| 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 | 37.6 | Very low | 36.9 | Very low | 241 Ų | 241 | 153.8 Ų | 153.8 | 100% | 1.187 | 83% | 0.831 | S | S | * | * | 0 | 57.9 | 0 | -67 | -172.8 | -171.1 | 0 | 0 | 111.9 | |||||
| 2 | L | 34.8 | Very low | 37.1 | Very low | 188 Ų | 188 | 149.3 Ų | 149.3 | 98% | 0.984 | 82% | 0.815 | S | S | * | * | trans | -149.9 | 59.1 | 178.2 | -78.7 | 172.4 | 0 | 0 | 0 | 110.5 | ||||
| 3 | G | 35.5 | Very low | 37 | Very low | 69 Ų | 69 | 150.5 Ų | 150.5 | 71% | 0.711 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -139.4 | -1.1 | -174.3 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 4 | W | 31.9 | Very low | 37 | Very low | 241 Ų | 241 | 154.5 Ų | 154.5 | 91% | 0.913 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -121.1 | -5.7 | -168.7 | -75.7 | 69.7 | 0 | 0 | 0 | 115.2 | ||
| 5 | C | 37.5 | Very low | 37 | Very low | 133 Ų | 133 | 155.3 Ų | 155.3 | 90% | 0.899 | 81% | 0.813 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.2 | 0.4 | -175.8 | -74.9 | 0 | 0 | 0 | 0 | 115.8 | ||
| 6 | Q | 38.7 | Very low | 37.1 | Very low | 194 Ų | 194 | 152.7 Ų | 152.7 | 91% | 0.907 | 81% | 0.809 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109 | 9.4 | -175.3 | -151.7 | 135.6 | 2.4 | 0 | 0 | 114.9 | ||
| 7 | A | 37.9 | Very low | 36.8 | Very low | 82 Ų | 82 | 153.1 Ų | 153.1 | 68% | 0.678 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -93.8 | -10.9 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | A9 | A7-A9 PolarHBondContact O-N 2.88Š|
| 8 | I | 33.6 | Very low | 36.5 | Very low | 165 Ų | 165 | 150.8 Ų | 150.8 | 85% | 0.846 | 81% | 0.81 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.8 | -11.2 | -171.7 | -62.6 | 175.9 | 0 | 0 | 0 | 113.1 | ||
| 9 | A | 38.9 | Very low | 36.4 | Very low | 97 Ų | 97 | 149.4 Ų | 149.4 | 80% | 0.802 | 81% | 0.807 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.7 | 2.1 | -173.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | A7 | A7-A9 PolarHBondContact O-N 2.88Š|
| 10 | R | 42 | Very low | 36.2 | Very low | 187 Ų | 187 | 154 Ų | 154 | 71% | 0.706 | 81% | 0.812 | S | S | * | * | S | Bend | trans | -115.2 | -4.4 | -169.1 | -92.4 | -169.4 | -156.6 | 168.2 | 10.1 | 118.8 | ||
| 11 | N | 38 | Very low | 36 | Very low | 95 Ų | 95 | 152.6 Ų | 152.6 | 51% | 0.508 | 81% | 0.81 | S | S | . | * | trans | -161.1 | 109.1 | 179.2 | -149.4 | -35.9 | 0 | 0 | 0 | 113.9 | H13 | N11-H13 PolarHBondContact O-N 2.86Å; N11-H13 PolarHBondContact OD1-N 3.16Å | ||
| 12 | P | 39.1 | Very low | 36.1 | Very low | 99 Ų | 99 | 146.7 Ų | 146.7 | 64% | 0.643 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | 1 | 174.9 | 28.9 | -30.3 | 0 | 0 | 0 | 114.2 | Y229 | P12-Y229 HydrophobicContact CB-CD2 4.37Å; P12-Y229 HydrophobicContact CB-CE2 3.89Å; P12-Y229 HydrophobicContact CG-CD2 4.26Å; P12-Y229 HydrophobicContact CG-CE2 3.75Å |
| 13 | H | 35.6 | Very low | 35.9 | Very low | 165 Ų | 165 | 147.4 Ų | 147.4 | 76% | 0.764 | 79% | 0.788 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.9 | 12 | -176.8 | -94 | -70.9 | 0 | 0 | 0 | 115.9 | N11 | N11-H13 PolarHBondContact O-N 2.86Å; N11-H13 PolarHBondContact OD1-N 3.16Å |
| 14 | R | 36.9 | Very low | 35.7 | Very low | 207 Ų | 207 | 150.6 Ų | 150.6 | 78% | 0.781 | 79% | 0.794 | S | S | * | * | trans | -105.5 | 89.8 | 176.8 | -163.9 | -176.9 | -90.2 | -122.3 | 4.4 | 110.8 | ||||
| 15 | L | 36.4 | Very low | 35.7 | Very low | 166 Ų | 166 | 144.7 Ų | 144.7 | 87% | 0.869 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 128.1 | 158.5 | -78.5 | 162.8 | 0 | 0 | 0 | 108.2 | ||
| 16 | P | 38.7 | Very low | 35.3 | Very low | 114 Ų | 114 | 141.3 Ų | 141.3 | 74% | 0.74 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 128.2 | 169 | 29.6 | -28.1 | 0 | 0 | 0 | 109.3 | S18 | P16-S18 PolarHBondContact O-N 2.84Š|
| 17 | N | 32.2 | Very low | 35 | Very low | 160 Ų | 160 | 140.3 Ų | 140.3 | 86% | 0.856 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 117.7 | 171.9 | -162.8 | 17.2 | 0 | 0 | 0 | 108.5 | T19 | N17-T19 PolarHBondContact O-N 2.75Š|
| 18 | S | 32.3 | Very low | 35.1 | Very low | 112 Ų | 112 | 140.7 Ų | 140.7 | 78% | 0.783 | 78% | 0.781 | S | S | * | * | trans | -74.8 | 115.7 | -178.9 | -167.1 | 0 | 0 | 0 | 0 | 109.9 | P16 R20 | P16-S18 PolarHBondContact O-N 2.84Å; S18-R20 PolarHBondContact O-N 2.87Å | ||
| 19 | T | 33.4 | Very low | 35.7 | Very low | 124 Ų | 124 | 138.3 Ų | 138.3 | 76% | 0.761 | 78% | 0.776 | S | S | * | * | trans | -53 | 130.8 | 167.3 | -49.2 | 0 | 0 | 0 | 0 | 110.2 | N17 | N17-T19 PolarHBondContact O-N 2.75Š| ||
