.07Å; Y365-Y426 WeakPolarHBondContact O-CE1 3.22Å; Y365-Y426 PolarHBondContact O-OH 2.79Å |
| 366 | F | 91.2 | Very high | 90 | Very high | 23 Ų | 23 | 50.3 Ų | 50.3 | 10% | 0.101 | 26% | 0.256 | C | S | . | . | I | π-helix | trans | -94.8 | -67.9 | 179.1 | -172.6 | -94.9 | 0 | 0 | 0 | 113.7 | C361 F362 P369 V370 A430 L431 H434 | C361-F366 PolarHBondContact O-N 3.41Å; C361-F366 VanDerWaalsContact O-N 3.11Å; F362-F366 HydrophobicContact CD2-CB 4.33Å; F362-F366 AromaticContact CD2-CD1 3.91Å; F362-F366 HydrophobicContact CD2-CD1 3.91Å; F362-F366 HydrophobicContact CD2-CG 4.39Å; F362-F366 AromaticContact CE2-CD1 3.75Å; F362-F366 HydrophobicContact CE2-CD1 3.75Å; F362-F366 HydrophobicContact CE2-CE1 4.19Å; F362-F366 WeakPolarHBondContact O-CB 3.3Å; F366-P369 WeakPolarHBondContact O-CD 3.42Å; F366-V370 HydrophobicContact CE2-CG2 4.48Å; F366-V370 WeakPolarHBondContact O-CB 3.4Å; F366-V370 VanDerWaalsContact O-CG2 3.25Å; F366-V370 WeakPolarHBondContact O-CG2 3.06Å; F366-V370 PolarHBondContact O-N 3.32Å; F366-V370 VanDerWaalsContact O-N 3.13Å; F366-A430 HydrophobicContact CD2-CB 3.92Å; F366-A430 HydrophobicContact CE2-CB 4.2Å; F366-L431 HydrophobicContact CE2-CB 3.88Å; F366-L431 HydrophobicContact CZ-CB 3.78Å; F366-L431 HydrophobicContact CZ-CD1 4.07Å; F366-L431 HydrophobicContact CZ-CG 4.23Å; F366-H434 VanDerWaalsContact CB-CD2 3.41Å; F366-H434 WeakPolarHBondContact CB-CD2 3.47Å; F366-H434 AromaticContact CD2-CD2 3.59Å; F366-H434 AromaticContact CD2-NE2 4Å; F366-H434 AromaticContact CG-CD2 3.59Å |
| 367 | C | 91.7 | Very high | 90.2 | Very high | 32 Ų | 32 | 49.4 Ų | 49.4 | 22% | 0.216 | 25% | 0.245 | C | C | . | . | I | π-helix | trans | -63.4 | -50.9 | -170.5 | -70.8 | 0 | 0 | 0 | 0 | 112.3 | F362 V370 L371 | F362-C367 VanDerWaalsContact CE1-SG 3.52Å; F362-C367 WeakPolarHBondContact CZ-SG 3.44Å; F362-C367 WeakPolarHBondContact O-CB 3.26Å; F362-C367 PolarHBondContact O-N 3.43Å; F362-C367 PolarHBondContact O-SG 3.02Å; C367-V370 PolarHBondContact O-N 2.97Å; C367-L371 HydrophobicContact CB-CD1 4.31Å; C367-L371 WeakPolarHBondContact O-CB 3.39Å; C367-L371 WeakPolarHBondContact O-CG 3.35Å; C367-L371 PolarHBondContact O-N 2.98Å |
| 368 | L | 91.2 | Very high | 90.3 | Very high | 89 Ų | 89 | 52.4 Ų | 52.4 | 47% | 0.466 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -58.6 | -52.9 | -177 | -179.1 | 167 | 0 | 0 | 0 | 111.3 | G363 F372 | G363-L368 VanDerWaalsContact O-CB 3.31Å; G363-L368 WeakPolarHBondContact O-CB 3.23Å; G363-L368 PolarHBondContact O-N 2.93Å; L368-F372 WeakPolarHBondContact O-CB 3.25Å; L368-F372 PolarHBondContact O-N 3.38Å |
| 369 | P | 91.3 | Very high | 90.5 | Very high | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -66.6 | -39.2 | 179.8 | -24.7 | 37.4 | 0 | 0 | 0 | 114.5 | C364 Y365 F366 T373 | C364-P369 WeakPolarHBondContact O-CD 3.39Å; Y365-P369 WeakPolarHBondContact O-CD 3.27Å; Y365-P369 VanDerWaalsContact O-CG 3.29Å; Y365-P369 WeakPolarHBondContact O-CG 3.07Å; F366-P369 WeakPolarHBondContact O-CD 3.42Å; P369-T373 WeakPolarHBondContact O-CB 3.34Å; P369-T373 WeakPolarHBondContact O-CG2 3.23Å; P369-T373 PolarHBondContact O-N 2.96Å; P369-T373 PolarHBondContact O-OG1 3.09Å |
| 370 | V | 90.8 | Very high | 90.5 | Very high | 25 Ų | 25 | 44.1 Ų | 44.1 | 15% | 0.152 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -67.7 | -50.8 | 179.8 | 173.3 | 0 | 0 | 0 | 0 | 110.6 | F366 C367 T373 I374 Y426 | F366-V370 HydrophobicContact CE2-CG2 4.48Å; F366-V370 WeakPolarHBondContact O-CB 3.4Å; F366-V370 VanDerWaalsContact O-CG2 3.25Å; F366-V370 WeakPolarHBondContact O-CG2 3.06Å; F366-V370 PolarHBondContact O-N 3.32Å; F366-V370 VanDerWaalsContact O-N 3.13Å; C367-V370 PolarHBondContact O-N 2.97Å; V370-T373 PolarHBondContact O-N 2.84Å; V370-T373 PolarHBondContact O-OG1 3.15Å; V370-I374 HydrophobicContact CG1-CD1 3.79Å; V370-I374 WeakPolarHBondContact O-CB 3.39Å; V370-I374 WeakPolarHBondContact O-CD1 3.4Å; V370-I374 VanDerWaalsContact O-CG1 3.23Å; V370-I374 WeakPolarHBondContact O-CG1 3.45Å; V370-I374 PolarHBondContact O-N 3.45Å; V370-Y426 HydrophobicContact CG2-CD1 3.97Å; V370-Y426 HydrophobicContact CG2-CE1 4.2Å |
| 371 | L | 92.4 | Very high | 90.4 | Very high | 105 Ų | 105 | 45.9 Ų | 45.9 | 55% | 0.55 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -63.5 | -44.8 | 177.8 | -65.4 | 172 | 0 | 0 | 0 | 111.3 | C367 I374 L375 | C367-L371 HydrophobicContact CB-CD1 4.31Å; C367-L371 WeakPolarHBondContact O-CB 3.39Å; C367-L371 WeakPolarHBondContact O-CG 3.35Å; C367-L371 PolarHBondContact O-N 2.98Å; L371-I374 PolarHBondContact O-N 3.4Å; L371-L375 WeakPolarHBondContact O-CB 3.48Å; L371-L375 VanDerWaalsContact O-CG 3.23Å; L371-L375 WeakPolarHBondContact O-CG 3.45Å; L371-L375 PolarHBondContact O-N 3.49Å |
| 372 | F | 93.3 | Very high | 90.3 | Very high | 71 Ų | 71 | 49.8 Ų | 49.8 | 31% | 0.311 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -62.6 | -44.9 | 179.7 | -177.6 | -91.8 | 0 | 0 | 0 | 112.2 | C264 I268 L368 L375 C376 | C264-F372 HydrophobicContact CB-CD1 4.18Å; C264-F372 HydrophobicContact CB-CE1 4.37Å; I268-F372 HydrophobicContact CD1-CE1 4.45Å; I268-F372 HydrophobicContact CD1-CZ 4.26Å; I268-F372 HydrophobicContact CG1-CE1 3.76Å; I268-F372 HydrophobicContact CG1-CZ 3.59Å; L368-F372 WeakPolarHBondContact O-CB 3.25Å; L368-F372 PolarHBondContact O-N 3.38Å; F372-L375 PolarHBondContact O-N 2.92Å; F372-C376 WeakPolarHBondContact CE1-SG 3.49Å; F372-C376 VanDerWaalsContact CZ-SG 3.52Å; F372-C376 WeakPolarHBondContact O-CB 3.48Å; F372-C376 PolarHBondContact O-N 2.88Å; F372-C376 PolarHBondContact O-SG 2.9Å |
| 373 | T | 91.5 | Very high | 90.1 | Very high | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.7 | -37.9 | 177.2 | 51.1 | 0 | 0 | 0 | 0 | 112.8 | L263 P369 V370 Q377 | L263-T373 HydrophobicContact CB-CG2 3.97Å; L263-T373 WeakPolarHBondContact O-CG2 3.45Å; P369-T373 WeakPolarHBondContact O-CB 3.34Å; P369-T373 WeakPolarHBondContact O-CG2 3.23Å; P369-T373 PolarHBondContact O-N 2.96Å; P369-T373 PolarHBondContact O-OG1 3.09Å; V370-T373 PolarHBondContact O-N 2.84Å; V370-T373 PolarHBondContact O-OG1 3.15Å; T373-Q377 WeakPolarHBondContact O-CB 3.46Å; T373-Q377 VanDerWaalsContact O-CG 3.24Å; T373-Q377 WeakPolarHBondContact O-CG 3.23Å; T373-Q377 PolarHBondContact O-N 3.28Å |
| 374 | I | 91.2 | Very high | 89.5 | Confident | 73 Ų | 73 | 51.3 Ų | 51.3 | 37% | 0.374 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.5 | -47.9 | 173.9 | -69.7 | 167.6 | 0 | 0 | 0 | 110.4 | V370 L371 Q377 M378 | V370-I374 HydrophobicContact CG1-CD1 3.79Å; V370-I374 WeakPolarHBondContact O-CB 3.39Å; V370-I374 WeakPolarHBondContact O-CD1 3.4Å; V370-I374 VanDerWaalsContact O-CG1 3.23Å; V370-I374 WeakPolarHBondContact O-CG1 3.45Å; V370-I374 PolarHBondContact O-N 3.45Å; L371-I374 PolarHBondContact O-N 3.4Å; I374-Q377 PolarHBondContact O-N 2.93Å; I374-Q377 VanDerWaalsContact O-N 3.17Å; I374-M378 HydrophobicContact CG2-CG 4.43Å; I374-M378 HydrophobicContact CG2-SD 3.93Å; I374-M378 WeakPolarHBondContact O-CG 3.48Å; I374-M378 PolarHBondContact O-N 2.99Å |
| 375 | L | 92.4 | Very high | 89 | Confident | 111 Ų | 111 | 52.2 Ų | 52.2 | 58% | 0.581 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -61.5 | -45.8 | 178.2 | -71.4 | 169.1 | 0 | 0 | 0 | 112.1 | L371 F372 Q377 M378 A379 | L371-L375 WeakPolarHBondContact O-CB 3.48Å; L371-L375 VanDerWaalsContact O-CG 3.23Å; L371-L375 WeakPolarHBondContact O-CG 3.45Å; L371-L375 PolarHBondContact O-N 3.49Å; F372-L375 PolarHBondContact O-N 2.92Å; L375-Q377 VanDerWaalsContact C-N 3.28Å; L375-Q377 PolarHBondContact O-N 3.34Å; L375-M378 PolarHBondContact O-N 3.46Å; L375-A379 WeakPolarHBondContact O-CB 3.4Å; L375-A379 PolarHBondContact O-N 3Å |
| 376 | C | 91.2 | Very high | 88.4 | Confident | 12 Ų | 12 | 56.9 Ų | 56.9 | 8% | 0.081 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.6 | -37.7 | 174.1 | -76.9 | 0 | 0 | 0 | 0 | 112.4 | F271 F372 T380 | F271-C376 HydrophobicContact CB-CB 4.31Å; F372-C376 WeakPolarHBondContact CE1-SG 3.49Å; F372-C376 VanDerWaalsContact CZ-SG 3.52Å; F372-C376 WeakPolarHBondContact O-CB 3.48Å; F372-C376 PolarHBondContact O-N 2.88Å; F372-C376 PolarHBondContact O-SG 2.9Å; C376-T380 WeakPolarHBondContact O-CB 2.97Å; C376-T380 PolarHBondContact O-N 3.44Å; C376-T380 PolarHBondContact O-OG1 3.36Å |
| 377 | Q | 89.3 | Confident | 87.6 | Confident | 7 Ų | 7 | 58.2 Ų | 58.2 | 3% | 0.033 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -71.7 | -39.2 | 176.3 | -74.7 | 178.1 | 46.8 | 0 | 0 | 112.9 | T373 I374 L375 T380 R381 L419 L420 | T373-Q377 WeakPolarHBondContact O-CB 3.46Å; T373-Q377 VanDerWaalsContact O-CG 3.24Å; T373-Q377 WeakPolarHBondContact O-CG 3.23Å; T373-Q377 PolarHBondContact O-N 3.28Å; I374-Q377 PolarHBondContact O-N 2.93Å; I374-Q377 VanDerWaalsContact O-N 3.17Å; L375-Q377 VanDerWaalsContact C-N 3.28Å; L375-Q377 PolarHBondContact O-N 3.34Å; Q377-T380 PolarHBondContact O-N 3.5Å; Q377-R381 WeakPolarHBondContact O-CB 3.48Å; Q377-R381 VanDerWaalsContact O-CG 3.26Å; Q377-R381 WeakPolarHBondContact O-CG 3.26Å; Q377-R381 PolarHBondContact O-N 3.44Å; Q377-L419 HydrophobicContact CG-CD2 4.33Å; Q377-L420 VanDerWaalsContact OE1-CB 3.32Å |
| 378 | M | 89.6 | Confident | 86.5 | Confident | 102 Ų | 102 | 59.2 Ų | 59.2 | 50% | 0.502 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.1 | -49.9 | 174 | -72.1 | 174.8 | 67.3 | 0 | 0 | 110.6 | I374 L375 T380 R381 N382 | I374-M378 HydrophobicContact CG2-CG 4.43Å; I374-M378 HydrophobicContact CG2-SD 3.93Å; I374-M378 WeakPolarHBondContact O-CG 3.48Å; I374-M378 PolarHBondContact O-N 2.99Å; L375-M378 PolarHBondContact O-N 3.46Å; M378-T380 VanDerWaalsContact C-N 3.33Å; M378-T380 PolarHBondContact O-N 2.99Å; M378-R381 WeakPolarHBondContact O-CB 3.49Å; M378-R381 PolarHBondContact O-N 3.11Å; M378-R381 VanDerWaalsContact O-N 3.12Å; M378-N382 PolarHBondContact O-N 3.03Å; M378-N382 PolarHBondContact O-OD1 3.36Å |
| 379 | A | 89.8 | Confident | 85.4 | Confident | 33 Ų | 33 | 58.2 Ų | 58.2 | 27% | 0.273 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -59.2 | -43 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | F271 L375 R381 N382 V383 | F271-A379 HydrophobicContact CD2-CB 3.84Å; F271-A379 HydrophobicContact CE2-CB 3.77Å; L375-A379 WeakPolarHBondContact O-CB 3.4Å; L375-A379 PolarHBondContact O-N 3Å; A379-R381 VanDerWaalsContact C-N 3.32Å; A379-R381 PolarHBondContact O-N 2.94Å; A379-N382 PolarHBondContact O-N 3.41Å; A379-V383 WeakPolarHBondContact O-CG2 3.29Å; A379-V383 PolarHBondContact O-N 3.32Å |
| 380 | T | 87.3 | Confident | 84.2 | Confident | 6 Ų | 6 | 61.2 Ų | 61.2 | 4% | 0.037 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60 | -38.9 | 174.7 | -66.8 | 0 | 0 | 0 | 0 | 112.6 | A274 C376 Q377 M378 N384 N416 | A274-T380 HydrophobicContact CB-CG2 3.88Å; C376-T380 WeakPolarHBondContact O-CB 2.97Å; C376-T380 PolarHBondContact O-N 3.44Å; C376-T380 PolarHBondContact O-OG1 3.36Å; Q377-T380 PolarHBondContact O-N 3.5Å; M378-T380 VanDerWaalsContact C-N 3.33Å; M378-T380 PolarHBondContact O-N 2.99Å; T380-N384 WeakPolarHBondContact O-CB 3.38Å; T380-N384 PolarHBondContact O-N 3.35Å; T380-N416 VanDerWaalsContact CG2-ND2 3.29Å; T380-N416 WeakPolarHBondContact CG2-ND2 3.24Å |
| 381 | R | 86.1 | Confident | 82.9 | Confident | 137 Ų | 137 | 63.5 Ų | 63.5 | 52% | 0.517 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -67.4 | -44.4 | 176.4 | -74.7 | 169.4 | -173.9 | -172.3 | 3.6 | 111.5 | Q377 M378 A379 N384 S385 | Q377-R381 WeakPolarHBondContact O-CB 3.48Å; Q377-R381 VanDerWaalsContact O-CG 3.26Å; Q377-R381 WeakPolarHBondContact O-CG 3.26Å; Q377-R381 PolarHBondContact O-N 3.44Å; M378-R381 WeakPolarHBondContact O-CB 3.49Å; M378-R381 PolarHBondContact O-N 3.11Å; M378-R381 VanDerWaalsContact O-N 3.12Å; A379-R381 VanDerWaalsContact C-N 3.32Å; A379-R381 PolarHBondContact O-N 2.94Å; R381-N384 CarbonylContact O-C 3.56Å; R381-N384 PolarHBondContact O-N 3.19Å; R381-S385 PolarHBondContact O-N 2.95Å; R381-S385 PolarHBondContact O-OG 3.39Å |
| 382 | N | 86.8 | Confident | 81.5 | Confident | 96 Ų | 96 | 67.6 Ų | 67.6 | 51% | 0.513 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -63.9 | -47.8 | -179.5 | -65 | 8 | 0 | 0 | 0 | 111.5 | M378 A379 N384 S385 D386 | M378-N382 PolarHBondContact O-N 3.03Å; M378-N382 PolarHBondContact O-OD1 3.36Å; A379-N382 PolarHBondContact O-N 3.41Å; N382-N384 PolarHBondContact O-N 2.89Å; N382-S385 WeakPolarHBondContact CA-OG 3.42Å; N382-S385 PolarHBondContact O-N 3.14Å; N382-S385 PolarHBondContact O-OG 3.04Å; N382-D386 PolarHBondContact O-N 2.69Å |
| 383 | V | 84.9 | Confident | 80 | Confident | 51 Ų | 51 | 72.7 Ų | 72.7 | 31% | 0.309 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -59.7 | -34.7 | 175.8 | 175.1 | 0 | 0 | 0 | 0 | 111.8 | A274 A379 S387 | A274-V383 HydrophobicContact CB-CG1 4.47Å; A274-V383 WeakPolarHBondContact O-CG1 3.39Å; A379-V383 WeakPolarHBondContact O-CG2 3.29Å; A379-V383 PolarHBondContact O-N 3.32Å; V383-S387 WeakPolarHBondContact O-CB 3.43Å; V383-S387 PolarHBondContact O-N 3.04Å; V383-S387 VanDerWaalsContact O-N 3.13Å; V383-S387 PolarHBondContact O-OG 3.02Å |
| 384 | N | 77.9 | Confident | 78.6 | Confident | 71 Ų | 71 | 82.6 Ų | 82.6 | 38% | 0.38 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -76.6 | -30.4 | 174.7 | -176.2 | 71.7 | 0 | 0 | 0 | 113.5 | T380 R381 N382 S387 S388 | T380-N384 WeakPolarHBondContact O-CB 3.38Å; T380-N384 PolarHBondContact O-N 3.35Å; R381-N384 CarbonylContact O-C 3.56Å; R381-N384 PolarHBondContact O-N 3.19Å; N382-N384 PolarHBondContact O-N 2.89Å; N384-S387 PolarHBondContact O-OG 3.01Å; N384-S388 VanDerWaalsContact O-CB 3.3Å; N384-S388 WeakPolarHBondContact O-CB 3.16Å; N384-S388 PolarHBondContact O-N 2.88Å |
| 385 | S | 79.5 | Confident | 77.1 | Confident | 53 Ų | 53 | 83.7 Ų | 83.7 | 37% | 0.371 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -67.6 | -44 | 171.3 | 54.5 | 0 | 0 | 0 | 0 | 111.1 | R381 N382 S388 S389 | R381-S385 PolarHBondContact O-N 2.95Å; R381-S385 PolarHBondContact O-OG 3.39Å; N382-S385 WeakPolarHBondContact CA-OG 3.42Å; N382-S385 PolarHBondContact O-N 3.14Å; N382-S385 PolarHBondContact O-OG 3.04Å; S385-S388 CarbonylContact O-C 3.58Å; S385-S388 WeakPolarHBondContact O-CA 3.22Å; S385-S388 WeakPolarHBondContact O-CB 3.42Å; S385-S388 PolarHBondContact O-N 3.49Å; S385-S388 PolarHBondContact O-OG 3Å; S385-S389 PolarHBondContact O-N 2.89Å; S385-S389 PolarHBondContact O-OG 2.85Å |
| 386 | D | 78.1 | Confident | 75.3 | Confident | 97 Ų | 97 | 86.6 Ų | 86.6 | 52% | 0.519 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -70.5 | -40.3 | -174.4 | -58.9 | -10.1 | 0 | 0 | 0 | 111.4 | N382 S388 S389 A390 | N382-D386 PolarHBondContact O-N 2.69Å; D386-S388 PolarHBondContact O-N 3.06Å; D386-S389 PolarHBondContact O-N 3.37Å; D386-S389 PolarHBondContact O-OG 3.46Å; D386-S389 VanDerWaalsContact O-OG 3.07Å; D386-A390 WeakPolarHBondContact O-CB 3.39Å; D386-A390 PolarHBondContact O-N 3.13Å |
| 387 | S | 72.4 | Confident | 73.7 | Confident | 52 Ų | 52 | 92.8 Ų | 92.8 | 36% | 0.364 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -72 | -14.4 | 171.5 | 60.8 | 0 | 0 | 0 | 0 | 113.9 | V383 N384 R405 | V383-S387 WeakPolarHBondContact O-CB 3.43Å; V383-S387 PolarHBondContact O-N 3.04Å; V383-S387 VanDerWaalsContact O-N 3.13Å; V383-S387 PolarHBondContact O-OG 3.02Å; N384-S387 PolarHBondContact O-OG 3.01Å; S387-R405 PolarHBondContact O-NH2 2.91Å; S387-R405 VanDerWaalsContact O-NH2 3.11Å |
| 388 | S | 69.4 | Low | 72.6 | Confident | 53 Ų | 53 | 95.6 Ų | 95.6 | 37% | 0.371 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -83.1 | -45 | 169.5 | 83.8 | 0 | 0 | 0 | 0 | 111.9 | N384 S385 D386 Q391 K392 | N384-S388 VanDerWaalsContact O-CB 3.3Å; N384-S388 WeakPolarHBondContact O-CB 3.16Å; N384-S388 PolarHBondContact O-N 2.88Å; S385-S388 CarbonylContact O-C 3.58Å; S385-S388 WeakPolarHBondContact O-CA 3.22Å; S385-S388 WeakPolarHBondContact O-CB 3.42Å; S385-S388 PolarHBondContact O-N 3.49Å; S385-S388 PolarHBondContact O-OG 3Å; D386-S388 PolarHBondContact O-N 3.06Å; S388-Q391 PolarHBondContact O-N 3.3Å; S388-K392 WeakPolarHBondContact O-CB 3.37Å; S388-K392 PolarHBondContact O-N 2.9Å |
| 389 | S | 68 | Low | 71.5 | Confident | 67 Ų | 67 | 101.7 Ų | 101.7 | 47% | 0.469 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.4 | -50 | -179.7 | 57.9 | 0 | 0 | 0 | 0 | 111.3 | S385 D386 Q391 K392 Q393 | S385-S389 PolarHBondContact O-N 2.89Å; S385-S389 PolarHBondContact O-OG 2.85Å; D386-S389 PolarHBondContact O-N 3.37Å; D386-S389 PolarHBondContact O-OG 3.46Å; D386-S389 VanDerWaalsContact O-OG 3.07Å; S389-Q391 PolarHBondContact O-N 2.68Å; S389-Q391 VanDerWaalsContact O-N 3.08Å; S389-K392 PolarHBondContact O-N 3.44Å; S389-K392 VanDerWaalsContact O-N 3.1Å; S389-Q393 PolarHBondContact O-N 2.9Å |
| 390 | A | 65.8 | Low | 70.4 | Confident | 64 Ų | 64 | 103.6 Ų | 103.6 | 53% | 0.529 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.7 | -21.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | D386 | D386-A390 WeakPolarHBondContact O-CB 3.39Å; D386-A390 PolarHBondContact O-N 3.13Å |
| 391 | Q | 63.9 | Low | 69.6 | Low | 72 Ų | 72 | 108 Ų | 108 | 34% | 0.336 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -104.6 | -15.6 | 175 | -162 | 157.2 | 6.9 | 0 | 0 | 114.6 | S388 S389 Q393 R394 N395 R405 | S388-Q391 PolarHBondContact O-N 3.3Å; S389-Q391 PolarHBondContact O-N 2.68Å; S389-Q391 VanDerWaalsContact O-N 3.08Å; Q391-Q393 PolarHBondContact O-N 2.75Å; Q391-R394 HydrophobicContact CG-CB 4.25Å; Q391-R394 PolarHBondContact O-N 3.48Å; Q391-N395 PolarHBondContact NE2-OD1 2.93Å; Q391-R405 VanDerWaalsContact OE1-NH1 3.07Å; Q391-R405 VanDerWaalsContact OE1-NH2 3.16Å |
| 392 | K | 62.6 | Low | 68.9 | Low | 192 Ų | 192 | 104 Ų | 104 | 84% | 0.835 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -61.2 | -29.1 | 165.5 | -153 | 178.5 | -173.6 | -173.5 | 0 | 111 | S388 S389 R394 | S388-K392 WeakPolarHBondContact O-CB 3.37Å; S388-K392 PolarHBondContact O-N 2.9Å; S389-K392 PolarHBondContact O-N 3.44Å; S389-K392 VanDerWaalsContact O-N 3.1Å; K392-R394 VanDerWaalsContact C-N 3.27Å; K392-R394 PolarHBondContact O-N 3.02Å |
| 393 | Q | 61.8 | Low | 68.5 | Low | 177 Ų | 177 | 105.4 Ų | 105.4 | 83% | 0.827 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.5 | -11.2 | 172.8 | -150.5 | 75.7 | 6.7 | 0 | 0 | 114.8 | S389 Q391 | S389-Q393 PolarHBondContact O-N 2.9Å; Q391-Q393 PolarHBondContact O-N 2.75Å |
| 394 | R | 63.5 | Low | 68.1 | Low | 209 Ų | 209 | 109.5 Ų | 109.5 | 79% | 0.789 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.7 | -6.7 | -153.7 | -129 | 177.4 | -174.9 | 178.4 | 2.1 | 117.2 | Q391 K392 | Q391-R394 HydrophobicContact CG-CB 4.25Å; Q391-R394 PolarHBondContact O-N 3.48Å; K392-R394 VanDerWaalsContact C-N 3.27Å; K392-R394 PolarHBondContact O-N 3.02Å |
| 395 | N | 58.6 | Low | 67.9 | Low | 95 Ų | 95 | 110.3 Ų | 110.3 | 51% | 0.508 | 56% | 0.557 | S | S | . | * | trans | -138.4 | 123.8 | -174.5 | -87.6 | 84.6 | 0 | 0 | 0 | 112 | Q391 | Q391-N395 PolarHBondContact NE2-OD1 2.93Š| ||
| 396 | H | 55.4 | Low | 67.8 | Low | 173 Ų | 173 | 113.7 Ų | 113.7 | 80% | 0.801 | 57% | 0.567 | S | S | * | * | S | Bend | trans | -113.1 | -38.5 | 167.9 | -175.1 | -92.6 | 0 | 0 | 0 | 112.1 | ||
| 397 | D | 56.3 | Low | 67.9 | Low | 142 Ų | 142 | 114.4 Ų | 114.4 | 76% | 0.759 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -108.8 | 13.9 | -154.3 | -54.5 | -68.1 | 0 | 0 | 0 | 118.3 | ||
| 398 | D | 66 | Low | 68.2 | Low | 66 Ų | 66 | 115.9 Ų | 115.9 | 35% | 0.353 | 57% | 0.569 | S | S | . | * | trans | -125.9 | 78.3 | -167 | -160 | -8.4 | 0 | 0 | 0 | 115.1 | A400 N401 S402 | D398-A400 PolarHBondContact O-N 3.11Å; D398-N401 WeakPolarHBondContact OD2-CB 3.36Å; D398-N401 PolarHBondContact OD2-ND2 2.97Å; D398-S402 WeakPolarHBondContact O-CB 3.19Å; D398-S402 PolarHBondContact O-N 2.79Å; D398-S402 VanDerWaalsContact O-N 3.14Å | ||
| 399 | R | 66.3 | Low | 68.7 | Low | 230 Ų | 230 | 116.2 Ų | 116.2 | 87% | 0.868 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -58.9 | -42.7 | -178.5 | -92.2 | -177.3 | 169.4 | 174.3 | -2.4 | 113.3 | S402 Q403 | R399-S402 PolarHBondContact O-N 3.11Å; R399-S402 PolarHBondContact O-OG 3.14Å; R399-Q403 PolarHBondContact O-N 3.32Å |
| 400 | A | 68.3 | Low | 69.4 | Low | 72 Ų | 72 | 115.9 Ų | 115.9 | 60% | 0.595 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -68.7 | -42.4 | -173.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | D398 | D398-A400 PolarHBondContact O-N 3.11Å |
| 401 | N | 70.6 | Confident | 70.2 | Confident | 99 Ų | 99 | 116 Ų | 116 | 53% | 0.529 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -69.7 | -34.5 | 174.8 | -82.8 | -40.9 | 0 | 0 | 0 | 112.2 | D398 Q403 K404 R405 | D398-N401 WeakPolarHBondContact OD2-CB 3.36Å; D398-N401 PolarHBondContact OD2-ND2 2.97Å; N401-Q403 PolarHBondContact O-N 2.96Å; N401-K404 PolarHBondContact O-N 3.45Å; N401-R405 WeakPolarHBondContact O-CB 3.16Å; N401-R405 PolarHBondContact O-N 3.01Å |
| 402 | S | 71.8 | Confident | 71.1 | Confident | 52 Ų | 52 | 113.9 Ų | 113.9 | 36% | 0.364 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -59.8 | -42.7 | 177.7 | 77.9 | 0 | 0 | 0 | 0 | 112.7 | D398 R399 R405 Q406 | D398-S402 WeakPolarHBondContact O-CB 3.19Å; D398-S402 PolarHBondContact O-N 2.79Å; D398-S402 VanDerWaalsContact O-N 3.14Å; R399-S402 PolarHBondContact O-N 3.11Å; R399-S402 PolarHBondContact O-OG 3.14Å; S402-R405 PolarHBondContact O-N 3.42Å; S402-Q406 WeakPolarHBondContact O-CG 3.07Å; S402-Q406 PolarHBondContact O-N 3.48Å |
| 403 | Q | 78.4 | Confident | 72.1 | Confident | 127 Ų | 127 | 113.7 Ų | 113.7 | 59% | 0.593 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -68.9 | -42.3 | -178.5 | -170.2 | 171.8 | 1.5 | 0 | 0 | 112.5 | R399 N401 R405 Q406 Q407 | R399-Q403 PolarHBondContact O-N 3.32Å; N401-Q403 PolarHBondContact O-N 2.96Å; Q403-R405 VanDerWaalsContact C-N 3.31Å; Q403-R405 PolarHBondContact O-N 3.45Å; Q403-Q406 PolarHBondContact O-N 2.95Å; Q403-Q407 PolarHBondContact O-N 2.73Å |
| 404 | K | 76.3 | Confident | 73.3 | Confident | 137 Ų | 137 | 108.1 Ų | 108.1 | 60% | 0.596 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.9 | -39.2 | 173.8 | -72.3 | -176.8 | 178.7 | 177.2 | 0 | 111.8 | N401 Q407 H408 | N401-K404 PolarHBondContact O-N 3.45Å; K404-Q407 PolarHBondContact O-N 2.9Å; K404-H408 PolarHBondContact O-N 3.03Å |
| 405 | R | 73.3 | Confident | 74.5 | Confident | 88 Ų | 88 | 99.7 Ų | 99.7 | 33% | 0.332 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67.9 | -42.3 | 177.8 | -168 | 176.7 | -177.6 | -149.1 | -0.1 | 112.2 | S387 Q391 N401 S402 Q403 Q407 H408 Q409 | S387-R405 PolarHBondContact O-NH2 2.91Å; S387-R405 VanDerWaalsContact O-NH2 3.11Å; Q391-R405 VanDerWaalsContact OE1-NH1 3.07Å; Q391-R405 VanDerWaalsContact OE1-NH2 3.16Å; N401-R405 WeakPolarHBondContact O-CB 3.16Å; N401-R405 PolarHBondContact O-N 3.01Å; S402-R405 PolarHBondContact O-N 3.42Å; Q403-R405 VanDerWaalsContact C-N 3.31Å; Q403-R405 PolarHBondContact O-N 3.45Å; R405-Q407 VanDerWaalsContact C-N 3.34Å; R405-Q407 PolarHBondContact O-N 2.81Å; R405-H408 PolarHBondContact O-N 3.21Å; R405-Q409 WeakPolarHBondContact O-CG 3.31Å; R405-Q409 PolarHBondContact O-N 3.5Å |
| 406 | Q | 77.4 | Confident | 75.9 | Confident | 124 Ų | 124 | 96.5 Ų | 96.5 | 58% | 0.579 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -58.8 | -43.4 | 173.2 | -74.9 | 171.4 | -3 | 0 | 0 | 111.8 | S402 Q403 Q409 A410 | S402-Q406 WeakPolarHBondContact O-CG 3.07Å; S402-Q406 PolarHBondContact O-N 3.48Å; Q403-Q406 PolarHBondContact O-N 2.95Å; Q406-Q409 PolarHBondContact O-N 3.36Å; Q406-A410 WeakPolarHBondContact O-CB 3.25Å; Q406-A410 PolarHBondContact O-N 2.96Å |