| 20 | R | 33.3 | Very low | 35.4 | Very low | 240 Ų | 240 | 141.8 Ų | 141.8 | 91% | 0.906 | 78% | 0.775 | S | S | * | * | trans | -82.8 | 124.3 | 176.5 | -164.7 | -173.6 | -79.6 | 170.5 | -7.6 | 108.2 | S18 | S18-R20 PolarHBondContact O-N 2.87Š| ||
| 21 | T | 32.8 | Very low | 35 | Very low | 126 Ų | 126 | 139 Ų | 139 | 77% | 0.773 | 77% | 0.774 | S | S | * | * | trans | -112 | 144.7 | 163.6 | 45.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 22 | P | 38.9 | Very low | 34.7 | Very low | 117 Ų | 117 | 139.7 Ų | 139.7 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | trans | -95.8 | 138.3 | -177.5 | 35.6 | -28.1 | 0 | 0 | 0 | 111 | ||||
| 23 | E | 29.9 | Very low | 34.5 | Very low | 203 Ų | 203 | 139.8 Ų | 139.8 | 95% | 0.949 | 80% | 0.796 | S | S | * | * | trans | -148 | 153.5 | 157.1 | -77.7 | -153.2 | 110.8 | 0 | 0 | 111.4 | ||||
| 24 | V | 31.8 | Very low | 34.4 | Very low | 136 Ų | 136 | 140 Ų | 140 | 82% | 0.824 | 80% | 0.802 | S | S | * | * | trans | -104.3 | 154 | -156.6 | 170.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 25 | S | 31.5 | Very low | 34.3 | Very low | 117 Ų | 117 | 137.8 Ų | 137.8 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | 135.8 | 129.4 | 134.6 | -52.4 | 0 | 0 | 0 | 0 | 117 | ||||
| 26 | G | 30.5 | Very low | 34 | Very low | 62 Ų | 62 | 136.4 Ų | 136.4 | 64% | 0.639 | 80% | 0.799 | S | S | * | * | trans | 91.5 | 95.7 | 145.2 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 27 | D | 32.2 | Very low | 33.8 | Very low | 172 Ų | 172 | 140.3 Ų | 140.3 | 92% | 0.92 | 80% | 0.804 | S | S | * | * | 75.5 | 133 | 97.5 | -66.3 | -36.3 | 0 | 0 | 0 | 114.2 | |||||
| 28 | A | 38.6 | Very low | 33.8 | Very low | 90 Ų | 90 | 138.1 Ų | 138.1 | 74% | 0.744 | 80% | 0.801 | S | S | * | * | cis | -170.8 | -161 | -5.5 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 29 | P | 46.9 | Very low | 34.5 | Very low | 115 Ų | 115 | 138.7 Ų | 138.7 | 75% | 0.747 | 80% | 0.803 | S | S | * | * | -119 | 162.5 | -83.2 | 37.8 | -23.3 | 0 | 0 | 0 | 114.8 | |||||
| 30 | H | 32.5 | Very low | 34.4 | Very low | 170 Ų | 170 | 136.5 Ų | 136.5 | 79% | 0.787 | 80% | 0.804 | S | S | * | * | 176 | 150.8 | 122.9 | -124 | -93.5 | 0 | 0 | 0 | 114.4 | |||||
| 31 | N | 33.9 | Very low | 34.4 | Very low | 128 Ų | 128 | 136.6 Ų | 136.6 | 68% | 0.684 | 81% | 0.805 | S | S | * | * | trans | 90.1 | 85.9 | 160.2 | -68.2 | -8.3 | 0 | 0 | 0 | 120.9 | ||||
| 32 | S | 32.3 | Very low | 34.8 | Very low | 111 Ų | 111 | 136 Ų | 136 | 78% | 0.776 | 81% | 0.805 | S | S | * | * | 20.2 | 120.8 | 124.3 | 57.6 | 0 | 0 | 0 | 0 | 120.6 | |||||
| 33 | A | 33.6 | Very low | 34.7 | Very low | 101 Ų | 101 | 137 Ų | 137 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | 176.1 | 143.3 | 111.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 34 | L | 33.4 | Very low | 35.2 | Very low | 169 Ų | 169 | 133.1 Ų | 133.1 | 89% | 0.885 | 81% | 0.805 | S | S | * | * | trans | -57.5 | 148.8 | -175.1 | -71.3 | 83.1 | 0 | 0 | 0 | 114.9 | ||||
| 35 | N | 35.8 | Very low | 35.7 | Very low | 161 Ų | 161 | 138.2 Ų | 138.2 | 86% | 0.861 | 81% | 0.809 | S | S | * | * | -168.2 | 144.5 | 106.4 | -141.1 | 14.3 | 0 | 0 | 0 | 113.8 | |||||
| 36 | D | 30.8 | Very low | 36 | Very low | 136 Ų | 136 | 137.7 Ų | 137.7 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | trans | -90.8 | 140 | -173.3 | -162.3 | -67.4 | 0 | 0 | 0 | 111.9 | ||||
| 37 | K | 33 | Very low | 36.4 | Very low | 197 Ų | 197 | 139 Ų | 139 | 86% | 0.857 | 81% | 0.805 | S | S | * | * | trans | 156.4 | 131.2 | 133 | -89.6 | 174.7 | 171.3 | 174.8 | 0 | 114.3 | ||||
| 38 | S | 32.3 | Very low | 36.8 | Very low | 113 Ų | 113 | 137.9 Ų | 137.9 | 79% | 0.79 | 80% | 0.799 | S | S | * | * | trans | -125.3 | -179.3 | 159.2 | -118.5 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 39 | P | 47.7 | Very low | 36.9 | Very low | 125 Ų | 125 | 140.8 Ų | 140.8 | 81% | 0.812 | 80% | 0.801 | S | S | * | * | cis | -134.9 | -176.6 | -38.3 | 35.2 | -16.6 | 0 | 0 | 0 | 111.9 | ||||
| 40 | G | 31.2 | Very low | 36.5 | Very low | 77 Ų | 77 | 141.4 Ų | 141.4 | 79% | 0.794 | 81% | 0.807 | S | S | * | * | trans | 133.2 | 158.4 | 158.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 41 | R | 34 | Very low | 36.6 | Very low | 243 Ų | 243 | 142.9 Ų | 142.9 | 92% | 0.917 | 81% | 0.812 | S | S | * | * | cis | -167.7 | 142 | -10.4 | -179.8 | -179.7 | -173.8 | -161.6 | 2 | 104.6 | ||||
| 42 | S | 39.6 | Very low | 36.6 | Very low | 113 Ų | 113 | 141.1 Ų | 141.1 | 79% | 0.79 | 82% | 0.815 | S | S | * | * | trans | -57 | 142.8 | 177.6 | -46.3 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 43 | T | 36.9 | Very low | 36.8 | Very low | 138 Ų | 138 | 141.9 Ų | 141.9 | 85% | 0.847 | 82% | 0.82 | S | S | * | * | trans | -139 | 122.8 | 159.7 | 42.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 44 | S | 40.3 | Very low | 37.1 | Very low | 121 Ų | 121 | 142.6 Ų | 142.6 | 85% | 0.846 | 82% | 0.819 | S | S | * | * | trans | -84.7 | 146.8 | 168.5 | -49.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 45 | R | 42.4 | Very low | 37.9 | Very low | 244 Ų | 244 | 140.2 Ų | 140.2 | 92% | 0.921 | 81% | 0.814 | S | S | * | * | trans | -134.4 | 123 | 164.2 | -73.3 | 179.8 | 81.7 | 170.4 | 3.1 | 111.1 | ||||
| 46 | S | 37.6 | Very low | 38.1 | Very low | 106 Ų | 106 | 138.7 Ų | 138.7 | 74% | 0.741 | 81% | 0.81 | S | S | * | * | trans | -58.5 | 166.7 | 159 | 49.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 47 | S | 39.9 | Very low | 38.3 | Very low | 90 Ų | 90 | 139 Ų | 139 | 63% | 0.629 | 82% | 0.817 | S | S | * | * | -179.4 | 151.2 | 56 | -24.8 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 48 | N | 39.2 | Very low | 38.4 | Very low | 147 Ų | 147 | 132.7 Ų | 132.7 | 79% | 0.786 | 81% | 0.809 | S | S | * | * | trans | 73.8 | 103.8 | 132.9 | -57.2 | -18.4 | 0 | 0 | 0 | 124.6 | ||||
| 49 | I | 40.8 | Very low | 38.8 | Very low | 152 Ų | 152 | 134 Ų | 134 | 78% | 0.779 | 81% | 0.812 | S | S | * | * | 18 | 131.3 | 118.6 | -56.3 | 170.5 | 0 | 0 | 0 | 119.5 | |||||
| 50 | S | 38.6 | Very low | 38.5 | Very low | 127 Ų | 127 | 132.6 Ų | 132.6 | 89% | 0.888 | 81% | 0.811 | S | S | * | * | trans | -162.8 | 145.2 | 131.4 | -77.5 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 51 | K | 35.3 | Very low | 39.1 | Very low | 202 Ų | 202 | 134.7 Ų | 134.7 | 88% | 0.878 | 81% | 0.81 | S | S | * | * | trans | -81.5 | 151.1 | -169.8 | -89.1 | 176.1 | 170.1 | 174.4 | 0 | 115.1 | ||||
| 52 | A | 35.1 | Very low | 39.3 | Very low | 91 Ų | 91 | 134.5 Ų | 134.5 | 75% | 0.752 | 81% | 0.81 | S | S | * | * | trans | 31 | 133.7 | 136.8 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 53 | S | 34.9 | Very low | 39.5 | Very low | 126 Ų | 126 | 134.3 Ų | 134.3 | 88% | 0.881 | 81% | 0.808 | S | S | * | * | -176.5 | 130.6 | 126.6 | -70.8 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 54 | S | 39.6 | Very low | 39.9 | Very low | 117 Ų | 117 | 136.2 Ų | 136.2 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | trans | -97.2 | 159.5 | 160.9 | -53.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 55 | P | 50.5 | Low | 40.1 | Very low | 119 Ų | 119 | 135.6 Ų | 135.6 | 77% | 0.773 | 80% | 0.803 | S | S | * | * | -147.7 | 149.2 | 83.9 | 31.7 | -10.3 | 0 | 0 | 0 | 117 | |||||
| 56 | T | 39.7 | Very low | 40.2 | Very low | 129 Ų | 129 | 135 Ų | 135 | 79% | 0.791 | 80% | 0.801 | S | S | * | * | trans | 24.7 | 126.9 | 141.2 | -33.8 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 57 | T | 35.3 | Very low | 40.4 | Very low | 141 Ų | 141 | 137.2 Ų | 137.2 | 87% | 0.865 | 80% | 0.804 | S | S | * | * | 177.7 | 127.4 | 114.9 | -62.7 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 58 | G | 36.7 | Very low | 40.6 | Very low | 66 Ų | 66 | 137.7 Ų | 137.7 | 68% | 0.68 | 81% | 0.807 | S | S | * | * | trans | 93.7 | 104.4 | 141.9 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 59 | T | 38.9 | Very low | 40.6 | Very low | 141 Ų | 141 | 136.5 Ų | 136.5 | 87% | 0.865 | 81% | 0.805 | S | S | * | * | trans | 129.2 | 92.1 | 140.8 | -45.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 60 | A | 42.7 | Very low | 40.5 | Very low | 95 Ų | 95 | 133.9 Ų | 133.9 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | trans | -76.7 | 126.6 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 61 | P | 43.5 | Very low | 40.6 | Very low | 121 Ų | 121 | 132.4 Ų | 132.4 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | trans | -78.5 | 127.1 | 157.8 | 29.3 | -24.3 | 0 | 0 | 0 | 108.1 | S63 | P61-S63 PolarHBondContact O-N 2.83Å; P61-S63 VanDerWaalsContact O-N 3.16Å | ||
| 62 | R | 38.7 | Very low | 41.1 | Very low | 238 Ų | 238 | 127.3 Ų | 127.3 | 90% | 0.898 | 78% | 0.776 | S | S | * | * | trans | -33.2 | 117.7 | 169.1 | -84.5 | 170.4 | 153 | 176.2 | -7.5 | 110.7 | Q64 | R62-Q64 VanDerWaalsContact C-N 3.3Å; R62-Q64 PolarHBondContact O-N 2.72Å | ||
| 63 | S | 42.9 | Very low | 42 | Very low | 109 Ų | 109 | 129.1 Ų | 129.1 | 76% | 0.762 | 78% | 0.778 | S | S | * | * | trans | -51.1 | 99.2 | 155.8 | 29.7 | 0 | 0 | 0 | 0 | 107.6 | P61 S65 | P61-S63 PolarHBondContact O-N 2.83Å; P61-S63 VanDerWaalsContact O-N 3.16Å; S63-S65 PolarHBondContact O-N 3.31Å | ||
| 64 | Q | 45.6 | Very low | 43.3 | Very low | 179 Ų | 179 | 128.1 Ų | 128.1 | 84% | 0.836 | 76% | 0.759 | S | S | * | * | trans | -58.7 | 101.9 | 154.4 | -78.8 | 177 | -8.7 | 0 | 0 | 104.4 | R62 R66 | R62-Q64 VanDerWaalsContact C-N 3.3Å; R62-Q64 PolarHBondContact O-N 2.72Å; Q64-R66 PolarHBondContact O-N 2.84Å | ||