| 407 | Q | 80 | Confident | 77.6 | Confident | 112 Ų | 112 | 91.3 Ų | 91.3 | 52% | 0.523 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -63.2 | -42.6 | 176.6 | -169.2 | 177.7 | 10.6 | 0 | 0 | 112.1 | Q403 K404 R405 A410 V411 | Q403-Q407 PolarHBondContact O-N 2.73Å; K404-Q407 PolarHBondContact O-N 2.9Å; R405-Q407 VanDerWaalsContact C-N 3.34Å; R405-Q407 PolarHBondContact O-N 2.81Å; Q407-A410 PolarHBondContact O-N 2.95Å; Q407-V411 WeakPolarHBondContact O-CG2 3.38Å; Q407-V411 PolarHBondContact O-N 3.14Å; Q407-V411 VanDerWaalsContact O-N 3.15Å |
| 408 | H | 79.4 | Confident | 79.3 | Confident | 83 Ų | 83 | 84.6 Ų | 84.6 | 38% | 0.384 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -62.4 | -45.4 | 175.2 | -176.2 | 42.8 | 0 | 0 | 0 | 112 | K281 K404 R405 A410 V411 E412 | K281-H408 PolarHBondContact NZ-NE2 2.93Å; K404-H408 PolarHBondContact O-N 3.03Å; R405-H408 PolarHBondContact O-N 3.21Å; H408-A410 VanDerWaalsContact C-N 3.33Å; H408-A410 PolarHBondContact O-N 2.82Å; H408-V411 PolarHBondContact O-N 3.34Å; H408-E412 IonicContact CE1-OE1 3.71Å; H408-E412 IonicContact NE2-OE1 3.88Å; H408-E412 IonicContact NE2-OE2 3.74Å; H408-E412 PolarHBondContact O-N 3.14Å |
| 409 | Q | 79.7 | Confident | 80.6 | Confident | 60 Ų | 60 | 81.4 Ų | 81.4 | 28% | 0.28 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.9 | -34.1 | 176.9 | -72.7 | -179.7 | -53.1 | 0 | 0 | 112.8 | R405 Q406 R413 | R405-Q409 WeakPolarHBondContact O-CG 3.31Å; R405-Q409 PolarHBondContact O-N 3.5Å; Q406-Q409 PolarHBondContact O-N 3.36Å; Q409-R413 VanDerWaalsContact O-CB 3.27Å; Q409-R413 WeakPolarHBondContact O-CB 3.33Å; Q409-R413 PolarHBondContact O-N 3.16Å |
| 410 | A | 82.3 | Confident | 81.8 | Confident | 59 Ų | 59 | 73.3 Ų | 73.3 | 49% | 0.488 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64 | -41.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q406 Q407 H408 Q414 | Q406-A410 WeakPolarHBondContact O-CB 3.25Å; Q406-A410 PolarHBondContact O-N 2.96Å; Q407-A410 PolarHBondContact O-N 2.95Å; H408-A410 VanDerWaalsContact C-N 3.33Å; H408-A410 PolarHBondContact O-N 2.82Å; A410-Q414 WeakPolarHBondContact O-CB 3.38Å; A410-Q414 PolarHBondContact O-N 3.09Å |
| 411 | V | 82.9 | Confident | 83.1 | Confident | 67 Ų | 67 | 71 Ų | 71 | 41% | 0.406 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -66.8 | -46.7 | 175 | 174.6 | 0 | 0 | 0 | 0 | 111.3 | Q407 H408 R413 Q414 L415 | Q407-V411 WeakPolarHBondContact O-CG2 3.38Å; Q407-V411 PolarHBondContact O-N 3.14Å; Q407-V411 VanDerWaalsContact O-N 3.15Å; H408-V411 PolarHBondContact O-N 3.34Å; V411-R413 VanDerWaalsContact C-N 3.32Å; V411-R413 PolarHBondContact O-N 2.89Å; V411-Q414 WeakPolarHBondContact O-CB 3.4Å; V411-Q414 PolarHBondContact O-N 3.02Å; V411-Q414 VanDerWaalsContact O-N 3.13Å; V411-L415 HydrophobicContact CG1-CD1 4.15Å; V411-L415 HydrophobicContact CG1-CG 4.47Å; V411-L415 WeakPolarHBondContact O-CG 3.4Å; V411-L415 PolarHBondContact O-N 3.46Å |
| 412 | E | 83 | Confident | 84.2 | Confident | 28 Ų | 28 | 66.7 Ų | 66.7 | 13% | 0.131 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -63 | -37.7 | 177.3 | -69.1 | -165.4 | 134.9 | 0 | 0 | 111.9 | S273 K281 H408 L415 N416 | S273-E412 PolarHBondContact OG-OE1 3.42Å; K281-E412 VanDerWaalsContact NZ-CD 3.32Å; K281-E412 IonicContact NZ-OE1 3.47Å; K281-E412 PolarHBondContact NZ-OE1 2.97Å; K281-E412 IonicContact NZ-OE2 2.73Å; K281-E412 PolarHBondContact NZ-OE2 3.47Å; H408-E412 IonicContact CE1-OE1 3.71Å; H408-E412 IonicContact NE2-OE1 3.88Å; H408-E412 IonicContact NE2-OE2 3.74Å; H408-E412 PolarHBondContact O-N 3.14Å; E412-L415 PolarHBondContact O-N 3.13Å; E412-N416 WeakPolarHBondContact O-CB 3.1Å; E412-N416 PolarHBondContact O-N 3.46Å; E412-N416 PolarHBondContact O-ND2 3.15Å |
| 413 | R | 83.4 | Confident | 85.2 | Confident | 187 Ų | 187 | 64.6 Ų | 64.6 | 71% | 0.706 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -61.3 | -43.6 | 171.3 | -177.2 | 177.1 | 177.9 | 179.3 | -0.1 | 111.9 | Q409 V411 N416 C417 | Q409-R413 VanDerWaalsContact O-CB 3.27Å; Q409-R413 WeakPolarHBondContact O-CB 3.33Å; Q409-R413 PolarHBondContact O-N 3.16Å; V411-R413 VanDerWaalsContact C-N 3.32Å; V411-R413 PolarHBondContact O-N 2.89Å; R413-N416 PolarHBondContact O-N 3.46Å; R413-C417 WeakPolarHBondContact O-CB 3.37Å; R413-C417 PolarHBondContact O-N 3.02Å; R413-C417 PolarHBondContact O-SG 3.46Å |
| 414 | Q | 86.7 | Confident | 85.9 | Confident | 60 Ų | 60 | 61.8 Ų | 61.8 | 28% | 0.28 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -63 | -44.1 | 179.1 | -175 | 176.8 | 14.5 | 0 | 0 | 112.1 | A410 V411 C417 T418 L477 K479 | A410-Q414 WeakPolarHBondContact O-CB 3.38Å; A410-Q414 PolarHBondContact O-N 3.09Å; V411-Q414 WeakPolarHBondContact O-CB 3.4Å; V411-Q414 PolarHBondContact O-N 3.02Å; V411-Q414 VanDerWaalsContact O-N 3.13Å; Q414-C417 PolarHBondContact O-N 3.18Å; Q414-T418 PolarHBondContact O-N 2.99Å; Q414-T418 PolarHBondContact O-OG1 3.37Å; Q414-L477 PolarHBondContact NE2-O 3.45Å; Q414-K479 VanDerWaalsContact NE2-N 3.11Å |
| 415 | L | 88.1 | Confident | 86.8 | Confident | 32 Ų | 32 | 56.4 Ų | 56.4 | 17% | 0.168 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -63.1 | -42.7 | 176.6 | -64.1 | 171.1 | 0 | 0 | 0 | 111.4 | W207 V411 E412 T418 L419 | W207-L415 HydrophobicContact CD2-CD2 4.36Å; W207-L415 HydrophobicContact CG-CD2 4.31Å; W207-L415 HydrophobicContact CZ2-CB 4.36Å; W207-L415 HydrophobicContact CZ2-CD2 4.48Å; V411-L415 HydrophobicContact CG1-CD1 4.15Å; V411-L415 HydrophobicContact CG1-CG 4.47Å; V411-L415 WeakPolarHBondContact O-CG 3.4Å; V411-L415 PolarHBondContact O-N 3.46Å; E412-L415 PolarHBondContact O-N 3.13Å; L415-T418 PolarHBondContact O-N 3.13Å; L415-L419 PolarHBondContact O-N 3.42Å |
| 416 | N | 88.8 | Confident | 87.7 | Confident | 29 Ų | 29 | 52.5 Ų | 52.5 | 16% | 0.155 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -67.7 | -36.8 | 177.1 | -67.6 | -18.6 | 0 | 0 | 0 | 112.8 | R270 T380 E412 R413 T418 L419 L420 | R270-N416 VanDerWaalsContact CD-OD1 3.29Å; R270-N416 WeakPolarHBondContact CD-OD1 3.4Å; R270-N416 WeakPolarHBondContact CG-OD1 3.35Å; T380-N416 VanDerWaalsContact CG2-ND2 3.29Å; T380-N416 WeakPolarHBondContact CG2-ND2 3.24Å; E412-N416 WeakPolarHBondContact O-CB 3.1Å; E412-N416 PolarHBondContact O-N 3.46Å; E412-N416 PolarHBondContact O-ND2 3.15Å; R413-N416 PolarHBondContact O-N 3.46Å; N416-T418 VanDerWaalsContact C-N 3.35Å; N416-L419 PolarHBondContact O-N 3.01Å; N416-L420 PolarHBondContact O-N 2.94Å |
| 417 | C | 90.6 | Very high | 88.4 | Confident | 63 Ų | 63 | 47.2 Ų | 47.2 | 43% | 0.426 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -66.6 | -37.7 | 173.1 | -66 | 0 | 0 | 0 | 0 | 111.7 | R413 Q414 L420 A421 | R413-C417 WeakPolarHBondContact O-CB 3.37Å; R413-C417 PolarHBondContact O-N 3.02Å; R413-C417 PolarHBondContact O-SG 3.46Å; Q414-C417 PolarHBondContact O-N 3.18Å; C417-L420 PolarHBondContact O-N 2.82Å; C417-A421 WeakPolarHBondContact O-CB 3.38Å; C417-A421 PolarHBondContact O-N 2.91Å |
| 418 | T | 91.9 | Very high | 88.9 | Confident | 1 Ų | 1 | 47.3 Ų | 47.3 | 1% | 0.006 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.3 | -47.2 | 175.4 | -51.7 | 0 | 0 | 0 | 0 | 110.7 | Q414 L415 N416 L420 A421 L422 L474 | Q414-T418 PolarHBondContact O-N 2.99Å; Q414-T418 PolarHBondContact O-OG1 3.37Å; L415-T418 PolarHBondContact O-N 3.13Å; N416-T418 VanDerWaalsContact C-N 3.35Å; T418-L420 VanDerWaalsContact C-N 3.34Å; T418-L420 PolarHBondContact O-N 2.92Å; T418-A421 PolarHBondContact O-N 2.98Å; T418-L422 HydrophobicContact CG2-CD1 4.29Å; T418-L422 WeakPolarHBondContact O-CG 3.29Å; T418-L422 PolarHBondContact O-N 3.33Å; T418-L474 HydrophobicContact CG2-CD2 3.62Å |
| 419 | L | 92.8 | Very high | 89.5 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.7 | -40.1 | 177.5 | -176.2 | 60.9 | 0 | 0 | 0 | 112.6 | W207 L263 L266 R270 Q377 L415 N416 A423 | W207-L419 HydrophobicContact CH2-CB 4.14Å; W207-L419 HydrophobicContact CH2-CD1 4.46Å; W207-L419 HydrophobicContact CH2-CD2 4.27Å; W207-L419 HydrophobicContact CZ2-CB 4.39Å; L263-L419 HydrophobicContact CD2-CD1 3.85Å; L266-L419 HydrophobicContact CB-CD1 3.68Å; L266-L419 HydrophobicContact CD1-CD1 4.15Å; R270-L419 HydrophobicContact CG-CD2 3.94Å; Q377-L419 HydrophobicContact CG-CD2 4.33Å; L415-L419 PolarHBondContact O-N 3.42Å; N416-L419 PolarHBondContact O-N 3.01Å; L419-A423 WeakPolarHBondContact O-CB 3.5Å; L419-A423 PolarHBondContact O-N 3.37Å |
| 420 | L | 93.1 | Very high | 90 | Very high | 60 Ų | 60 | 41.3 Ų | 41.3 | 31% | 0.314 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -61.3 | -48.8 | 174 | -178.8 | 55.1 | 0 | 0 | 0 | 111.7 | Q377 N416 C417 T418 L422 A423 V424 | Q377-L420 VanDerWaalsContact OE1-CB 3.32Å; N416-L420 PolarHBondContact O-N 2.94Å; C417-L420 PolarHBondContact O-N 2.82Å; T418-L420 VanDerWaalsContact C-N 3.34Å; T418-L420 PolarHBondContact O-N 2.92Å; L420-L422 VanDerWaalsContact C-N 3.33Å; L420-L422 PolarHBondContact O-N 2.88Å; L420-A423 PolarHBondContact O-N 3.04Å; L420-V424 HydrophobicContact CD1-CG2 4.09Å; L420-V424 HydrophobicContact CG-CG2 4.4Å; L420-V424 WeakPolarHBondContact O-CG2 3.41Å; L420-V424 PolarHBondContact O-N 3.11Å |
| 421 | A | 93.8 | Very high | 90.2 | Very high | 23 Ų | 23 | 42.5 Ų | 42.5 | 19% | 0.19 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -66 | -36.4 | -176.9 | 0 | 0 | 0 | 0 | 0 | 112 | C417 T418 V424 V425 L473 L477 | C417-A421 WeakPolarHBondContact O-CB 3.38Å; C417-A421 PolarHBondContact O-N 2.91Å; T418-A421 PolarHBondContact O-N 2.98Å; A421-V424 PolarHBondContact O-N 3.32Å; A421-V425 PolarHBondContact O-N 3.48Å; A421-L473 HydrophobicContact CB-CD1 4.12Å; A421-L473 HydrophobicContact CB-CD2 3.77Å; A421-L473 HydrophobicContact CB-CG 4.28Å; A421-L477 HydrophobicContact CB-CD1 3.44Å; A421-L477 VanDerWaalsContact CB-CD1 3.44Å |
| 422 | L | 93.8 | Very high | 90.4 | Very high | 8 Ų | 8 | 41.3 Ų | 41.3 | 4% | 0.042 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61 | -47.3 | 170.9 | -69.9 | 169.1 | 0 | 0 | 0 | 111.8 | L211 L263 T418 L420 V424 V425 Y426 T470 L473 L474 | L211-L422 HydrophobicContact CD2-CD1 3.94Å; L263-L422 HydrophobicContact CD2-CB 3.9Å; T418-L422 HydrophobicContact CG2-CD1 4.29Å; T418-L422 WeakPolarHBondContact O-CG 3.29Å; T418-L422 PolarHBondContact O-N 3.33Å; L420-L422 VanDerWaalsContact C-N 3.33Å; L420-L422 PolarHBondContact O-N 2.88Å; L422-V424 VanDerWaalsContact C-N 3.29Å; L422-V424 PolarHBondContact O-N 3.4Å; L422-V425 PolarHBondContact O-N 3.02Å; L422-Y426 VanDerWaalsContact O-CB 3.28Å; L422-Y426 WeakPolarHBondContact O-CB 3.22Å; L422-Y426 PolarHBondContact O-N 2.8Å; L422-T470 HydrophobicContact CD2-CG2 3.82Å; L422-L473 HydrophobicContact CD2-CD2 4.33Å; L422-L474 HydrophobicContact CD1-CD2 4.08Å; L422-L474 HydrophobicContact CD2-CD2 3.97Å; L422-L474 HydrophobicContact CD2-CG 4.29Å; L422-L474 HydrophobicContact CG-CD2 4.31Å |
| 423 | A | 93.4 | Very high | 90.5 | Very high | 8 Ų | 8 | 41.5 Ų | 41.5 | 7% | 0.066 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.4 | -32.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L419 L420 G427 | L419-A423 WeakPolarHBondContact O-CB 3.5Å; L419-A423 PolarHBondContact O-N 3.37Å; L420-A423 PolarHBondContact O-N 3.04Å; A423-G427 PolarHBondContact O-N 3.05Å |
| 424 | V | 93.6 | Very high | 90.6 | Very high | 69 Ų | 69 | 32.9 Ų | 32.9 | 42% | 0.418 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -70.6 | -45.6 | 174.6 | 168.3 | 0 | 0 | 0 | 0 | 111.7 | L420 A421 L422 G427 I428 | L420-V424 HydrophobicContact CD1-CG2 4.09Å; L420-V424 HydrophobicContact CG-CG2 4.4Å; L420-V424 WeakPolarHBondContact O-CG2 3.41Å; L420-V424 PolarHBondContact O-N 3.11Å; A421-V424 PolarHBondContact O-N 3.32Å; L422-V424 VanDerWaalsContact C-N 3.29Å; L422-V424 PolarHBondContact O-N 3.4Å; V424-G427 PolarHBondContact O-N 2.99Å; V424-I428 HydrophobicContact CG1-CD1 3.64Å; V424-I428 HydrophobicContact CG1-CG1 4.4Å; V424-I428 WeakPolarHBondContact O-CB 3.38Å; V424-I428 VanDerWaalsContact O-CG1 3.29Å; V424-I428 WeakPolarHBondContact O-CG1 3.46Å; V424-I428 PolarHBondContact O-N 3.42Å |