| 65 | S | 44.4 | Very low | 45.2 | Very low | 107 Ų | 107 | 126.5 Ų | 126.5 | 75% | 0.748 | 74% | 0.742 | S | S | * | * | trans | -51 | 92.8 | 156.2 | -55.4 | 0 | 0 | 0 | 0 | 105.1 | S63 L67 | S63-S65 PolarHBondContact O-N 3.31Å; S65-L67 PolarHBondContact O-N 3.46Å | ||
| 66 | R | 44.6 | Very low | 47 | Very low | 231 Ų | 231 | 123.6 Ų | 123.6 | 87% | 0.872 | 72% | 0.719 | S | S | * | * | trans | -58 | 103.1 | 158.4 | -82.2 | -151.8 | -112.6 | -114.7 | 4.2 | 102.7 | Q64 S68 | Q64-R66 PolarHBondContact O-N 2.84Å; R66-S68 VanDerWaalsContact C-N 3.32Å; R66-S68 PolarHBondContact O-N 3.33Å | ||
| 67 | L | 41.1 | Very low | 49.4 | Very low | 154 Ų | 154 | 117.4 Ų | 117.4 | 81% | 0.806 | 68% | 0.681 | S | S | * | * | trans | -40 | 110.2 | 160 | -70.6 | 160.7 | 0 | 0 | 0 | 104.5 | S65 V69 | S65-L67 PolarHBondContact O-N 3.46Å; L67-V69 PolarHBondContact O-N 3.22Å | ||
| 68 | S | 44.9 | Very low | 52 | Low | 99 Ų | 99 | 112.7 Ų | 112.7 | 69% | 0.692 | 65% | 0.647 | S | S | * | * | trans | -62 | 92.3 | 163.3 | 61.4 | 0 | 0 | 0 | 0 | 103.6 | R66 C70 | R66-S68 VanDerWaalsContact C-N 3.32Å; R66-S68 PolarHBondContact O-N 3.33Å; S68-C70 PolarHBondContact O-N 2.78Å | ||
| 69 | V | 38.5 | Very low | 54.4 | Low | 123 Ų | 123 | 112.7 Ų | 112.7 | 75% | 0.745 | 63% | 0.631 | S | S | * | * | trans | -60.4 | 95.8 | 154.2 | -179.7 | 0 | 0 | 0 | 0 | 102 | L67 P71 | L67-V69 PolarHBondContact O-N 3.22Å; V69-P71 WeakPolarHBondContact O-CD 3.09Å; V69-P71 VanDerWaalsContact O-N 3.08Å | ||
| 70 | C | 38.6 | Very low | 56.9 | Low | 96 Ų | 96 | 108.4 Ų | 108.4 | 65% | 0.649 | 61% | 0.607 | S | S | * | * | trans | -57.6 | 110.6 | 163 | -63.1 | 0 | 0 | 0 | 0 | 103.9 | S68 S72 | S68-C70 PolarHBondContact O-N 2.78Å; C70-S72 PolarHBondContact O-N 3.42Å | ||
| 71 | P | 42 | Very low | 59 | Low | 96 Ų | 96 | 110.5 Ų | 110.5 | 62% | 0.623 | 60% | 0.6 | S | S | * | * | trans | -72.1 | 88.8 | 170 | 29.3 | -24.1 | 0 | 0 | 0 | 104.3 | V69 T73 | V69-P71 WeakPolarHBondContact O-CD 3.09Å; V69-P71 VanDerWaalsContact O-N 3.08Å; P71-T73 VanDerWaalsContact C-N 3.33Å; P71-T73 PolarHBondContact O-N 3.5Å | ||
| 72 | S | 44.1 | Very low | 61.1 | Low | 96 Ų | 96 | 108.1 Ų | 108.1 | 67% | 0.671 | 59% | 0.585 | S | S | * | * | trans | -58.4 | 109.2 | 158.9 | 57.4 | 0 | 0 | 0 | 0 | 105.6 | C70 Q74 | C70-S72 PolarHBondContact O-N 3.42Å; S72-Q74 PolarHBondContact O-N 3.46Å | ||
| 73 | T | 55.1 | Low | 63.5 | Low | 128 Ų | 128 | 101.9 Ų | 101.9 | 79% | 0.785 | 57% | 0.566 | S | S | * | * | S | Bend | trans | 64.6 | 36.6 | 152.3 | 67.2 | 0 | 0 | 0 | 0 | 117.5 | P71 | P71-T73 VanDerWaalsContact C-N 3.33Å; P71-T73 PolarHBondContact O-N 3.5Å |
| 74 | Q | 61.3 | Low | 65.4 | Low | 105 Ų | 105 | 98.4 Ų | 98.4 | 49% | 0.491 | 55% | 0.547 | S | S | . | . | trans | -79.8 | 119.9 | 159.6 | -79.3 | 177 | -41.3 | 0 | 0 | 108.9 | S72 I76 E83 | S72-Q74 PolarHBondContact O-N 3.46Å; Q74-I76 HydrophobicContact CB-CG2 4.5Å; Q74-I76 PolarHBondContact O-N 3.41Å; Q74-I76 VanDerWaalsContact O-N 3.13Å; Q74-E83 PolarHBondContact NE2-OE1 3.42Å; Q74-E83 PolarHBondContact OE1-OE1 3.13Å | ||
| 75 | D | 80.3 | Confident | 67.1 | Low | 84 Ų | 84 | 94.1 Ų | 94.1 | 45% | 0.449 | 53% | 0.53 | S | S | . | . | trans | -66.4 | 110.7 | 172.3 | -64.9 | -24.2 | 0 | 0 | 0 | 107.2 | L90 F102 | D75-L90 HydrophobicContact CB-CD1 3.91Å; D75-L90 WeakPolarHBondContact O-CD1 3.36Å; D75-F102 HydrophobicContact CB-CD1 4.02Å; D75-F102 HydrophobicContact CB-CD2 3.99Å; D75-F102 HydrophobicContact CB-CE1 4.05Å; D75-F102 HydrophobicContact CB-CE2 4.03Å; D75-F102 HydrophobicContact CB-CG 3.98Å; D75-F102 HydrophobicContact CB-CZ 4.05Å; D75-F102 VanDerWaalsContact CG-CE2 3.45Å; D75-F102 WeakPolarHBondContact OD1-CE2 3.44Å; D75-F102 WeakPolarHBondContact OD1-CZ 3.49Å; D75-F102 WeakPolarHBondContact OD2-CE1 3.28Å; D75-F102 WeakPolarHBondContact OD2-CZ 3.47Å | ||
| 76 | I | 87.9 | Confident | 68.5 | Low | 57 Ų | 57 | 97 Ų | 97 | 29% | 0.292 | 54% | 0.537 | S | S | . | . | B | Isolated β-bridge | trans | -117.1 | 147.5 | 178.8 | 53.8 | 167.6 | 0 | 0 | 0 | 110 | Q74 R78 E83 | Q74-I76 HydrophobicContact CB-CG2 4.5Å; Q74-I76 PolarHBondContact O-N 3.41Å; Q74-I76 VanDerWaalsContact O-N 3.13Å; I76-R78 PolarHBondContact O-N 3.22Å; I76-E83 HydrophobicContact CG2-CG 3.97Å |
| 77 | C | 89.6 | Confident | 69.6 | Low | 0 Ų | 0 | 94.3 Ų | 94.3 | 0% | 0 | 53% | 0.534 | C | S | . | . | trans | -66.4 | 125.6 | 178.4 | 177.4 | 0 | 0 | 0 | 0 | 111.2 | I79 C80 H81 C82 L90 F102 H104 | C77-I79 PolarHBondContact O-N 3.15Å; C77-C80 WeakPolarHBondContact CB-SG 3.09Å; C77-H81 WeakPolarHBondContact O-CA 3.35Å; C77-H81 PolarHBondContact O-N 2.92Å; C77-C82 WeakPolarHBondContact CB-O 2.97Å; C77-C82 PolarHBondContact N-O 2.96Å; C77-L90 HydrophobicContact CB-CD2 3.65Å; C77-F102 WeakPolarHBondContact CA-O 3.44Å; C77-H104 VanDerWaalsContact CB-CE1 3.44Å; C77-H104 WeakPolarHBondContact CB-CE1 3.24Å; C77-H104 VanDerWaalsContact CB-ND1 3.28Å; C77-H104 WeakPolarHBondContact CB-ND1 3.2Å; C77-H104 PolarHBondContact SG-N 2.61Å; C77-H104 VanDerWaalsContact SG-N 3.38Å; C77-H104 PolarHBondContact SG-ND1 3.16Å; C77-H104 VanDerWaalsContact SG-ND1 3.37Å | ||
| 78 | R | 89.9 | Confident | 71.3 | Confident | 41 Ų | 41 | 88.8 Ų | 88.8 | 16% | 0.155 | 51% | 0.509 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.4 | -11.6 | 179 | 86.4 | -169.6 | -178.7 | 109 | 2.8 | 115.2 | I76 L100 F102 V103 E121 | I76-R78 PolarHBondContact O-N 3.22Å; R78-L100 HydrophobicContact CB-CD2 4.44Å; R78-L100 WeakPolarHBondContact CD-O 3.43Å; R78-F102 PolarHBondContact N-O 2.85Å; R78-V103 HydrophobicContact CG-CG2 3.94Å; R78-E121 IonicContact CZ-OE1 3.02Å; R78-E121 IonicContact NH1-OE1 3.78Å; R78-E121 PolarHBondContact NH1-OE1 3.34Å; R78-E121 IonicContact NH2-OE1 3.52Å; R78-E121 PolarHBondContact NH2-OE1 3.28Å |
| 79 | I | 88.6 | Confident | 73.2 | Confident | 66 Ų | 66 | 87.8 Ų | 87.8 | 34% | 0.338 | 50% | 0.5 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.7 | -50.9 | -174.6 | -59 | 180 | 0 | 0 | 0 | 111.1 | C77 V103 C107 W111 | C77-I79 PolarHBondContact O-N 3.15Å; I79-V103 HydrophobicContact CD1-CG1 3.39Å; I79-V103 HydrophobicContact CG1-CG1 3.88Å; I79-C107 HydrophobicContact CB-CB 3.99Å; I79-C107 HydrophobicContact CD1-CB 3.89Å; I79-C107 HydrophobicContact CG1-CB 4.45Å; I79-C107 HydrophobicContact CG2-CB 4.1Å; I79-W111 HydrophobicContact CD1-CB 4.07Å; I79-W111 HydrophobicContact CD1-CG 4.47Å |
| 80 | C | 89.9 | Confident | 75.5 | Confident | 52 Ų | 52 | 83.8 Ų | 83.8 | 35% | 0.351 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -102.2 | -9.7 | -178.5 | 65 | 0 | 0 | 0 | 0 | 113.6 | C77 C82 H104 | C77-C80 WeakPolarHBondContact CB-SG 3.09Å; C80-C82 PolarHBondContact O-N 3.27Å; C80-H104 PolarHBondContact SG-CE1 3.45Å; C80-H104 PolarHBondContact SG-ND1 3.5Å |
| 81 | H | 88.6 | Confident | 77.9 | Confident | 138 Ų | 138 | 79.7 Ų | 79.7 | 64% | 0.639 | 45% | 0.446 | S | S | * | . | trans | 59.4 | 24 | -176.3 | -50.8 | 153.3 | 0 | 0 | 0 | 114.4 | C77 | C77-H81 WeakPolarHBondContact O-CA 3.35Å; C77-H81 PolarHBondContact O-N 2.92Å | ||
| 82 | C | 87.6 | Confident | 80.1 | Confident | 72 Ų | 72 | 75.7 Ų | 75.7 | 49% | 0.486 | 42% | 0.42 | S | S | . | . | P | Polyproline II helix | trans | -99 | 153.8 | 172.2 | -56.2 | 0 | 0 | 0 | 0 | 111.2 | C77 C80 | C77-C82 WeakPolarHBondContact CB-O 2.97Å; C77-C82 PolarHBondContact N-O 2.96Å; C80-C82 PolarHBondContact O-N 3.27Å |
| 83 | E | 87.6 | Confident | 82.1 | Confident | 107 Ų | 107 | 71.1 Ų | 71.1 | 50% | 0.5 | 39% | 0.388 | S | S | . | . | B | Isolated β-bridge | trans | -65.9 | 162 | 171.6 | -63.4 | 177.5 | -174.4 | 0 | 0 | 111.3 | Q74 I76 H104 | Q74-E83 PolarHBondContact NE2-OE1 3.42Å; Q74-E83 PolarHBondContact OE1-OE1 3.13Å; I76-E83 HydrophobicContact CG2-CG 3.97Å; E83-H104 PolarHBondContact O-CE1 3.42Å; E83-H104 PolarHBondContact O-NE2 3.46Å |
| 84 | G | 83.5 | Confident | 83.8 | Confident | 35 Ų | 35 | 65.1 Ų | 65.1 | 36% | 0.361 | 35% | 0.351 | S | S | . | . | P | Polyproline II helix | trans | -78.5 | 137.8 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 85 | D | 80.8 | Confident | 85 | Confident | 89 Ų | 89 | 66.2 Ų | 66.2 | 48% | 0.476 | 35% | 0.351 | S | S | . | . | trans | -114.3 | 173.5 | 170.9 | 64.3 | 19.7 | 0 | 0 | 0 | 110.7 | E87 S88 | D85-E87 PolarHBondContact O-N 3.42Å; D85-E87 PolarHBondContact OD1-N 3.33Å; D85-S88 VanDerWaalsContact CG-OG 3.28Å; D85-S88 PolarHBondContact N-O 3.32Å; D85-S88 CarbonylContact O-C 3.57Å; D85-S88 PolarHBondContact O-N 3.22Å; D85-S88 VanDerWaalsContact OD1-CA 3.25Å; D85-S88 WeakPolarHBondContact OD1-CA 3.4Å; D85-S88 VanDerWaalsContact OD1-CB 3.27Å; D85-S88 WeakPolarHBondContact OD1-CB 2.92Å; D85-S88 PolarHBondContact OD1-N 3.3Å; D85-S88 PolarHBondContact OD1-OG 2.95Å; D85-S88 PolarHBondContact OD2-OG 3.35Å | ||
| 86 | D | 73.6 | Confident | 85.2 | Confident | 169 Ų | 169 | 62.9 Ų | 62.9 | 90% | 0.904 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -63.5 | -26 | -179.4 | -66.8 | -40.8 | 0 | 0 | 0 | 112.8 | ||
| 87 | E | 69.1 | Low | 85.2 | Confident | 173 Ų | 173 | 65.3 Ų | 65.3 | 81% | 0.808 | 35% | 0.351 | S | S | * | . | S | Bend | trans | -85.7 | -23.5 | 178.9 | -70.9 | -66.4 | 130.5 | 0 | 0 | 112.9 | D85 | D85-E87 PolarHBondContact O-N 3.42Å; D85-E87 PolarHBondContact OD1-N 3.33Å |