| 425 | V | 94 | Very high | 90.7 | Very high | 23 Ų | 23 | 33.2 Ų | 33.2 | 14% | 0.139 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -63.7 | -43.8 | 175.6 | 168.7 | 0 | 0 | 0 | 0 | 111 | A421 L422 I428 C429 V469 L473 | A421-V425 PolarHBondContact O-N 3.48Å; L422-V425 PolarHBondContact O-N 3.02Å; V425-I428 PolarHBondContact O-N 3.33Å; V425-C429 WeakPolarHBondContact O-CB 3.41Å; V425-C429 PolarHBondContact O-N 2.9Å; V425-C429 PolarHBondContact O-SG 3.48Å; V425-V469 HydrophobicContact CG1-CB 4.46Å; V425-V469 HydrophobicContact CG1-CG1 4.07Å; V425-V469 HydrophobicContact CG2-CG1 4.11Å; V425-L473 HydrophobicContact CG2-CD2 3.91Å |
| 426 | Y | 93.3 | Very high | 90.4 | Very high | 6 Ų | 6 | 33.7 Ų | 33.7 | 2% | 0.024 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -56.3 | -50.8 | 173.2 | -177.3 | -101.5 | 0 | 0 | 0 | 111.5 | L256 T259 S260 L263 Y365 V370 L422 I428 C429 A430 K466 | L256-Y426 HydrophobicContact CD1-CE2 3.77Å; L256-Y426 WeakPolarHBondContact CD1-OH 3.24Å; T259-Y426 WeakPolarHBondContact OG1-CE2 3.4Å; S260-Y426 PolarHBondContact OG-OH 2.74Å; L263-Y426 HydrophobicContact CD1-CD1 3.96Å; L263-Y426 HydrophobicContact CD1-CD2 4.24Å; L263-Y426 HydrophobicContact CD1-CG 3.77Å; Y365-Y426 WeakPolarHBondContact O-CE1 3.22Å; Y365-Y426 PolarHBondContact O-OH 2.79Å; V370-Y426 HydrophobicContact CG2-CD1 3.97Å; V370-Y426 HydrophobicContact CG2-CE1 4.2Å; L422-Y426 VanDerWaalsContact O-CB 3.28Å; L422-Y426 WeakPolarHBondContact O-CB 3.22Å; L422-Y426 PolarHBondContact O-N 2.8Å; Y426-I428 PolarHBondContact O-N 3.15Å; Y426-C429 PolarHBondContact O-N 2.96Å; Y426-A430 WeakPolarHBondContact O-CB 3.31Å; Y426-A430 PolarHBondContact O-N 3.44Å; Y426-K466 HydrophobicContact CD2-CD 4.48Å |
| 427 | G | 91.8 | Very high | 90.1 | Very high | 13 Ų | 13 | 34.5 Ų | 34.5 | 13% | 0.134 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.6 | -48.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | A423 V424 C429 L431 | A423-G427 PolarHBondContact O-N 3.05Å; V424-G427 PolarHBondContact O-N 2.99Å; G427-C429 PolarHBondContact O-N 3.16Å; G427-L431 WeakPolarHBondContact O-CB 3.39Å; G427-L431 PolarHBondContact O-N 2.03Å |
| 428 | I | 91.7 | Very high | 89.8 | Confident | 114 Ų | 114 | 33 Ų | 33 | 59% | 0.585 | 19% | 0.192 | S | C | * | . | H | α-helix | trans | -65.6 | -36.9 | -178.1 | -70.4 | 169.6 | 0 | 0 | 0 | 112 | V424 V425 Y426 P432 | V424-I428 HydrophobicContact CG1-CD1 3.64Å; V424-I428 HydrophobicContact CG1-CG1 4.4Å; V424-I428 WeakPolarHBondContact O-CB 3.38Å; V424-I428 VanDerWaalsContact O-CG1 3.29Å; V424-I428 WeakPolarHBondContact O-CG1 3.46Å; V424-I428 PolarHBondContact O-N 3.42Å; V425-I428 PolarHBondContact O-N 3.33Å; Y426-I428 PolarHBondContact O-N 3.15Å; I428-P432 VanDerWaalsContact O-CD 3.23Å; I428-P432 WeakPolarHBondContact O-CD 3.47Å |
| 429 | C | 91.8 | Very high | 89.4 | Confident | 14 Ų | 14 | 36.3 Ų | 36.3 | 10% | 0.095 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -80.6 | -35.2 | -178 | -57.4 | 0 | 0 | 0 | 0 | 112.9 | V425 Y426 G427 K466 | V425-C429 WeakPolarHBondContact O-CB 3.41Å; V425-C429 PolarHBondContact O-N 2.9Å; V425-C429 PolarHBondContact O-SG 3.48Å; Y426-C429 PolarHBondContact O-N 2.96Å; G427-C429 PolarHBondContact O-N 3.16Å; C429-K466 HydrophobicContact CB-CB 3.82Å; C429-K466 HydrophobicContact CB-CG 4.34Å |
| 430 | A | 88.4 | Confident | 88.9 | Confident | 4 Ų | 4 | 39.2 Ų | 39.2 | 3% | 0.033 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -89.4 | -27.9 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | L256 F366 Y426 E433 H434 | L256-A430 HydrophobicContact CD1-CB 4.4Å; F366-A430 HydrophobicContact CD2-CB 3.92Å; F366-A430 HydrophobicContact CE2-CB 4.2Å; Y426-A430 WeakPolarHBondContact O-CB 3.31Å; Y426-A430 PolarHBondContact O-N 3.44Å; A430-E433 PolarHBondContact O-N 3.25Å; A430-H434 PolarHBondContact O-CD2 3.02Å; A430-H434 PolarHBondContact O-N 3.17Å |
| 431 | L | 88.1 | Confident | 88.2 | Confident | 84 Ų | 84 | 39.3 Ų | 39.3 | 44% | 0.44 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -58 | -44.5 | -177.9 | -180 | 153.3 | 0 | 0 | 0 | 113.8 | F366 G427 E433 H434 V435 | F366-L431 HydrophobicContact CE2-CB 3.88Å; F366-L431 HydrophobicContact CZ-CB 3.78Å; F366-L431 HydrophobicContact CZ-CD1 4.07Å; F366-L431 HydrophobicContact CZ-CG 4.23Å; G427-L431 WeakPolarHBondContact O-CB 3.39Å; G427-L431 PolarHBondContact O-N 2.03Å; L431-E433 PolarHBondContact O-N 3.43Å; L431-H434 PolarHBondContact O-N 3.1Å; L431-V435 HydrophobicContact CD2-CG2 3.78Å; L431-V435 HydrophobicContact CG-CG2 3.94Å; L431-V435 WeakPolarHBondContact O-CB 3.14Å; L431-V435 VanDerWaalsContact O-CG2 3.29Å; L431-V435 WeakPolarHBondContact O-CG2 3.44Å; L431-V435 PolarHBondContact O-N 2.95Å |
| 432 | P | 87.4 | Confident | 87.7 | Confident | 41 Ų | 41 | 42.1 Ų | 42.1 | 27% | 0.266 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -61.2 | -42.9 | -176.8 | -26 | 36.8 | 0 | 0 | 0 | 113 | I428 C436 L462 | I428-P432 VanDerWaalsContact O-CD 3.23Å; I428-P432 WeakPolarHBondContact O-CD 3.47Å; P432-C436 WeakPolarHBondContact O-CB 2.99Å; P432-C436 PolarHBondContact O-N 3.47Å; P432-C436 PolarHBondContact O-SG 3.41Å; P432-L462 HydrophobicContact CB-CD1 3.84Å; P432-L462 HydrophobicContact CG-CD1 3.84Å |
| 433 | E | 84.4 | Confident | 87 | Confident | 33 Ų | 33 | 45 Ų | 45 | 15% | 0.154 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -57.4 | -56.2 | 175.6 | 177.5 | -149.3 | 124.7 | 0 | 0 | 110.9 | A430 L431 V435 C436 N437 H459 | A430-E433 PolarHBondContact O-N 3.25Å; L431-E433 PolarHBondContact O-N 3.43Å; E433-V435 PolarHBondContact O-N 2.95Å; E433-C436 PolarHBondContact O-N 3.38Å; E433-N437 WeakPolarHBondContact O-CB 3.34Å; E433-N437 PolarHBondContact O-N 2.67Å; E433-H459 WeakPolarHBondContact CG-ND1 3.24Å; E433-H459 IonicContact OE2-CE1 2.65Å; E433-H459 PolarHBondContact OE2-CE1 3.24Å; E433-H459 IonicContact OE2-ND1 2.73Å; E433-H459 PolarHBondContact OE2-ND1 3.28Å |
| 434 | H | 86.3 | Confident | 86 | Confident | 6 Ų | 6 | 52.8 Ų | 52.8 | 3% | 0.028 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -67.1 | -36.5 | -175.2 | -54.7 | -29.6 | 0 | 0 | 0 | 112.3 | F362 F366 A430 L431 I438 | F362-H434 HydrophobicContact CD2-CB 3.9Å; F366-H434 VanDerWaalsContact CB-CD2 3.41Å; F366-H434 WeakPolarHBondContact CB-CD2 3.47Å; F366-H434 AromaticContact CD2-CD2 3.59Å; F366-H434 AromaticContact CD2-NE2 4Å; F366-H434 AromaticContact CG-CD2 3.59Å; A430-H434 PolarHBondContact O-CD2 3.02Å; A430-H434 PolarHBondContact O-N 3.17Å; L431-H434 PolarHBondContact O-N 3.1Å; H434-I438 WeakPolarHBondContact O-CB 3.35Å; H434-I438 WeakPolarHBondContact O-CD1 3.39Å; H434-I438 VanDerWaalsContact O-CG1 3.25Å; H434-I438 WeakPolarHBondContact O-CG1 3.31Å; H434-I438 PolarHBondContact O-N 3.47Å |
| 435 | V | 86.8 | Confident | 85.1 | Confident | 66 Ų | 66 | 54.7 Ų | 54.7 | 40% | 0.4 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.9 | -43.7 | 174.7 | 168.6 | 0 | 0 | 0 | 0 | 111 | L431 E433 T439 | L431-V435 HydrophobicContact CD2-CG2 3.78Å; L431-V435 HydrophobicContact CG-CG2 3.94Å; L431-V435 WeakPolarHBondContact O-CB 3.14Å; L431-V435 VanDerWaalsContact O-CG2 3.29Å; L431-V435 WeakPolarHBondContact O-CG2 3.44Å; L431-V435 PolarHBondContact O-N 2.95Å; E433-V435 PolarHBondContact O-N 2.95Å; V435-T439 VanDerWaalsContact O-CB 3.27Å; V435-T439 WeakPolarHBondContact O-CB 3.26Å; V435-T439 PolarHBondContact O-N 3.37Å; V435-T439 PolarHBondContact O-OG1 3.18Å |
| 436 | C | 83.5 | Confident | 84 | Confident | 43 Ų | 43 | 60 Ų | 60 | 29% | 0.291 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -67.1 | -44.8 | 177.6 | -65.2 | 0 | 0 | 0 | 0 | 111.7 | P432 E433 I438 T439 L440 L455 | P432-C436 WeakPolarHBondContact O-CB 2.99Å; P432-C436 PolarHBondContact O-N 3.47Å; P432-C436 PolarHBondContact O-SG 3.41Å; E433-C436 PolarHBondContact O-N 3.38Å; C436-I438 PolarHBondContact O-N 3.31Å; C436-T439 PolarHBondContact O-N 3.19Å; C436-L440 WeakPolarHBondContact O-CB 3.5Å; C436-L440 PolarHBondContact O-N 2.85Å; C436-L455 HydrophobicContact CB-CD1 3.74Å; C436-L455 HydrophobicContact CB-CD2 3.84Å; C436-L455 HydrophobicContact CB-CG 4.42Å |
| 437 | N | 82 | Confident | 83.2 | Confident | 46 Ų | 46 | 63.1 Ų | 63.1 | 25% | 0.246 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -61.9 | -39.1 | 178.3 | -76.7 | -14.8 | 0 | 0 | 0 | 112.8 | M358 E433 A441 | M358-N437 HydrophobicContact CE-CB 3.84Å; M358-N437 HydrophobicContact SD-CB 3.95Å; E433-N437 WeakPolarHBondContact O-CB 3.34Å; E433-N437 PolarHBondContact O-N 2.67Å; N437-A441 WeakPolarHBondContact O-CB 3.38Å; N437-A441 PolarHBondContact O-N 2.68Å |
| 438 | I | 83.8 | Confident | 82.6 | Confident | 30 Ų | 30 | 66.8 Ų | 66.8 | 15% | 0.154 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -71.8 | -42.7 | 174.2 | -69 | 167.2 | 0 | 0 | 0 | 111.1 | F362 H434 C436 L440 A441 C442 | F362-I438 HydrophobicContact CB-CD1 3.78Å; F362-I438 HydrophobicContact CD1-CD1 3.57Å; F362-I438 HydrophobicContact CD2-CD1 3.79Å; F362-I438 HydrophobicContact CE1-CD1 4.01Å; F362-I438 HydrophobicContact CE2-CD1 4.21Å; F362-I438 HydrophobicContact CG-CD1 3.43Å; F362-I438 VanDerWaalsContact CG-CD1 3.43Å; F362-I438 HydrophobicContact CZ-CD1 4.31Å; H434-I438 WeakPolarHBondContact O-CB 3.35Å; H434-I438 WeakPolarHBondContact O-CD1 3.39Å; H434-I438 VanDerWaalsContact O-CG1 3.25Å; H434-I438 WeakPolarHBondContact O-CG1 3.31Å; H434-I438 PolarHBondContact O-N 3.47Å; C436-I438 PolarHBondContact O-N 3.31Å; I438-L440 VanDerWaalsContact C-N 3.32Å; I438-L440 PolarHBondContact O-N 3.04Å; I438-A441 PolarHBondContact O-N 2.91Å; I438-C442 WeakPolarHBondContact O-CB 3.5Å; I438-C442 PolarHBondContact O-N 3.19Å; I438-C442 PolarHBondContact O-SG 2.91Å; I438-C442 VanDerWaalsContact O-SG 3.41Å |
| 439 | T | 84.3 | Confident | 81.9 | Confident | 72 Ų | 72 | 67.6 Ų | 67.6 | 44% | 0.442 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60.8 | -42.5 | 179.5 | -58.5 | 0 | 0 | 0 | 0 | 111.3 | V435 C436 C442 T443 | V435-T439 VanDerWaalsContact O-CB 3.27Å; V435-T439 WeakPolarHBondContact O-CB 3.26Å; V435-T439 PolarHBondContact O-N 3.37Å; V435-T439 PolarHBondContact O-OG1 3.18Å; C436-T439 PolarHBondContact O-N 3.19Å; T439-C442 PolarHBondContact O-N 3.14Å; T439-T443 HydrophobicContact CG2-CG2 4.16Å; T439-T443 WeakPolarHBondContact O-CB 3.11Å; T439-T443 WeakPolarHBondContact O-CG2 3.5Å; T439-T443 PolarHBondContact O-N 3.25Å; T439-T443 PolarHBondContact O-OG1 3.34Å |
| 440 | L | 81.2 | Confident | 81.2 | Confident | 60 Ų | 60 | 69.1 Ų | 69.1 | 31% | 0.314 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -56.7 | -51.7 | 171.7 | -89.6 | 164.3 | 0 | 0 | 0 | 112 | C436 I438 C442 H444 I447 L455 | C436-L440 WeakPolarHBondContact O-CB 3.5Å; C436-L440 PolarHBondContact O-N 2.85Å; I438-L440 VanDerWaalsContact C-N 3.32Å; I438-L440 PolarHBondContact O-N 3.04Å; L440-C442 VanDerWaalsContact C-N 3.32Å; L440-C442 PolarHBondContact O-N 3.27Å; L440-H444 PolarHBondContact O-N 3.34Å; L440-I447 HydrophobicContact CD1-CD1 4.38Å; L440-I447 HydrophobicContact CD2-CD1 3.52Å; L440-I447 HydrophobicContact CD2-CG1 3.76Å; L440-I447 HydrophobicContact CG-CD1 4.04Å; L440-L455 HydrophobicContact CD1-CD2 4.11Å |
| 441 | A | 79.5 | Confident | 80.8 | Confident | 62 Ų | 62 | 72.8 Ų | 72.8 | 51% | 0.512 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -64.3 | -32.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | N437 I438 | N437-A441 WeakPolarHBondContact O-CB 3.38Å; N437-A441 PolarHBondContact O-N 2.68Å; I438-A441 PolarHBondContact O-N 2.91Å |