| 88 | S | 76.2 | Confident | 84.9 | Confident | 39 Ų | 39 | 67.6 Ų | 67.6 | 27% | 0.273 | 38% | 0.375 | S | S | . | . | S | Bend | trans | -142.3 | 75.7 | -175.9 | 68.2 | 0 | 0 | 0 | 0 | 110.4 | D85 H104 | D85-S88 VanDerWaalsContact CG-OG 3.28Å; D85-S88 PolarHBondContact N-O 3.32Å; D85-S88 CarbonylContact O-C 3.57Å; D85-S88 PolarHBondContact O-N 3.22Å; D85-S88 VanDerWaalsContact OD1-CA 3.25Å; D85-S88 WeakPolarHBondContact OD1-CA 3.4Å; D85-S88 VanDerWaalsContact OD1-CB 3.27Å; D85-S88 WeakPolarHBondContact OD1-CB 2.92Å; D85-S88 PolarHBondContact OD1-N 3.3Å; D85-S88 PolarHBondContact OD1-OG 2.95Å; D85-S88 PolarHBondContact OD2-OG 3.35Å; S88-H104 PolarHBondContact O-CD2 2.58Å |
| 89 | P | 84.3 | Confident | 84.6 | Confident | 78 Ų | 78 | 69.8 Ų | 69.8 | 51% | 0.506 | 39% | 0.393 | S | S | . | . | trans | -67.4 | 152.3 | 178.1 | 26.8 | -34.7 | 0 | 0 | 0 | 111.7 | ||||
| 90 | L | 87.6 | Confident | 84.4 | Confident | 38 Ų | 38 | 70.6 Ų | 70.6 | 20% | 0.199 | 40% | 0.398 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.2 | 135.2 | 172.5 | -69.5 | 159.9 | 0 | 0 | 0 | 110.2 | D75 C77 F102 | D75-L90 HydrophobicContact CB-CD1 3.91Å; D75-L90 WeakPolarHBondContact O-CD1 3.36Å; C77-L90 HydrophobicContact CB-CD2 3.65Å; L90-F102 HydrophobicContact CB-CB 4.5Å; L90-F102 HydrophobicContact CB-CD1 4.49Å; L90-F102 HydrophobicContact CD2-CB 4.27Å |
| 91 | I | 88 | Confident | 84.2 | Confident | 11 Ų | 11 | 71 Ų | 71 | 6% | 0.056 | 39% | 0.392 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.8 | 158.1 | 175.2 | 59.2 | 160.5 | 0 | 0 | 0 | 110.5 | P93 F102 V103 L108 V235 N237 | I91-P93 HydrophobicContact CD1-CB 4.48Å; I91-P93 WeakPolarHBondContact O-CD 3.2Å; I91-F102 WeakPolarHBondContact O-CA 3.27Å; I91-V103 WeakPolarHBondContact CG1-O 3.36Å; I91-V103 PolarHBondContact N-O 2.65Å; I91-V103 PolarHBondContact O-N 2.88Å; I91-L108 HydrophobicContact CD1-CD2 3.79Å; I91-V235 HydrophobicContact CD1-CB 4.23Å; I91-N237 VanDerWaalsContact CA-OD1 3.24Å; I91-N237 WeakPolarHBondContact CA-OD1 3.38Å; I91-N237 WeakPolarHBondContact CB-OD1 3.4Å |
| 92 | T | 88.9 | Confident | 84.2 | Confident | 11 Ų | 11 | 66.1 Ų | 66.1 | 7% | 0.067 | 37% | 0.369 | C | S | . | . | trans | -113.1 | 82.9 | 174.5 | 59 | 0 | 0 | 0 | 0 | 110.2 | C94 R101 F102 N237 C238 T241 | T92-C94 PolarHBondContact O-N 3.42Å; T92-R101 WeakPolarHBondContact CA-O 3.5Å; T92-R101 HydrophobicContact CG2-CB 4.48Å; T92-R101 HydrophobicContact CG2-CG 3.93Å; T92-F102 HydrophobicContact CG2-CD1 3.8Å; T92-F102 HydrophobicContact CG2-CE1 3.8Å; T92-N237 PolarHBondContact N-OD1 3.27Å; T92-N237 WeakPolarHBondContact O-CA 3.49Å; T92-N237 PolarHBondContact OG1-OD1 3.42Å; T92-C238 PolarHBondContact O-N 3.44Å; T92-T241 HydrophobicContact CG2-CG2 4.22Å; T92-T241 WeakPolarHBondContact OG1-CB 3.33Å; T92-T241 PolarHBondContact OG1-OG1 3.38Å | ||
| 93 | P | 87.1 | Confident | 84.2 | Confident | 1 Ų | 1 | 62.7 Ų | 62.7 | 1% | 0.006 | 35% | 0.346 | C | S | . | . | trans | -76 | -10.6 | -170.9 | 33.8 | -39.6 | 0 | 0 | 0 | 113.5 | I91 R101 V103 L108 F127 V235 | I91-P93 HydrophobicContact CD1-CB 4.48Å; I91-P93 WeakPolarHBondContact O-CD 3.2Å; P93-R101 WeakPolarHBondContact CD-O 3.15Å; P93-V103 HydrophobicContact CG-CG2 4.19Å; P93-L108 HydrophobicContact CB-CD2 3.38Å; P93-L108 HydrophobicContact CG-CD1 4.31Å; P93-L108 HydrophobicContact CG-CD2 3.66Å; P93-F127 HydrophobicContact CB-CD1 3.81Å; P93-F127 HydrophobicContact CB-CE1 4Å; P93-F127 HydrophobicContact CG-CE1 4.22Å; P93-F127 WeakPolarHBondContact O-CD1 3.49Å; P93-V235 HydrophobicContact CB-CG1 3.82Å | ||
| 94 | C | 89.4 | Confident | 84.3 | Confident | 2 Ų | 2 | 58.1 Ų | 58.1 | 1% | 0.014 | 32% | 0.324 | C | S | . | . | S | Bend | trans | -146.5 | 178.4 | -174.9 | 67.8 | 0 | 0 | 0 | 0 | 112.4 | T92 C96 C120 Y125 F127 C238 | T92-C94 PolarHBondContact O-N 3.42Å; C94-C96 VanDerWaalsContact C-N 3.28Å; C94-C96 PolarHBondContact O-N 3.34Å; C94-C96 PolarHBondContact SG-SG 3.13Å; C94-C120 HydrophobicContact CB-CB 3.76Å; C94-C120 VanDerWaalsContact SG-SG 3.65Å; C94-Y125 HydrophobicContact CB-CD1 4.17Å; C94-F127 HydrophobicContact CB-CE1 4.18Å; C94-C238 PolarHBondContact O-SG 3.43Å |
| 95 | R | 86.4 | Confident | 84.4 | Confident | 128 Ų | 128 | 58.1 Ų | 58.1 | 48% | 0.483 | 32% | 0.315 | S | S | . | . | S | Bend | trans | -87.1 | 12.4 | -176.8 | -62 | 174.4 | -179.8 | -97.9 | -15.6 | 114 | Y125 D240 | R95-Y125 HydrophobicContact CG-CD2 4.04Å; R95-Y125 HydrophobicContact CG-CE2 4.41Å; R95-Y125 HydrophobicContact CG-CG 4.17Å; R95-Y125 VanDerWaalsContact NE-CD2 3.31Å; R95-D240 IonicContact CZ-OD2 3.24Å; R95-D240 IonicContact NE-OD2 2.81Å; R95-D240 IonicContact NH1-OD2 2.59Å; R95-D240 PolarHBondContact NH1-OD2 2.82Å; R95-D240 IonicContact NH2-OD2 2.86Å; R95-D240 PolarHBondContact NH2-OD2 3.28Å |