| 442 | C | 81.8 | Confident | 80.5 | Confident | 82 Ų | 82 | 71 Ų | 71 | 55% | 0.554 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -87.9 | -24.1 | -177.2 | -70.7 | 0 | 0 | 0 | 0 | 114.7 | I438 T439 L440 | I438-C442 WeakPolarHBondContact O-CB 3.5Å; I438-C442 PolarHBondContact O-N 3.19Å; I438-C442 PolarHBondContact O-SG 2.91Å; I438-C442 VanDerWaalsContact O-SG 3.41Å; T439-C442 PolarHBondContact O-N 3.14Å; L440-C442 VanDerWaalsContact C-N 3.32Å; L440-C442 PolarHBondContact O-N 3.27Å |
| 443 | T | 79.6 | Confident | 80.1 | Confident | 68 Ų | 68 | 71.4 Ų | 71.4 | 42% | 0.417 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -101 | -17.7 | -176.4 | 60.2 | 0 | 0 | 0 | 0 | 114 | T439 I445 | T439-T443 HydrophobicContact CG2-CG2 4.16Å; T439-T443 WeakPolarHBondContact O-CB 3.11Å; T439-T443 WeakPolarHBondContact O-CG2 3.5Å; T439-T443 PolarHBondContact O-N 3.25Å; T439-T443 PolarHBondContact O-OG1 3.34Å; T443-I445 HydrophobicContact CG2-CD1 4.4Å; T443-I445 PolarHBondContact O-N 3.29Å; T443-I445 VanDerWaalsContact O-N 3.08Å |
| 444 | H | 72.9 | Confident | 80 | Confident | 173 Ų | 173 | 75.5 Ų | 75.5 | 80% | 0.801 | 45% | 0.454 | S | S | * | . | trans | 56.7 | 20.6 | -178.4 | -148.8 | -69.5 | 0 | 0 | 0 | 114.2 | L440 T446 | L440-H444 PolarHBondContact O-N 3.34Å; H444-T446 PolarHBondContact O-N 2.92Å | ||
| 445 | I | 75.4 | Confident | 80 | Confident | 109 Ų | 109 | 77 Ų | 77 | 56% | 0.559 | 46% | 0.462 | S | S | * | . | trans | -75.3 | 124.2 | 179.6 | -65.6 | 169.5 | 0 | 0 | 0 | 109.5 | T443 I447 | T443-I445 HydrophobicContact CG2-CD1 4.4Å; T443-I445 PolarHBondContact O-N 3.29Å; T443-I445 VanDerWaalsContact O-N 3.08Å; I445-I447 PolarHBondContact O-N 3.15Å; I445-I447 VanDerWaalsContact O-N 3.1Å | ||
| 446 | T | 71.1 | Confident | 79.8 | Confident | 135 Ų | 135 | 79 Ų | 79 | 83% | 0.828 | 47% | 0.466 | S | S | * | . | trans | -71.8 | 98.2 | 170.7 | 40.5 | 0 | 0 | 0 | 0 | 110.5 | H444 | H444-T446 PolarHBondContact O-N 2.92Š| ||
| 447 | I | 74.9 | Confident | 79.9 | Confident | 70 Ų | 70 | 79.9 Ų | 79.9 | 36% | 0.359 | 47% | 0.468 | S | S | . | . | trans | -71.5 | 136 | 175.5 | -66.3 | -167.2 | 0 | 0 | 0 | 110.3 | L440 I445 T451 A452 | L440-I447 HydrophobicContact CD1-CD1 4.38Å; L440-I447 HydrophobicContact CD2-CD1 3.52Å; L440-I447 HydrophobicContact CD2-CG1 3.76Å; L440-I447 HydrophobicContact CG-CD1 4.04Å; I445-I447 PolarHBondContact O-N 3.15Å; I445-I447 VanDerWaalsContact O-N 3.1Å; I447-T451 HydrophobicContact CG2-CG2 3.67Å; I447-A452 HydrophobicContact CG2-CB 4.41Å | ||
| 448 | S | 80.6 | Confident | 80.2 | Confident | 91 Ų | 91 | 81.4 Ų | 81.4 | 64% | 0.636 | 48% | 0.476 | S | S | * | . | trans | -61.9 | 135.6 | 171.7 | 177.6 | 0 | 0 | 0 | 0 | 111.4 | G450 T451 A452 | S448-G450 PolarHBondContact O-N 3.2Å; S448-T451 WeakPolarHBondContact O-CB 3.38Å; S448-T451 PolarHBondContact O-N 3.18Å; S448-A452 PolarHBondContact O-N 3.42Å | ||
| 449 | E | 75.8 | Confident | 80.4 | Confident | 131 Ų | 131 | 82.1 Ų | 82.1 | 61% | 0.612 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -47.2 | -41.3 | -172.8 | -59.8 | -176.8 | 158.9 | 0 | 0 | 114.3 | P321 T451 A452 A453 | P321-E449 WeakPolarHBondContact CG-OE2 3.44Å; E449-T451 VanDerWaalsContact C-N 3.3Å; E449-T451 PolarHBondContact O-N 2.9Å; E449-A452 WeakPolarHBondContact O-CB 3.43Å; E449-A452 PolarHBondContact O-N 2.95Å; E449-A452 VanDerWaalsContact O-N 3.14Å; E449-A453 PolarHBondContact O-N 3.2Å |
| 450 | G | 76.6 | Confident | 80.7 | Confident | 45 Ų | 45 | 80 Ų | 80 | 46% | 0.464 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -61.9 | -35.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | S448 I454 | S448-G450 PolarHBondContact O-N 3.2Å; G450-I454 WeakPolarHBondContact O-CD1 3.49Å; G450-I454 VanDerWaalsContact O-CG1 3.24Å; G450-I454 WeakPolarHBondContact O-CG1 3.39Å; G450-I454 PolarHBondContact O-N 3.39Å; G450-I454 VanDerWaalsContact O-N 3.13Å |
| 451 | T | 82 | Confident | 81.2 | Confident | 81 Ų | 81 | 80.2 Ų | 80.2 | 50% | 0.497 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -75.1 | -33.7 | 175.4 | -60.5 | 0 | 0 | 0 | 0 | 111.5 | I447 S448 E449 I454 L455 | I447-T451 HydrophobicContact CG2-CG2 3.67Å; S448-T451 WeakPolarHBondContact O-CB 3.38Å; S448-T451 PolarHBondContact O-N 3.18Å; E449-T451 VanDerWaalsContact C-N 3.3Å; E449-T451 PolarHBondContact O-N 2.9Å; T451-I454 PolarHBondContact O-N 2.81Å; T451-L455 WeakPolarHBondContact O-CB 3.39Å; T451-L455 PolarHBondContact O-N 3.03Å |
| 452 | A | 80.4 | Confident | 81.9 | Confident | 47 Ų | 47 | 78.4 Ų | 78.4 | 39% | 0.388 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.7 | -44.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | I447 S448 E449 I454 L455 E456 | I447-A452 HydrophobicContact CG2-CB 4.41Å; S448-A452 PolarHBondContact O-N 3.42Å; E449-A452 WeakPolarHBondContact O-CB 3.43Å; E449-A452 PolarHBondContact O-N 2.95Å; E449-A452 VanDerWaalsContact O-N 3.14Å; A452-I454 PolarHBondContact O-N 3.45Å; A452-L455 WeakPolarHBondContact O-CB 3.47Å; A452-L455 PolarHBondContact O-N 3.24Å; A452-E456 PolarHBondContact O-N 2.84Å |
| 453 | A | 79.6 | Confident | 82.4 | Confident | 50 Ų | 50 | 75.5 Ų | 75.5 | 41% | 0.413 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.5 | -38 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | E449 L457 | E449-A453 PolarHBondContact O-N 3.2Å; A453-L457 WeakPolarHBondContact O-CB 3.46Å; A453-L457 PolarHBondContact O-N 2.85Å |
| 454 | I | 83.1 | Confident | 83.2 | Confident | 119 Ų | 119 | 72.9 Ų | 72.9 | 61% | 0.61 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -64.9 | -40 | 173.4 | -70.3 | 164.6 | 0 | 0 | 0 | 111 | G450 T451 A452 L457 L458 | G450-I454 WeakPolarHBondContact O-CD1 3.49Å; G450-I454 VanDerWaalsContact O-CG1 3.24Å; G450-I454 WeakPolarHBondContact O-CG1 3.39Å; G450-I454 PolarHBondContact O-N 3.39Å; G450-I454 VanDerWaalsContact O-N 3.13Å; T451-I454 PolarHBondContact O-N 2.81Å; A452-I454 PolarHBondContact O-N 3.45Å; I454-L457 PolarHBondContact O-N 3.03Å; I454-L458 WeakPolarHBondContact O-CB 3.5Å; I454-L458 PolarHBondContact O-N 3.02Å |
| 455 | L | 84.4 | Confident | 84.2 | Confident | 38 Ų | 38 | 67.2 Ų | 67.2 | 20% | 0.199 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -66.9 | -42.1 | 177.2 | 178.8 | 61.5 | 0 | 0 | 0 | 112.1 | C436 L440 T451 A452 L458 H459 | C436-L455 HydrophobicContact CB-CD1 3.74Å; C436-L455 HydrophobicContact CB-CD2 3.84Å; C436-L455 HydrophobicContact CB-CG 4.42Å; L440-L455 HydrophobicContact CD1-CD2 4.11Å; T451-L455 WeakPolarHBondContact O-CB 3.39Å; T451-L455 PolarHBondContact O-N 3.03Å; A452-L455 WeakPolarHBondContact O-CB 3.47Å; A452-L455 PolarHBondContact O-N 3.24Å; L455-L458 PolarHBondContact O-N 2.71Å; L455-H459 PolarHBondContact O-N 3.07Å |
| 456 | E | 83.3 | Confident | 85.1 | Confident | 106 Ų | 106 | 62.4 Ų | 62.4 | 50% | 0.495 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -60.2 | -45.2 | 173.8 | -177.8 | -179.8 | 175.4 | 0 | 0 | 111.4 | A452 H459 H460 | A452-E456 PolarHBondContact O-N 2.84Å; E456-H459 PolarHBondContact O-N 3.12Å; E456-H460 VanDerWaalsContact CG-CE1 3.5Å; E456-H460 WeakPolarHBondContact CG-CE1 3.47Å; E456-H460 PolarHBondContact O-N 2.88Å; E456-H460 VanDerWaalsContact O-N 3.11Å; E456-H460 PolarHBondContact O-ND1 2.87Å; E456-H460 IonicContact OE1-CE1 2.68Å |
| 457 | L | 85.2 | Confident | 86.3 | Confident | 63 Ų | 63 | 56 Ų | 56 | 33% | 0.33 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -65.1 | -39 | 177.2 | -176.5 | 144.4 | 0 | 0 | 0 | 112.3 | V175 A453 I454 F461 | V175-L457 HydrophobicContact CG2-CD1 3.9Å; A453-L457 WeakPolarHBondContact O-CB 3.46Å; A453-L457 PolarHBondContact O-N 2.85Å; I454-L457 PolarHBondContact O-N 3.03Å; L457-F461 WeakPolarHBondContact O-CB 3.37Å; L457-F461 PolarHBondContact O-N 3.23Å |
| 458 | L | 88.3 | Confident | 87.3 | Confident | 77 Ų | 77 | 52.9 Ų | 52.9 | 40% | 0.403 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -64.6 | -42.3 | 175.4 | 179.2 | 61.5 | 0 | 0 | 0 | 111.9 | I454 L455 F461 L462 | I454-L458 WeakPolarHBondContact O-CB 3.5Å; I454-L458 PolarHBondContact O-N 3.02Å; L455-L458 PolarHBondContact O-N 2.71Å; L458-F461 PolarHBondContact O-N 3.39Å; L458-L462 HydrophobicContact CD1-CD1 4.1Å; L458-L462 HydrophobicContact CD1-CG 4.17Å; L458-L462 HydrophobicContact CG-CD1 4.05Å; L458-L462 WeakPolarHBondContact O-CB 3.5Å; L458-L462 VanDerWaalsContact O-CG 3.3Å; L458-L462 WeakPolarHBondContact O-CG 3.33Å; L458-L462 PolarHBondContact O-N 3.08Å |
| 459 | H | 88.9 | Confident | 88.1 | Confident | 46 Ų | 46 | 51 Ų | 51 | 21% | 0.213 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -59 | -55.4 | 175.5 | 159.3 | 68 | 0 | 0 | 0 | 111.5 | E433 L455 E456 F461 L462 L463 | E433-H459 WeakPolarHBondContact CG-ND1 3.24Å; E433-H459 IonicContact OE2-CE1 2.65Å; E433-H459 PolarHBondContact OE2-CE1 3.24Å; E433-H459 IonicContact OE2-ND1 2.73Å; E433-H459 PolarHBondContact OE2-ND1 3.28Å; L455-H459 PolarHBondContact O-N 3.07Å; E456-H459 PolarHBondContact O-N 3.12Å; H459-F461 VanDerWaalsContact C-N 3.29Å; H459-F461 PolarHBondContact O-N 2.71Å; H459-L462 PolarHBondContact O-N 3.11Å; H459-L463 WeakPolarHBondContact O-CB 3.27Å; H459-L463 PolarHBondContact O-N 3.4Å |
| 460 | H | 90.8 | Very high | 89 | Confident | 28 Ų | 28 | 45.3 Ų | 45.3 | 13% | 0.13 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -58.8 | -41 | 179.2 | -69.5 | 103.5 | 0 | 0 | 0 | 111.6 | V229 E252 E456 L463 F464 | V229-H460 HydrophobicContact CG1-CB 4.15Å; E252-H460 IonicContact OE1-CD2 2.71Å; E456-H460 VanDerWaalsContact CG-CE1 3.5Å; E456-H460 WeakPolarHBondContact CG-CE1 3.47Å; E456-H460 PolarHBondContact O-N 2.88Å; E456-H460 VanDerWaalsContact O-N 3.11Å; E456-H460 PolarHBondContact O-ND1 2.87Å; E456-H460 IonicContact OE1-CE1 2.68Å; H460-L463 PolarHBondContact O-N 2.8Å; H460-F464 HydrophobicContact CB-CE2 4.03Å; H460-F464 WeakPolarHBondContact O-CD2 3.25Å; H460-F464 WeakPolarHBondContact O-CG 3.37Å; H460-F464 PolarHBondContact O-N 2.82Å |
| 461 | F | 91.7 | Very high | 89.8 | Confident | 63 Ų | 63 | 43.2 Ų | 43.2 | 28% | 0.276 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -61.8 | -47 | 176.1 | 174.4 | -113 | 0 | 0 | 0 | 112.7 | L178 V182 L457 L458 H459 L463 F464 L465 | L178-F461 HydrophobicContact CD1-CE2 3.74Å; L178-F461 HydrophobicContact CD1-CZ 4.2Å; L178-F461 HydrophobicContact CD2-CD2 3.77Å; L178-F461 HydrophobicContact CD2-CE2 3.54Å; L178-F461 HydrophobicContact CD2-CG 4.49Å; L178-F461 HydrophobicContact CD2-CZ 4.06Å; L178-F461 HydrophobicContact CG-CD2 4.04Å; L178-F461 HydrophobicContact CG-CE2 3.61Å; L178-F461 HydrophobicContact CG-CZ 4.39Å; V182-F461 HydrophobicContact CG2-CE2 4.15Å; L457-F461 WeakPolarHBondContact O-CB 3.37Å; L457-F461 PolarHBondContact O-N 3.23Å; L458-F461 PolarHBondContact O-N 3.39Å; H459-F461 VanDerWaalsContact C-N 3.29Å; H459-F461 PolarHBondContact O-N 2.71Å; F461-L463 VanDerWaalsContact C-N 3.3Å; F461-L463 PolarHBondContact O-N 3.33Å; F461-F464 PolarHBondContact O-N 3.14Å; F461-L465 HydrophobicContact CE1-CD2 4.07Å; F461-L465 HydrophobicContact CZ-CB 4.44Å; F461-L465 HydrophobicContact CZ-CD1 4.39Å; F461-L465 HydrophobicContact CZ-CD2 4.04Å; F461-L465 WeakPolarHBondContact O-CB 3.33Å; F461-L465 PolarHBondContact O-N 3.1Å |
| 462 | L | 93.2 | Very high | 90.4 | Very high | 25 Ų | 25 | 42 Ų | 42 | 13% | 0.131 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.8 | -37.6 | 177.3 | -72.2 | 170.7 | 0 | 0 | 0 | 112 | P432 L458 H459 L465 K466 | P432-L462 HydrophobicContact CB-CD1 3.84Å; P432-L462 HydrophobicContact CG-CD1 3.84Å; L458-L462 HydrophobicContact CD1-CD1 4.1Å; L458-L462 HydrophobicContact CD1-CG 4.17Å; L458-L462 HydrophobicContact CG-CD1 4.05Å; L458-L462 WeakPolarHBondContact O-CB 3.5Å; L458-L462 VanDerWaalsContact O-CG 3.3Å; L458-L462 WeakPolarHBondContact O-CG 3.33Å; L458-L462 PolarHBondContact O-N 3.08Å; H459-L462 PolarHBondContact O-N 3.11Å; L462-L465 PolarHBondContact O-N 3.29Å; L462-K466 WeakPolarHBondContact O-CB 3.4Å; L462-K466 PolarHBondContact O-N 3.31Å |