| 96 | C | 85.9 | Confident | 84.6 | Confident | 13 Ų | 13 | 57.1 Ų | 57.1 | 9% | 0.088 | 32% | 0.319 | C | S | . | . | trans | -60 | 153.5 | 176.9 | -70.5 | 0 | 0 | 0 | 0 | 111.1 | C94 L100 R101 C120 C123 | C94-C96 VanDerWaalsContact C-N 3.28Å; C94-C96 PolarHBondContact O-N 3.34Å; C94-C96 PolarHBondContact SG-SG 3.13Å; C96-L100 HydrophobicContact CB-CB 4.34Å; C96-R101 HydrophobicContact CB-CB 4.4Å; C96-R101 WeakPolarHBondContact O-CB 3.35Å; C96-C120 VanDerWaalsContact SG-SG 3.65Å; C96-C123 VanDerWaalsContact SG-SG 3.62Å | ||
| 97 | T | 86 | Confident | 85.2 | Confident | 108 Ų | 108 | 50.4 Ų | 50.4 | 66% | 0.663 | 29% | 0.285 | S | S | * | . | trans | -108.7 | 168.5 | 179.4 | 58.3 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 98 | G | 84.4 | Confident | 86.1 | Confident | 49 Ų | 49 | 42.2 Ų | 42.2 | 51% | 0.505 | 25% | 0.247 | S | C | . | . | G | 310 helix | trans | 61.8 | -149.1 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | L100 R101 | G98-L100 VanDerWaalsContact C-N 3.28Å; G98-L100 PolarHBondContact O-N 2.9Å; G98-R101 WeakPolarHBondContact O-CG 3.25Å; G98-R101 PolarHBondContact O-NE 3.38Å |
| 99 | T | 82.8 | Confident | 86.5 | Confident | 86 Ų | 86 | 43.6 Ų | 43.6 | 53% | 0.528 | 25% | 0.249 | S | C | . | . | G | 310 helix | trans | -69.6 | -21.4 | -179 | 52.2 | 0 | 0 | 0 | 0 | 113.5 | R101 F102 | T99-R101 PolarHBondContact O-N 2.88Å; T99-R101 VanDerWaalsContact O-N 3.13Å; T99-F102 PolarHBondContact O-N 3.04Å |
| 100 | L | 85.1 | Confident | 86.5 | Confident | 83 Ų | 83 | 45.4 Ų | 45.4 | 44% | 0.435 | 25% | 0.251 | S | S | . | . | G | 310 helix | trans | -70.2 | -7.7 | -179.1 | -63.8 | 176.5 | 0 | 0 | 0 | 113.8 | R78 C96 G98 L122 | R78-L100 HydrophobicContact CB-CD2 4.44Å; R78-L100 WeakPolarHBondContact CD-O 3.43Å; C96-L100 HydrophobicContact CB-CB 4.34Å; G98-L100 VanDerWaalsContact C-N 3.28Å; G98-L100 PolarHBondContact O-N 2.9Å; L100-L122 HydrophobicContact CB-CD1 4.47Å; L100-L122 HydrophobicContact CD1-CD1 3.92Å |
| 101 | R | 86.1 | Confident | 86.5 | Confident | 62 Ų | 62 | 45.9 Ų | 45.9 | 23% | 0.234 | 25% | 0.25 | C | C | . | . | G | 310 helix | trans | -82.8 | -25.1 | 177.6 | 82.2 | 174.9 | 69 | -155.6 | 3.2 | 113.2 | T92 P93 C96 G98 T99 | T92-R101 WeakPolarHBondContact CA-O 3.5Å; T92-R101 HydrophobicContact CG2-CB 4.48Å; T92-R101 HydrophobicContact CG2-CG 3.93Å; P93-R101 WeakPolarHBondContact CD-O 3.15Å; C96-R101 HydrophobicContact CB-CB 4.4Å; C96-R101 WeakPolarHBondContact O-CB 3.35Å; G98-R101 WeakPolarHBondContact O-CG 3.25Å; G98-R101 PolarHBondContact O-NE 3.38Å; T99-R101 PolarHBondContact O-N 2.88Å; T99-R101 VanDerWaalsContact O-N 3.13Å |
| 102 | F | 88.3 | Confident | 86.5 | Confident | 34 Ų | 34 | 46.5 Ų | 46.5 | 15% | 0.149 | 25% | 0.253 | C | S | . | . | trans | -94.5 | 128.8 | -170.4 | -60.4 | -74.5 | 0 | 0 | 0 | 111.5 | D75 C77 R78 L90 I91 T92 T99 | D75-F102 HydrophobicContact CB-CD1 4.02Å; D75-F102 HydrophobicContact CB-CD2 3.99Å; D75-F102 HydrophobicContact CB-CE1 4.05Å; D75-F102 HydrophobicContact CB-CE2 4.03Å; D75-F102 HydrophobicContact CB-CG 3.98Å; D75-F102 HydrophobicContact CB-CZ 4.05Å; D75-F102 VanDerWaalsContact CG-CE2 3.45Å; D75-F102 WeakPolarHBondContact OD1-CE2 3.44Å; D75-F102 WeakPolarHBondContact OD1-CZ 3.49Å; D75-F102 WeakPolarHBondContact OD2-CE1 3.28Å; D75-F102 WeakPolarHBondContact OD2-CZ 3.47Å; C77-F102 WeakPolarHBondContact CA-O 3.44Å; R78-F102 PolarHBondContact N-O 2.85Å; L90-F102 HydrophobicContact CB-CB 4.5Å; L90-F102 HydrophobicContact CB-CD1 4.49Å; L90-F102 HydrophobicContact CD2-CB 4.27Å; I91-F102 WeakPolarHBondContact O-CA 3.27Å; T92-F102 HydrophobicContact CG2-CD1 3.8Å; T92-F102 HydrophobicContact CG2-CE1 3.8Å; T99-F102 PolarHBondContact O-N 3.04Å | ||
| 103 | V | 88.5 | Confident | 86.2 | Confident | 1 Ų | 1 | 53.1 Ų | 53.1 | 1% | 0.006 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.3 | 143.4 | -179.5 | -164.5 | 0 | 0 | 0 | 0 | 109.7 | R78 I79 I91 P93 C107 L108 | R78-V103 HydrophobicContact CG-CG2 3.94Å; I79-V103 HydrophobicContact CD1-CG1 3.39Å; I79-V103 HydrophobicContact CG1-CG1 3.88Å; I91-V103 WeakPolarHBondContact CG1-O 3.36Å; I91-V103 PolarHBondContact N-O 2.65Å; I91-V103 PolarHBondContact O-N 2.88Å; P93-V103 HydrophobicContact CG-CG2 4.19Å; V103-C107 HydrophobicContact CG1-CB 4.18Å; V103-L108 HydrophobicContact CB-CB 4.48Å; V103-L108 HydrophobicContact CG1-CB 3.83Å |