| 463 | L | 93.6 | Very high | 91.1 | Very high | 20 Ų | 20 | 41.4 Ų | 41.4 | 11% | 0.105 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -63.9 | -48.4 | 176.7 | -172.4 | 149.5 | 0 | 0 | 0 | 111.7 | V221 E252 H459 H460 F461 K466 C467 | V221-L463 HydrophobicContact CG1-CD2 3.73Å; E252-L463 HydrophobicContact CB-CD1 3.72Å; E252-L463 HydrophobicContact CG-CD1 3.83Å; E252-L463 HydrophobicContact CG-CD2 3.98Å; H459-L463 WeakPolarHBondContact O-CB 3.27Å; H459-L463 PolarHBondContact O-N 3.4Å; H460-L463 PolarHBondContact O-N 2.8Å; F461-L463 VanDerWaalsContact C-N 3.3Å; F461-L463 PolarHBondContact O-N 3.33Å; L463-K466 WeakPolarHBondContact O-CB 3.46Å; L463-K466 PolarHBondContact O-N 2.92Å; L463-C467 PolarHBondContact O-N 3.11Å; L463-C467 PolarHBondContact O-SG 3.24Å |
| 464 | F | 95.3 | Very high | 91.8 | Very high | 14 Ų | 14 | 39.1 Ų | 39.1 | 6% | 0.061 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -70.4 | -34.9 | 177.1 | -58.7 | -43.4 | 0 | 0 | 0 | 112.4 | V182 V221 L222 C225 L226 V229 H460 F461 K466 C467 A468 | V182-F464 HydrophobicContact CG1-CB 3.74Å; V182-F464 WeakPolarHBondContact CG1-O 3.49Å; V221-F464 HydrophobicContact CG1-CD1 3.98Å; V221-F464 HydrophobicContact CG1-CE1 3.81Å; L222-F464 HydrophobicContact CD2-CB 4.23Å; C225-F464 HydrophobicContact CB-CE1 3.94Å; C225-F464 HydrophobicContact CB-CZ 4.21Å; L226-F464 HydrophobicContact CB-CD1 3.92Å; L226-F464 HydrophobicContact CB-CD2 4.11Å; L226-F464 HydrophobicContact CB-CE1 3.86Å; L226-F464 HydrophobicContact CB-CE2 4.04Å; L226-F464 HydrophobicContact CB-CG 4.07Å; L226-F464 HydrophobicContact CB-CZ 3.94Å; L226-F464 HydrophobicContact CD1-CB 4.06Å; L226-F464 HydrophobicContact CD1-CD1 4.45Å; L226-F464 HydrophobicContact CD1-CD2 4.21Å; L226-F464 HydrophobicContact CD1-CG 3.98Å; L226-F464 HydrophobicContact CG-CD2 4.05Å; L226-F464 HydrophobicContact CG-CE2 4.29Å; L226-F464 HydrophobicContact CG-CG 4.21Å; V229-F464 HydrophobicContact CB-CE2 4.17Å; V229-F464 HydrophobicContact CB-CZ 4.17Å; V229-F464 HydrophobicContact CG1-CE2 4.15Å; V229-F464 HydrophobicContact CG2-CE2 4.48Å; V229-F464 HydrophobicContact CG2-CZ 4.04Å; H460-F464 HydrophobicContact CB-CE2 4.03Å; H460-F464 WeakPolarHBondContact O-CD2 3.25Å; H460-F464 WeakPolarHBondContact O-CG 3.37Å; H460-F464 PolarHBondContact O-N 2.82Å; F461-F464 PolarHBondContact O-N 3.14Å; F464-K466 PolarHBondContact O-N 2.91Å; F464-C467 WeakPolarHBondContact O-CB 2.93Å; F464-C467 PolarHBondContact O-N 3.22Å; F464-C467 VanDerWaalsContact O-N 3.15Å; F464-A468 PolarHBondContact O-N 2.99Å |
| 465 | L | 94.9 | Very high | 92.2 | Very high | 53 Ų | 53 | 34.6 Ų | 34.6 | 28% | 0.277 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -60.7 | -43.1 | 173.9 | -176.3 | 65.8 | 0 | 0 | 0 | 111.4 | F461 L462 C467 A468 V469 | F461-L465 HydrophobicContact CE1-CD2 4.07Å; F461-L465 HydrophobicContact CZ-CB 4.44Å; F461-L465 HydrophobicContact CZ-CD1 4.39Å; F461-L465 HydrophobicContact CZ-CD2 4.04Å; F461-L465 WeakPolarHBondContact O-CB 3.33Å; F461-L465 PolarHBondContact O-N 3.1Å; L462-L465 PolarHBondContact O-N 3.29Å; L465-C467 VanDerWaalsContact C-N 3.34Å; L465-C467 PolarHBondContact O-N 2.8Å; L465-A468 PolarHBondContact O-N 2.73Å; L465-V469 HydrophobicContact CD1-CG2 3.79Å; L465-V469 HydrophobicContact CG-CG2 4.06Å; L465-V469 WeakPolarHBondContact O-CB 3.42Å; L465-V469 VanDerWaalsContact O-CG2 3.31Å; L465-V469 WeakPolarHBondContact O-CG2 2.99Å; L465-V469 PolarHBondContact O-N 3.47Å |
| 466 | K | 94.8 | Very high | 92.5 | Very high | 9 Ų | 9 | 37.3 Ų | 37.3 | 4% | 0.039 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -53.6 | -49.5 | 170.9 | 178.5 | -152.9 | 70.4 | 73.2 | 0 | 111.1 | D218 Y426 C429 L462 L463 F464 A468 V469 T470 | D218-K466 IonicContact OD1-NZ 3.67Å; D218-K466 PolarHBondContact OD1-NZ 3.4Å; D218-K466 IonicContact OD2-NZ 3.16Å; Y426-K466 HydrophobicContact CD2-CD 4.48Å; C429-K466 HydrophobicContact CB-CB 3.82Å; C429-K466 HydrophobicContact CB-CG 4.34Å; L462-K466 WeakPolarHBondContact O-CB 3.4Å; L462-K466 PolarHBondContact O-N 3.31Å; L463-K466 WeakPolarHBondContact O-CB 3.46Å; L463-K466 PolarHBondContact O-N 2.92Å; F464-K466 PolarHBondContact O-N 2.91Å; K466-A468 VanDerWaalsContact C-N 3.25Å; K466-A468 PolarHBondContact O-N 3.4Å; K466-V469 PolarHBondContact O-N 2.73Å; K466-T470 VanDerWaalsContact O-CB 3.23Å; K466-T470 WeakPolarHBondContact O-CB 3.45Å; K466-T470 PolarHBondContact O-N 3.24Å; K466-T470 PolarHBondContact O-OG1 3.17Å |
| 467 | C | 95.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -63.8 | -26.9 | -179 | -63.4 | 0 | 0 | 0 | 0 | 113.6 | N190 D218 L222 L463 F464 L465 P471 | N190-C467 PolarHBondContact ND2-O 3.49Å; D218-C467 HydrophobicContact CB-CB 3.86Å; D218-C467 PolarHBondContact OD1-SG 3.43Å; L222-C467 HydrophobicContact CD1-CB 3.87Å; L222-C467 HydrophobicContact CD2-CB 4.05Å; L222-C467 HydrophobicContact CG-CB 3.74Å; L463-C467 PolarHBondContact O-N 3.11Å; L463-C467 PolarHBondContact O-SG 3.24Å; F464-C467 WeakPolarHBondContact O-CB 2.93Å; F464-C467 PolarHBondContact O-N 3.22Å; F464-C467 VanDerWaalsContact O-N 3.15Å; L465-C467 VanDerWaalsContact C-N 3.34Å; L465-C467 PolarHBondContact O-N 2.8Å; C467-P471 VanDerWaalsContact O-CD 3.24Å; C467-P471 WeakPolarHBondContact O-CD 3.42Å |
| 468 | A | 96.1 | Very high | 92.8 | Very high | 4 Ų | 4 | 32.7 Ų | 32.7 | 3% | 0.033 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -88.4 | -41.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | V182 F464 L465 K466 P471 V472 | V182-A468 HydrophobicContact CG1-CB 4.03Å; F464-A468 PolarHBondContact O-N 2.99Å; L465-A468 PolarHBondContact O-N 2.73Å; K466-A468 VanDerWaalsContact C-N 3.25Å; K466-A468 PolarHBondContact O-N 3.4Å; A468-P471 WeakPolarHBondContact O-CD 3.23Å; A468-P471 WeakPolarHBondContact O-CG 3.37Å; A468-V472 WeakPolarHBondContact O-CG2 3.35Å |
| 469 | V | 95.9 | Very high | 92.4 | Very high | 53 Ų | 53 | 35.9 Ų | 35.9 | 32% | 0.321 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -72.6 | -36 | -178 | 172.3 | 0 | 0 | 0 | 0 | 111.7 | V425 L465 K466 V472 L473 | V425-V469 HydrophobicContact CG1-CB 4.46Å; V425-V469 HydrophobicContact CG1-CG1 4.07Å; V425-V469 HydrophobicContact CG2-CG1 4.11Å; L465-V469 HydrophobicContact CD1-CG2 3.79Å; L465-V469 HydrophobicContact CG-CG2 4.06Å; L465-V469 WeakPolarHBondContact O-CB 3.42Å; L465-V469 VanDerWaalsContact O-CG2 3.31Å; L465-V469 WeakPolarHBondContact O-CG2 2.99Å; L465-V469 PolarHBondContact O-N 3.47Å; K466-V469 PolarHBondContact O-N 2.73Å; V469-V472 PolarHBondContact O-N 3.22Å; V469-L473 WeakPolarHBondContact O-CB 3.48Å; V469-L473 PolarHBondContact O-N 2.81Å |
| 470 | T | 94.7 | Very high | 92 | Very high | 11 Ų | 11 | 36 Ų | 36 | 7% | 0.067 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -53.5 | -54.7 | -178.7 | -64.1 | 0 | 0 | 0 | 0 | 113.9 | I214 L422 K466 L473 L474 | I214-T470 HydrophobicContact CG2-CG2 3.72Å; L422-T470 HydrophobicContact CD2-CG2 3.82Å; K466-T470 VanDerWaalsContact O-CB 3.23Å; K466-T470 WeakPolarHBondContact O-CB 3.45Å; K466-T470 PolarHBondContact O-N 3.24Å; K466-T470 PolarHBondContact O-OG1 3.17Å; T470-L473 WeakPolarHBondContact O-CB 3.4Å; T470-L473 PolarHBondContact O-N 3.41Å; T470-L474 WeakPolarHBondContact O-CG 3.47Å; T470-L474 PolarHBondContact O-N 2.84Å; T470-L474 VanDerWaalsContact O-N 3.14Å |
| 471 | P | 94.8 | Very high | 91.6 | Very high | 1 Ų | 1 | 34.7 Ų | 34.7 | 1% | 0.006 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -67.9 | -34.2 | 177.3 | 30.1 | -41 | 0 | 0 | 0 | 113.7 | A189 N190 V193 C467 A468 L473 L474 L475 | A189-P471 HydrophobicContact CB-CB 3.74Å; A189-P471 HydrophobicContact CB-CG 3.55Å; N190-P471 HydrophobicContact CB-CG 4.47Å; N190-P471 WeakPolarHBondContact OD1-CB 3.41Å; N190-P471 VanDerWaalsContact OD1-CG 3.26Å; N190-P471 WeakPolarHBondContact OD1-CG 3.36Å; V193-P471 HydrophobicContact CG2-CB 3.98Å; C467-P471 VanDerWaalsContact O-CD 3.24Å; C467-P471 WeakPolarHBondContact O-CD 3.42Å; A468-P471 WeakPolarHBondContact O-CD 3.23Å; A468-P471 WeakPolarHBondContact O-CG 3.37Å; P471-L473 VanDerWaalsContact C-N 3.33Å; P471-L473 PolarHBondContact O-N 3.43Å; P471-L474 WeakPolarHBondContact O-CB 3.12Å; P471-L474 PolarHBondContact O-N 3.25Å; P471-L475 WeakPolarHBondContact O-CG 3.3Å; P471-L475 PolarHBondContact O-N 3.46Å |
| 472 | V | 94.8 | Very high | 91.3 | Very high | 55 Ų | 55 | 32.3 Ų | 32.3 | 33% | 0.333 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -62.5 | -43.9 | 176.7 | 174.3 | 0 | 0 | 0 | 0 | 110.2 | V185 A189 A468 V469 L474 L475 C476 | V185-V472 HydrophobicContact CG1-CG2 3.92Å; A189-V472 HydrophobicContact CB-CG2 3.64Å; A468-V472 WeakPolarHBondContact O-CG2 3.35Å; V469-V472 PolarHBondContact O-N 3.22Å; V472-L474 VanDerWaalsContact C-N 3.32Å; V472-L474 PolarHBondContact O-N 3.11Å; V472-L475 PolarHBondContact O-N 2.86Å; V472-C476 PolarHBondContact O-N 2.96Å; V472-C476 PolarHBondContact O-SG 3.41Å |
| 473 | L | 94.6 | Very high | 90.9 | Very high | 35 Ų | 35 | 36.1 Ų | 36.1 | 18% | 0.183 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59.8 | -40.8 | 174 | -175.9 | 72 | 0 | 0 | 0 | 112 | A421 L422 V425 V469 T470 P471 C476 L477 | A421-L473 HydrophobicContact CB-CD1 4.12Å; A421-L473 HydrophobicContact CB-CD2 3.77Å; A421-L473 HydrophobicContact CB-CG 4.28Å; L422-L473 HydrophobicContact CD2-CD2 4.33Å; V425-L473 HydrophobicContact CG2-CD2 3.91Å; V469-L473 WeakPolarHBondContact O-CB 3.48Å; V469-L473 PolarHBondContact O-N 2.81Å; T470-L473 WeakPolarHBondContact O-CB 3.4Å; T470-L473 PolarHBondContact O-N 3.41Å; P471-L473 VanDerWaalsContact C-N 3.33Å; P471-L473 PolarHBondContact O-N 3.43Å; L473-C476 PolarHBondContact O-N 3.37Å; L473-L477 HydrophobicContact CD1-CD1 3.72Å; L473-L477 HydrophobicContact CD1-CG 4.05Å; L473-L477 HydrophobicContact CG-CD1 3.9Å; L473-L477 HydrophobicContact CG-CG 4.36Å; L473-L477 WeakPolarHBondContact O-CB 3.46Å; L473-L477 WeakPolarHBondContact O-CG 3.41Å; L473-L477 PolarHBondContact O-N 3.18Å |
| 474 | L | 92.8 | Very high | 90.4 | Very high | 1 Ų | 1 | 35.7 Ų | 35.7 | 1% | 0.005 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63 | -46.2 | 175 | -69.2 | 179.6 | 0 | 0 | 0 | 112.2 | V193 L211 T418 L422 T470 P471 V472 C476 C478 | V193-L474 HydrophobicContact CG1-CD1 4.36Å; V193-L474 HydrophobicContact CG2-CB 4.39Å; L211-L474 HydrophobicContact CB-CD1 4.17Å; L211-L474 HydrophobicContact CD1-CD2 3.97Å; L211-L474 HydrophobicContact CD2-CD1 4.16Å; L211-L474 HydrophobicContact CD2-CD2 3.84Å; L211-L474 HydrophobicContact CG-CD2 4.45Å; T418-L474 HydrophobicContact CG2-CD2 3.62Å; L422-L474 HydrophobicContact CD1-CD2 4.08Å; L422-L474 HydrophobicContact CD2-CD2 3.97Å; L422-L474 HydrophobicContact CD2-CG 4.29Å; L422-L474 HydrophobicContact CG-CD2 4.31Å; T470-L474 WeakPolarHBondContact O-CG 3.47Å; T470-L474 PolarHBondContact O-N 2.84Å; T470-L474 VanDerWaalsContact O-N 3.14Å; P471-L474 WeakPolarHBondContact O-CB 3.12Å; P471-L474 PolarHBondContact O-N 3.25Å; V472-L474 VanDerWaalsContact C-N 3.32Å; V472-L474 PolarHBondContact O-N 3.11Å; L474-C476 VanDerWaalsContact C-N 3.3Å; L474-C476 PolarHBondContact O-N 2.78Å; L474-C478 VanDerWaalsContact O-CB 3.26Å; L474-C478 WeakPolarHBondContact O-CB 3.5Å; L474-C478 PolarHBondContact O-N 2.81Å |
| 475 | L | 92.1 | Very high | 89.8 | Confident | 25 Ų | 25 | 37.9 Ų | 37.9 | 13% | 0.131 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62 | -37.9 | 177.6 | -68.1 | 167.8 | 0 | 0 | 0 | 111.8 | A189 A192 V193 P471 V472 L481 G482 F485 | A189-L475 HydrophobicContact CB-CD1 4.28Å; A192-L475 HydrophobicContact CB-CD1 4.17Å; A192-L475 HydrophobicContact CB-CD2 4.49Å; V193-L475 HydrophobicContact CG2-CD1 4.49Å; V193-L475 HydrophobicContact CG2-CD2 4.11Å; V193-L475 HydrophobicContact CG2-CG 4Å; P471-L475 WeakPolarHBondContact O-CG 3.3Å; P471-L475 PolarHBondContact O-N 3.46Å; V472-L475 PolarHBondContact O-N 2.86Å; L475-L481 HydrophobicContact CD2-CB 4.41Å; L475-G482 WeakPolarHBondContact O-CA 3.43Å; L475-F485 HydrophobicContact CD2-CB 3.96Å; L475-F485 HydrophobicContact CD2-CG 4.28Å |
| 476 | C | 90.8 | Very high | 89.3 | Confident | 94 Ų | 94 | 40.4 Ų | 40.4 | 64% | 0.635 | 22% | 0.223 | S | C | * | . | H | α-helix | trans | -73.8 | -46 | 178.6 | -65 | 0 | 0 | 0 | 0 | 113.5 | V472 L473 L474 | V472-C476 PolarHBondContact O-N 2.96Å; V472-C476 PolarHBondContact O-SG 3.41Å; L473-C476 PolarHBondContact O-N 3.37Å; L474-C476 VanDerWaalsContact C-N 3.3Å; L474-C476 PolarHBondContact O-N 2.78Å |
| 477 | L | 88.2 | Confident | 88.7 | Confident | 62 Ų | 62 | 44.8 Ų | 44.8 | 33% | 0.325 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -82.1 | -39 | -174.8 | -66.3 | -175.8 | 0 | 0 | 0 | 113.1 | Q414 A421 L473 K479 | Q414-L477 PolarHBondContact NE2-O 3.45Å; A421-L477 HydrophobicContact CB-CD1 3.44Å; A421-L477 VanDerWaalsContact CB-CD1 3.44Å; L473-L477 HydrophobicContact CD1-CD1 3.72Å; L473-L477 HydrophobicContact CD1-CG 4.05Å; L473-L477 HydrophobicContact CG-CD1 3.9Å; L473-L477 HydrophobicContact CG-CG 4.36Å; L473-L477 WeakPolarHBondContact O-CB 3.46Å; L473-L477 WeakPolarHBondContact O-CG 3.41Å; L473-L477 PolarHBondContact O-N 3.18Å; L477-K479 PolarHBondContact O-N 3.09Å |
| 478 | C | 85.9 | Confident | 87.8 | Confident | 10 Ų | 10 | 46.8 Ų | 46.8 | 7% | 0.068 | 26% | 0.261 | C | S | . | . | trans | -88.3 | 87.3 | 177.1 | -72.1 | 0 | 0 | 0 | 0 | 110.1 | L474 A480 L481 G482 | L474-C478 VanDerWaalsContact O-CB 3.26Å; L474-C478 WeakPolarHBondContact O-CB 3.5Å; L474-C478 PolarHBondContact O-N 2.81Å; C478-A480 PolarHBondContact O-N 3.25Å; C478-L481 HydrophobicContact CB-CB 3.99Å; C478-L481 HydrophobicContact CB-CD1 3.69Å; C478-L481 HydrophobicContact CB-CG 4.21Å; C478-L481 WeakPolarHBondContact O-CA 3.4Å; C478-L481 WeakPolarHBondContact O-CB 3.39Å; C478-L481 PolarHBondContact O-N 2.93Å; C478-G482 PolarHBondContact O-N 3.3Å | ||
| 479 | K | 80.6 | Confident | 86.9 | Confident | 145 Ų | 145 | 48.6 Ų | 48.6 | 63% | 0.63 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -42.8 | -40.9 | 176.7 | -68.3 | -171.2 | 175.4 | -170.5 | 0 | 113.9 | Q414 L477 L481 G482 Q483 | Q414-K479 VanDerWaalsContact NE2-N 3.11Å; L477-K479 PolarHBondContact O-N 3.09Å; K479-L481 PolarHBondContact O-N 2.84Å; K479-G482 PolarHBondContact O-N 3.32Å; K479-Q483 WeakPolarHBondContact O-CB 3.43Å; K479-Q483 WeakPolarHBondContact O-CG 3.39Å; K479-Q483 PolarHBondContact O-N 3.49Å; K479-Q483 PolarHBondContact O-OE1 3.19Å |
| 480 | A | 81 | Confident | 85.8 | Confident | 48 Ų | 48 | 49.4 Ų | 49.4 | 40% | 0.397 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -69.2 | -26.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | M203 C478 A484 | M203-A480 HydrophobicContact CE-CB 3.78Å; M203-A480 HydrophobicContact SD-CB 3.85Å; C478-A480 PolarHBondContact O-N 3.25Å; A480-A484 WeakPolarHBondContact O-CB 3.28Å; A480-A484 PolarHBondContact O-N 3.36Å |
| 481 | L | 82.7 | Confident | 84.3 | Confident | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -75.3 | -50.4 | 169.6 | -83.9 | 161.1 | 0 | 0 | 0 | 110.3 | V196 V197 M203 L211 L475 C478 K479 Q483 A484 F485 | V196-L481 HydrophobicContact CB-CD2 4.1Å; V196-L481 HydrophobicContact CG1-CD2 3.76Å; V197-L481 HydrophobicContact CG2-CD2 3.92Å; M203-L481 HydrophobicContact CE-CD2 4.2Å; M203-L481 HydrophobicContact CE-CG 3.75Å; L211-L481 HydrophobicContact CD1-CD1 4.34Å; L475-L481 HydrophobicContact CD2-CB 4.41Å; C478-L481 HydrophobicContact CB-CB 3.99Å; C478-L481 HydrophobicContact CB-CD1 3.69Å; C478-L481 HydrophobicContact CB-CG 4.21Å; C478-L481 WeakPolarHBondContact O-CA 3.4Å; C478-L481 WeakPolarHBondContact O-CB 3.39Å; C478-L481 PolarHBondContact O-N 2.93Å; K479-L481 PolarHBondContact O-N 2.84Å; L481-Q483 PolarHBondContact O-N 2.83Å; L481-A484 PolarHBondContact O-N 2.96Å; L481-F485 WeakPolarHBondContact O-CB 3.2Å; L481-F485 PolarHBondContact O-N 3.12Å |
| 482 | G | 84.3 | Confident | 82.6 | Confident | 14 Ų | 14 | 56.4 Ų | 56.4 | 14% | 0.144 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -62 | -41.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | L475 C478 K479 F485 M486 | L475-G482 WeakPolarHBondContact O-CA 3.43Å; C478-G482 PolarHBondContact O-N 3.3Å; K479-G482 PolarHBondContact O-N 3.32Å; G482-F485 PolarHBondContact O-N 3.37Å; G482-M486 WeakPolarHBondContact O-CG 3.42Å; G482-M486 PolarHBondContact O-N 2.88Å |
| 483 | Q | 84.3 | Confident | 80.9 | Confident | 104 Ų | 104 | 58.2 Ų | 58.2 | 49% | 0.486 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -64.4 | -49.6 | 175.5 | -72.7 | 175.3 | -69.2 | 0 | 0 | 111.2 | K479 L481 F485 M486 D487 | K479-Q483 WeakPolarHBondContact O-CB 3.43Å; K479-Q483 WeakPolarHBondContact O-CG 3.39Å; K479-Q483 PolarHBondContact O-N 3.49Å; K479-Q483 PolarHBondContact O-OE1 3.19Å; L481-Q483 PolarHBondContact O-N 2.83Å; Q483-F485 PolarHBondContact O-N 2.67Å; Q483-M486 CarbonylContact O-C 3.57Å; Q483-M486 WeakPolarHBondContact O-CA 3.32Å; Q483-M486 WeakPolarHBondContact O-CB 3.49Å; Q483-M486 PolarHBondContact O-N 3.09Å; Q483-D487 PolarHBondContact O-N 3.47Å |
| 484 | A | 83.2 | Confident | 79 | Confident | 11 Ų | 11 | 63.8 Ų | 63.8 | 9% | 0.091 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -66.9 | -23.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | V196 A480 L481 C488 | V196-A484 HydrophobicContact CG1-CB 3.55Å; V196-A484 HydrophobicContact CG2-CB 4.27Å; A480-A484 WeakPolarHBondContact O-CB 3.28Å; A480-A484 PolarHBondContact O-N 3.36Å; L481-A484 PolarHBondContact O-N 2.96Å; A484-C488 PolarHBondContact O-N 3.32Å; A484-C488 PolarHBondContact O-SG 3.16Å |
| 485 | F | 84.4 | Confident | 76.8 | Confident | 61 Ų | 61 | 72.1 Ų | 72.1 | 27% | 0.268 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -69.1 | -49 | 166.7 | 167.4 | -106.2 | 0 | 0 | 0 | 111.5 | A192 V196 L475 L481 G482 Q483 D487 C488 C489 | A192-F485 HydrophobicContact CB-CD2 3.46Å; A192-F485 VanDerWaalsContact CB-CD2 3.46Å; A192-F485 HydrophobicContact CB-CE2 3.67Å; A192-F485 HydrophobicContact CB-CG 4.38Å; V196-F485 HydrophobicContact CG2-CB 4.2Å; L475-F485 HydrophobicContact CD2-CB 3.96Å; L475-F485 HydrophobicContact CD2-CG 4.28Å; L481-F485 WeakPolarHBondContact O-CB 3.2Å; L481-F485 PolarHBondContact O-N 3.12Å; G482-F485 PolarHBondContact O-N 3.37Å; Q483-F485 PolarHBondContact O-N 2.67Å; F485-D487 VanDerWaalsContact C-N 3.35Å; F485-D487 PolarHBondContact O-N 3.26Å; F485-C488 PolarHBondContact O-N 3.03Å; F485-C489 WeakPolarHBondContact CE2-SG 3.29Å; F485-C489 VanDerWaalsContact CZ-SG 3.51Å; F485-C489 PolarHBondContact O-N 3.34Å; F485-C489 PolarHBondContact O-SG 2.85Å |
| 486 | M | 83.9 | Confident | 74.5 | Confident | 105 Ų | 105 | 75.8 Ų | 75.8 | 52% | 0.517 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -59.9 | -42.4 | 175.3 | -71.1 | -59.6 | -59.9 | 0 | 0 | 112 | G482 Q483 C488 C489 C490 | G482-M486 WeakPolarHBondContact O-CG 3.42Å; G482-M486 PolarHBondContact O-N 2.88Å; Q483-M486 CarbonylContact O-C 3.57Å; Q483-M486 WeakPolarHBondContact O-CA 3.32Å; Q483-M486 WeakPolarHBondContact O-CB 3.49Å; Q483-M486 PolarHBondContact O-N 3.09Å; M486-C488 VanDerWaalsContact C-N 3.34Å; M486-C488 PolarHBondContact O-N 3.09Å; M486-C489 PolarHBondContact O-N 3.31Å; M486-C489 VanDerWaalsContact O-N 3.17Å; M486-C490 WeakPolarHBondContact O-CB 3.44Å; M486-C490 PolarHBondContact O-N 3.5Å; M486-C490 PolarHBondContact O-SG 3.08Å |
| 487 | D | 81.8 | Confident | 72 | Confident | 101 Ų | 101 | 78.4 Ų | 78.4 | 54% | 0.54 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -59.4 | -44.3 | 176.3 | -62.6 | -30.4 | 0 | 0 | 0 | 111 | Q483 F485 C491 | Q483-D487 PolarHBondContact O-N 3.47Å; F485-D487 VanDerWaalsContact C-N 3.35Å; F485-D487 PolarHBondContact O-N 3.26Å; D487-C491 WeakPolarHBondContact O-CB 3.41Å; D487-C491 PolarHBondContact O-N 3.25Å; D487-C491 PolarHBondContact O-SG 2.97Å |
| 488 | C | 76.4 | Confident | 69.6 | Low | 43 Ų | 43 | 80.5 Ų | 80.5 | 29% | 0.291 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -64.3 | -43 | 174.3 | -71.3 | 0 | 0 | 0 | 0 | 111.9 | A484 F485 M486 C491 C492 | A484-C488 PolarHBondContact O-N 3.32Å; A484-C488 PolarHBondContact O-SG 3.16Å; F485-C488 PolarHBondContact O-N 3.03Å; M486-C488 VanDerWaalsContact C-N 3.34Å; M486-C488 PolarHBondContact O-N 3.09Å; C488-C491 PolarHBondContact O-N 3.39Å; C488-C492 WeakPolarHBondContact O-CB 3.35Å; C488-C492 PolarHBondContact O-N 3.02Å; C488-C492 PolarHBondContact O-SG 3.49Å |
| 489 | C | 77.4 | Confident | 67.2 | Low | 42 Ų | 42 | 86.6 Ų | 86.6 | 28% | 0.284 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 179 | -67.8 | 0 | 0 | 0 | 0 | 112 | F485 M486 C492 C493 | F485-C489 WeakPolarHBondContact CE2-SG 3.29Å; F485-C489 VanDerWaalsContact CZ-SG 3.51Å; F485-C489 PolarHBondContact O-N 3.34Å; F485-C489 PolarHBondContact O-SG 2.85Å; M486-C489 PolarHBondContact O-N 3.31Å; M486-C489 VanDerWaalsContact O-N 3.17Å; C489-C492 PolarHBondContact O-N 3.1Å; C489-C493 WeakPolarHBondContact O-CB 3.48Å; C489-C493 PolarHBondContact O-N 3.38Å; C489-C493 PolarHBondContact O-SG 2.76Å |
| 490 | C | 73.8 | Confident | 65 | Low | 70 Ų | 70 | 86.1 Ų | 86.1 | 47% | 0.473 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62 | -45.1 | 175.9 | -70.7 | 0 | 0 | 0 | 0 | 111.5 | M486 C493 Q494 | M486-C490 WeakPolarHBondContact O-CB 3.44Å; M486-C490 PolarHBondContact O-N 3.5Å; M486-C490 PolarHBondContact O-SG 3.08Å; C490-C493 PolarHBondContact O-N 3.03Å; C490-Q494 WeakPolarHBondContact O-CB 3.38Å; C490-Q494 PolarHBondContact O-N 2.97Å |
| 491 | C | 62.9 | Low | 62.8 | Low | 79 Ų | 79 | 88 Ų | 88 | 53% | 0.534 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -57.5 | -50 | 172.9 | -67.3 | 0 | 0 | 0 | 0 | 111.4 | D487 C488 C493 Q494 E495 | D487-C491 WeakPolarHBondContact O-CB 3.41Å; D487-C491 PolarHBondContact O-N 3.25Å; D487-C491 PolarHBondContact O-SG 2.97Å; C488-C491 PolarHBondContact O-N 3.39Å; C491-C493 PolarHBondContact O-N 3.27Å; C491-Q494 PolarHBondContact O-N 2.85Å; C491-E495 WeakPolarHBondContact O-CB 3.46Å; C491-E495 PolarHBondContact O-N 3.25Å |
| 492 | C | 58.8 | Low | 60.5 | Low | 80 Ų | 80 | 97.2 Ų | 97.2 | 54% | 0.541 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62.2 | -39.7 | 179.2 | -70.1 | 0 | 0 | 0 | 0 | 112.9 | C488 C489 C496 | C488-C492 WeakPolarHBondContact O-CB 3.35Å; C488-C492 PolarHBondContact O-N 3.02Å; C488-C492 PolarHBondContact O-SG 3.49Å; C489-C492 PolarHBondContact O-N 3.1Å; C492-C496 WeakPolarHBondContact O-CB 3.45Å; C492-C496 PolarHBondContact O-N 3.12Å; C492-C496 VanDerWaalsContact O-N 3.16Å; C492-C496 PolarHBondContact O-SG 3.41Å |
| 493 | C | 58.3 | Low | 57.9 | Low | 93 Ų | 93 | 104 Ų | 104 | 63% | 0.628 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -68.2 | -37.3 | 177.5 | -67.1 | 0 | 0 | 0 | 0 | 112.1 | C489 C490 C491 C496 | C489-C493 WeakPolarHBondContact O-CB 3.48Å; C489-C493 PolarHBondContact O-N 3.38Å; C489-C493 PolarHBondContact O-SG 2.76Å; C490-C493 PolarHBondContact O-N 3.03Å; C491-C493 PolarHBondContact O-N 3.27Å; C493-C496 PolarHBondContact O-N 3.35Å |
| 494 | Q | 55.8 | Low | 55.3 | Low | 152 Ų | 152 | 104.5 Ų | 104.5 | 71% | 0.71 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -75.4 | -35 | -179.4 | -166.2 | 164 | 4.9 | 0 | 0 | 112.3 | C490 C491 C496 Q497 | C490-Q494 WeakPolarHBondContact O-CB 3.38Å; C490-Q494 PolarHBondContact O-N 2.97Å; C491-Q494 PolarHBondContact O-N 2.85Å; Q494-C496 PolarHBondContact O-N 2.88Å; Q494-Q497 PolarHBondContact O-N 2.84Å |
| 495 | E | 45.9 | Very low | 53.3 | Low | 175 Ų | 175 | 110.4 Ų | 110.4 | 82% | 0.818 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -71.7 | -17.4 | 171.4 | -143.1 | 90.1 | -179.2 | 0 | 0 | 112.7 | C491 | C491-E495 WeakPolarHBondContact O-CB 3.46Å; C491-E495 PolarHBondContact O-N 3.25Å |
| 496 | C | 43.3 | Very low | 50.6 | Low | 103 Ų | 103 | 111 Ų | 111 | 70% | 0.696 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.3 | -1 | 176.1 | -73.4 | 0 | 0 | 0 | 0 | 114.3 | C492 C493 Q494 P498 | C492-C496 WeakPolarHBondContact O-CB 3.45Å; C492-C496 PolarHBondContact O-N 3.12Å; C492-C496 VanDerWaalsContact O-N 3.16Å; C492-C496 PolarHBondContact O-SG 3.41Å; C493-C496 PolarHBondContact O-N 3.35Å; Q494-C496 PolarHBondContact O-N 2.88Å; C496-P498 WeakPolarHBondContact O-CD 3.44Å |
| 497 | Q | 38.1 | Very low | 47.9 | Very low | 148 Ų | 148 | 111.7 Ų | 111.7 | 69% | 0.692 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -76.9 | 117.2 | 172.1 | -169.9 | 167.8 | 5.8 | 0 | 0 | 108.9 | Q494 T499 | Q494-Q497 PolarHBondContact O-N 2.84Å; Q497-T499 PolarHBondContact O-N 3.06Å |
| 498 | P | 39.1 | Very low | 45.4 | Very low | 106 Ų | 106 | 110.9 Ų | 110.9 | 69% | 0.688 | 69% | 0.688 | S | S | * | * | trans | -66.9 | 131.7 | -170.9 | 26 | -34.4 | 0 | 0 | 0 | 111.4 | C496 T500 | C496-P498 WeakPolarHBondContact O-CD 3.44Å; P498-T500 VanDerWaalsContact C-N 3.32Å; P498-T500 PolarHBondContact O-N 3.22Å | ||
| 499 | T | 35.9 | Very low | 43.4 | Very low | 138 Ų | 138 | 116.7 Ų | 116.7 | 85% | 0.847 | 71% | 0.711 | S | S | * | * | trans | -68.6 | 83.2 | 179.5 | -44.8 | 0 | 0 | 0 | 0 | 111.5 | Q497 A501 | Q497-T499 PolarHBondContact O-N 3.06Å; T499-A501 VanDerWaalsContact C-N 3.31Å; T499-A501 PolarHBondContact O-N 3.4Å | ||
| 500 | T | 33.1 | Very low | 41.1 | Very low | 135 Ų | 135 | 121.6 Ų | 121.6 | 83% | 0.828 | 74% | 0.74 | S | S | * | * | trans | -68.6 | 89.9 | 166.5 | 47.6 | 0 | 0 | 0 | 0 | 109.3 | P498 Q502 | P498-T500 VanDerWaalsContact C-N 3.32Å; P498-T500 PolarHBondContact O-N 3.22Å; T500-Q502 PolarHBondContact O-N 2.68Å | ||
| 501 | A | 35.8 | Very low | 38.9 | Very low | 89 Ų | 89 | 126.2 Ų | 126.2 | 74% | 0.736 | 75% | 0.752 | S | S | * | * | trans | -76.6 | 116.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111 | T499 | T499-A501 VanDerWaalsContact C-N 3.31Å; T499-A501 PolarHBondContact O-N 3.4Å | ||
| 502 | Q | 34.1 | Very low | 37.2 | Very low | 193 Ų | 193 | 130.9 Ų | 130.9 | 90% | 0.902 | 77% | 0.77 | S | S | * | * | trans | -153.4 | 139 | 151.9 | -121.7 | 176.6 | -1.1 | 0 | 0 | 110.3 | T500 | T500-Q502 PolarHBondContact O-N 2.68Š| ||
| 503 | D | 30.4 | Very low | 35.6 | Very low | 156 Ų | 156 | 135.6 Ų | 135.6 | 83% | 0.834 | 78% | 0.782 | S | S | * | * | trans | -81.2 | 139.3 | -168.3 | -54.8 | -92.9 | 0 | 0 | 0 | 113.8 | ||||
| 504 | S | 29.4 | Very low | 34.3 | Very low | 115 Ų | 115 | 136 Ų | 136 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | -178.9 | 145.5 | 129.1 | -82.5 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 505 | P | 39.8 | Very low | 33.1 | Very low | 135 Ų | 135 | 133.7 Ų | 133.7 | 88% | 0.877 | 80% | 0.799 | S | S | * | * | trans | -88.7 | 123 | 175.7 | 33.3 | -31.5 | 0 | 0 | 0 | 112.3 | ||||
| 506 | G | 27.8 | Very low | 32.3 | Very low | 72 Ų | 72 | 131 Ų | 131 | 74% | 0.742 | 79% | 0.79 | S | S | * | * | trans | -168 | 116.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 507 | S | 28.1 | Very low | 31.7 | Very low | 120 Ų | 120 | 134.6 Ų | 134.6 | 84% | 0.839 | 80% | 0.797 | S | S | * | * | trans | 37.3 | 114.1 | 149 | -156.5 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 508 | A | 29.8 | Very low | 31.5 | Very low | 84 Ų | 84 | 133.9 Ų | 133.9 | 69% | 0.694 | 80% | 0.803 | S | S | * | * | trans | 62.2 | 116.3 | 134.3 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 509 | Q | 32.9 | Very low | 31.1 | Very low | 165 Ų | 165 | 132.2 Ų | 132.2 | 77% | 0.771 | 79% | 0.793 | S | S | * | * | 48.4 | 94.2 | 128.4 | -74.3 | -86.9 | 8.3 | 0 | 0 | 120.3 | |||||
| 510 | V | 29.5 | Very low | 31.1 | Very low | 146 Ų | 146 | 132.3 Ų | 132.3 | 89% | 0.885 | 79% | 0.787 | S | S | * | * | trans | -134.8 | 79.4 | 136.8 | -169.9 | 0 | 0 | 0 | 0 | 111.9 | L512 | V510-L512 PolarHBondContact O-N 2.82Š| ||
| 511 | K | 27.4 | Very low | 31.1 | Very low | 166 Ų | 166 | 132.9 Ų | 132.9 | 72% | 0.722 | 78% | 0.779 | S | S | * | * | trans | -7.3 | 114.3 | 141.6 | 179.4 | -171.4 | -174.1 | -179.1 | 0 | 116.8 | ||||
| 512 | L | 27 | Very low | 31.1 | Very low | 177 Ų | 177 | 136.5 Ų | 136.5 | 93% | 0.927 | 78% | 0.778 | S | S | * | * | trans | -120.4 | 132.1 | 148.6 | -162.2 | 71.3 | 0 | 0 | 0 | 109.5 | V510 | V510-L512 PolarHBondContact O-N 2.82Š| ||
| 513 | K | 27 | Very low | 31.1 | Very low | 179 Ų | 179 | 132.3 Ų | 132.3 | 78% | 0.778 | 76% | 0.762 | S | S | * | * | trans | -126.3 | 99.7 | -165.4 | 178 | -161.4 | 171.7 | -170.4 | 0 | 110.7 | ||||
| 514 | A | 30.3 | Very low | 31.2 | Very low | 103 Ų | 103 | 133.1 Ų | 133.1 | 85% | 0.851 | 76% | 0.758 | S | S | * | * | trans | -149.3 | 27.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 515 | A | 29.4 | Very low | 31.5 | Very low | 102 Ų | 102 | 130.4 Ų | 130.4 | 84% | 0.843 | 74% | 0.742 | S | S | * | * | trans | -148.8 | 75.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 516 | N | 29.6 | Very low | 31.4 | Very low | 120 Ų | 120 | 131 Ų | 131 | 64% | 0.642 | 73% | 0.731 | S | S | * | * | trans | -149.9 | 71.5 | 171.3 | -171.2 | 45.9 | 0 | 0 | 0 | 113.2 | ||||
| 517 | E | 30.7 | Very low | 31.7 | Very low | 177 Ų | 177 | 132.8 Ų | 132.8 | 83% | 0.827 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -157.7 | 85.4 | 153.9 | -126.7 | 174.4 | -127.6 | 0 | 0 | 110.4 | ||
| 518 | T | 33.9 | Very low | 32.1 | Very low | 134 Ų | 134 | 130.9 Ų | 130.9 | 82% | 0.822 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -178.3 | -26.7 | 165.5 | 11.4 | 0 | 0 | 0 | 0 | 113.5 | I520 | T518-I520 VanDerWaalsContact C-N 3.26Å; T518-I520 PolarHBondContact O-N 2.72Å |
| 519 | S | 32 | Very low | 32.6 | Very low | 70 Ų | 70 | 131.5 Ų | 131.5 | 49% | 0.49 | 70% | 0.702 | S | S | . | * | G | 310 helix | trans | -60.1 | -26 | -173.9 | 48.3 | 0 | 0 | 0 | 0 | 115.5 | F521 F522 | S519-F521 PolarHBondContact O-N 3.3Å; S519-F522 PolarHBondContact O-N 3.11Å |
| 520 | I | 35 | Very low | 32.6 | Very low | 141 Ų | 141 | 126.6 Ų | 126.6 | 72% | 0.723 | 69% | 0.69 | S | S | * | * | G | 310 helix | trans | -57.6 | -19.7 | -171.5 | -64.4 | 173.7 | 0 | 0 | 0 | 113.9 | T518 | T518-I520 VanDerWaalsContact C-N 3.26Å; T518-I520 PolarHBondContact O-N 2.72Å |
| 521 | F | 33.3 | Very low | 32.8 | Very low | 147 Ų | 147 | 126 Ų | 126 | 65% | 0.645 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -84.3 | -17 | -177.6 | -145.5 | -90.9 | 0 | 0 | 0 | 115.2 | S519 | S519-F521 PolarHBondContact O-N 3.3Š|
| 522 | F | 35.8 | Very low | 33.2 | Very low | 164 Ų | 164 | 125.1 Ų | 125.1 | 72% | 0.719 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.5 | -39.7 | -170 | -113.2 | -81.9 | 0 | 0 | 0 | 115.5 | S519 K524 A525 | S519-F522 PolarHBondContact O-N 3.11Å; F522-K524 VanDerWaalsContact C-N 3.32Å; F522-K524 PolarHBondContact O-N 3.31Å; F522-A525 PolarHBondContact O-N 3.41Å |
| 523 | D | 34.3 | Very low | 33.4 | Very low | 105 Ų | 105 | 121.2 Ų | 121.2 | 56% | 0.561 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | -37.9 | 179.5 | -85.7 | -54.1 | 0 | 0 | 0 | 112.5 | A525 K526 | D523-A525 PolarHBondContact O-N 3.3Å; D523-K526 WeakPolarHBondContact O-CB 3.46Å; D523-K526 PolarHBondContact O-N 3.13Å |
| 524 | K | 31.6 | Very low | 33.8 | Very low | 174 Ų | 174 | 119.9 Ų | 119.9 | 76% | 0.757 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -65 | -14.6 | -176.3 | -151.7 | 168.6 | -170.6 | 171.4 | 0 | 114.4 | F522 T528 | F522-K524 VanDerWaalsContact C-N 3.32Å; F522-K524 PolarHBondContact O-N 3.31Å; K524-T528 PolarHBondContact O-OG1 3.24Å; K524-T528 VanDerWaalsContact O-OG1 3.06Å |
| 525 | A | 36.2 | Very low | 33.9 | Very low | 57 Ų | 57 | 120.7 Ų | 120.7 | 47% | 0.471 | 67% | 0.67 | S | S | . | * | H | α-helix | trans | -86.1 | -17.5 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | F522 D523 | F522-A525 PolarHBondContact O-N 3.41Å; D523-A525 PolarHBondContact O-N 3.3Å |
| 526 | K | 37.3 | Very low | 34.1 | Very low | 147 Ų | 147 | 124.6 Ų | 124.6 | 64% | 0.639 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -81.3 | -41.1 | -178.2 | -163.8 | 177 | 177.6 | -174.8 | 0 | 111.4 | D523 T528 T529 | D523-K526 WeakPolarHBondContact O-CB 3.46Å; D523-K526 PolarHBondContact O-N 3.13Å; K526-T528 PolarHBondContact O-N 3.46Å; K526-T529 PolarHBondContact O-N 3.07Å; K526-T529 PolarHBondContact O-OG1 3.27Å |
| 527 | D | 34.9 | Very low | 34.3 | Very low | 110 Ų | 110 | 124.9 Ų | 124.9 | 59% | 0.588 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -68.5 | -32.8 | 179.5 | -60 | -30.9 | 0 | 0 | 0 | 112.8 | T529 A530 | D527-T529 PolarHBondContact O-N 3.22Å; D527-A530 PolarHBondContact O-N 3.31Å |
| 528 | T | 36.2 | Very low | 34.5 | Very low | 81 Ų | 81 | 122.1 Ų | 122.1 | 50% | 0.497 | 69% | 0.686 | S | S | . | * | H | α-helix | trans | -70.8 | -17.6 | -177.3 | 15.4 | 0 | 0 | 0 | 0 | 113.9 | K524 K526 | K524-T528 PolarHBondContact O-OG1 3.24Å; K524-T528 VanDerWaalsContact O-OG1 3.06Å; K526-T528 PolarHBondContact O-N 3.46Å |
| 529 | T | 39.7 | Very low | 34.6 | Very low | 96 Ų | 96 | 121.4 Ų | 121.4 | 59% | 0.589 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -86 | -21.8 | 174.8 | 36.5 | 0 | 0 | 0 | 0 | 114.3 | K526 D527 I531 L532 | K526-T529 PolarHBondContact O-N 3.07Å; K526-T529 PolarHBondContact O-OG1 3.27Å; D527-T529 PolarHBondContact O-N 3.22Å; T529-I531 VanDerWaalsContact C-N 3.32Å; T529-I531 PolarHBondContact O-N 2.67Å; T529-L532 PolarHBondContact O-N 3.37Å |
| 530 | A | 34.6 | Very low | 34.7 | Very low | 63 Ų | 63 | 124.5 Ų | 124.5 | 52% | 0.521 | 69% | 0.69 | S | S | . | * | H | α-helix | trans | -66.5 | -35.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | D527 L532 S533 | D527-A530 PolarHBondContact O-N 3.31Å; A530-L532 VanDerWaalsContact C-N 3.32Å; A530-L532 PolarHBondContact O-N 3.35Å; A530-S533 PolarHBondContact O-N 3.25Å; A530-S533 PolarHBondContact O-OG 3.49Å |
| 531 | I | 33.5 | Very low | 34.7 | Very low | 133 Ų | 133 | 123.4 Ų | 123.4 | 68% | 0.682 | 69% | 0.688 | S | S | * | * | G | 310 helix | trans | -71.8 | -24.4 | -176.8 | -60.5 | 174.2 | 0 | 0 | 0 | 112.4 | T529 S533 | T529-I531 VanDerWaalsContact C-N 3.32Å; T529-I531 PolarHBondContact O-N 2.67Å; I531-S533 PolarHBondContact O-N 3.38Å |
| 532 | L | 34.7 | Very low | 34.8 | Very low | 148 Ų | 148 | 121.9 Ų | 121.9 | 78% | 0.775 | 69% | 0.691 | S | S | * | * | G | 310 helix | trans | -82.4 | 8.2 | 179.9 | -71.4 | 172.9 | 0 | 0 | 0 | 114.3 | T529 A530 | T529-L532 PolarHBondContact O-N 3.37Å; A530-L532 VanDerWaalsContact C-N 3.32Å; A530-L532 PolarHBondContact O-N 3.35Å |
| 533 | S | 32.5 | Very low | 34.7 | Very low | 94 Ų | 94 | 118.9 Ų | 118.9 | 66% | 0.657 | 69% | 0.689 | S | S | * | * | G | 310 helix | trans | -104.3 | 6.4 | 175.5 | 64.9 | 0 | 0 | 0 | 0 | 114.3 | A530 I531 | A530-S533 PolarHBondContact O-N 3.25Å; A530-S533 PolarHBondContact O-OG 3.49Å; I531-S533 PolarHBondContact O-N 3.38Å |
| 534 | I | 35.1 | Very low | 34.8 | Very low | 152 Ų | 152 | 119.9 Ų | 119.9 | 78% | 0.779 | 70% | 0.699 | S | S | * | * | trans | -126.1 | 68.9 | 178.1 | -46.6 | -178.2 | 0 | 0 | 0 | 110.8 | ||||
| 535 | S | 30.8 | Very low | 35 | Very low | 120 Ų | 120 | 115.4 Ų | 115.4 | 84% | 0.839 | 69% | 0.694 | S | S | * | * | trans | -150 | 146.6 | 151.2 | -159.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 536 | S | 34.8 | Very low | 34.9 | Very low | 184 Ų | 184 | 120.7 Ų | 120.7 | 100% | 1.287 | 71% | 0.714 | S | S | * | * | trans | -82.6 | 0 | -177.8 | -174.5 | 0 | 0 | 0 | 0 | 113.1 |
Retrieved 536 of 536 residues in 2553.6 ms
(Link to these results)