| 104 | H | 89.3 | Confident | 86 | Confident | 11 Ų | 11 | 57.4 Ų | 57.4 | 5% | 0.051 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.2 | 146.9 | 168.3 | -61.9 | 118.3 | 0 | 0 | 0 | 111.7 | C77 C80 E83 S88 A106 C107 L108 | C77-H104 VanDerWaalsContact CB-CE1 3.44Å; C77-H104 WeakPolarHBondContact CB-CE1 3.24Å; C77-H104 VanDerWaalsContact CB-ND1 3.28Å; C77-H104 WeakPolarHBondContact CB-ND1 3.2Å; C77-H104 PolarHBondContact SG-N 2.61Å; C77-H104 VanDerWaalsContact SG-N 3.38Å; C77-H104 PolarHBondContact SG-ND1 3.16Å; C77-H104 VanDerWaalsContact SG-ND1 3.37Å; C80-H104 PolarHBondContact SG-CE1 3.45Å; C80-H104 PolarHBondContact SG-ND1 3.5Å; E83-H104 PolarHBondContact O-CE1 3.42Å; E83-H104 PolarHBondContact O-NE2 3.46Å; S88-H104 PolarHBondContact O-CD2 2.58Å; H104-A106 VanDerWaalsContact C-N 3.25Å; H104-A106 PolarHBondContact O-N 3.24Å; H104-C107 HydrophobicContact CB-CB 4.1Å; H104-C107 PolarHBondContact O-N 3.21Å; H104-L108 PolarHBondContact O-N 3.27Å |
| 105 | Q | 85.6 | Confident | 85.8 | Confident | 34 Ų | 34 | 59.4 Ų | 59.4 | 16% | 0.159 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -48.7 | -47 | 172.2 | -167 | 82.1 | 29.1 | 0 | 0 | 112.4 | H109 F234 V235 | Q105-H109 VanDerWaalsContact O-CB 3.28Å; Q105-H109 WeakPolarHBondContact O-CB 3.33Å; Q105-H109 PolarHBondContact O-N 3.23Å; Q105-F234 HydrophobicContact CG-CD2 4.15Å; Q105-F234 HydrophobicContact CG-CE2 3.7Å; Q105-F234 HydrophobicContact CG-CZ 4.03Å; Q105-F234 VanDerWaalsContact NE2-CE1 3.28Å; Q105-F234 VanDerWaalsContact NE2-CZ 3.32Å; Q105-V235 PolarHBondContact NE2-O 3.29Å |
| 106 | A | 85.1 | Confident | 85.7 | Confident | 69 Ų | 69 | 59 Ų | 59 | 57% | 0.57 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -69.9 | -43.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | H104 H109 Q110 | H104-A106 VanDerWaalsContact C-N 3.25Å; H104-A106 PolarHBondContact O-N 3.24Å; A106-H109 PolarHBondContact O-N 3.02Å; A106-Q110 WeakPolarHBondContact O-CB 3.06Å; A106-Q110 PolarHBondContact O-N 3.16Å |
| 107 | C | 86.4 | Confident | 85.6 | Confident | 28 Ų | 28 | 60.9 Ų | 60.9 | 19% | 0.189 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -63.5 | -44.4 | 178.5 | -64 | 0 | 0 | 0 | 0 | 111.5 | I79 V103 H104 Q110 W111 | I79-C107 HydrophobicContact CB-CB 3.99Å; I79-C107 HydrophobicContact CD1-CB 3.89Å; I79-C107 HydrophobicContact CG1-CB 4.45Å; I79-C107 HydrophobicContact CG2-CB 4.1Å; V103-C107 HydrophobicContact CG1-CB 4.18Å; H104-C107 HydrophobicContact CB-CB 4.1Å; H104-C107 PolarHBondContact O-N 3.21Å; C107-Q110 PolarHBondContact O-N 3.26Å; C107-W111 WeakPolarHBondContact O-CB 3.4Å; C107-W111 PolarHBondContact O-N 3.48Å |
| 108 | L | 87.8 | Confident | 85.5 | Confident | 0 Ų | 0 | 62.6 Ų | 62.6 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -64.3 | -44 | 177.1 | -176.5 | 64.6 | 0 | 0 | 0 | 111.6 | I91 P93 V103 H104 Q110 W111 I112 F127 V235 | I91-L108 HydrophobicContact CD1-CD2 3.79Å; P93-L108 HydrophobicContact CB-CD2 3.38Å; P93-L108 HydrophobicContact CG-CD1 4.31Å; P93-L108 HydrophobicContact CG-CD2 3.66Å; V103-L108 HydrophobicContact CB-CB 4.48Å; V103-L108 HydrophobicContact CG1-CB 3.83Å; H104-L108 PolarHBondContact O-N 3.27Å; L108-Q110 VanDerWaalsContact C-N 3.32Å; L108-Q110 PolarHBondContact O-N 3.37Å; L108-W111 HydrophobicContact CD1-CE3 4.46Å; L108-W111 PolarHBondContact O-N 3.25Å; L108-I112 HydrophobicContact CD1-CD1 4.23Å; L108-I112 HydrophobicContact CD1-CG1 4.34Å; L108-I112 HydrophobicContact CD2-CD1 4.48Å; L108-I112 HydrophobicContact CG-CD1 3.93Å; L108-I112 HydrophobicContact CG-CG1 4.41Å; L108-I112 WeakPolarHBondContact O-CG1 3.11Å; L108-I112 PolarHBondContact O-N 2.59Å; L108-F127 HydrophobicContact CD1-CE1 4.45Å; L108-F127 HydrophobicContact CD1-CE2 4.46Å; L108-F127 HydrophobicContact CD1-CZ 4.13Å; L108-V235 HydrophobicContact CD2-CB 3.77Å; L108-V235 HydrophobicContact CD2-CG1 3.68Å; L108-V235 HydrophobicContact CD2-CG2 3.84Å; L108-V235 HydrophobicContact CG-CG2 4.46Å |
| 109 | H | 84.3 | Confident | 85.6 | Confident | 68 Ų | 68 | 62.2 Ų | 62.2 | 32% | 0.315 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.6 | -41.2 | 178.4 | -173.8 | -117.1 | 0 | 0 | 0 | 111.7 | Q105 A106 K113 | Q105-H109 VanDerWaalsContact O-CB 3.28Å; Q105-H109 WeakPolarHBondContact O-CB 3.33Å; Q105-H109 PolarHBondContact O-N 3.23Å; A106-H109 PolarHBondContact O-N 3.02Å; H109-K113 VanDerWaalsContact O-CB 3.3Å; H109-K113 WeakPolarHBondContact O-CB 2.97Å; H109-K113 PolarHBondContact O-N 3.23Å |
| 110 | Q | 83.9 | Confident | 85.8 | Confident | 117 Ų | 117 | 58.1 Ų | 58.1 | 55% | 0.547 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.6 | -43 | 175 | -174.6 | 64.5 | 13.6 | 0 | 0 | 111.9 | A106 C107 L108 K113 S114 | A106-Q110 WeakPolarHBondContact O-CB 3.06Å; A106-Q110 PolarHBondContact O-N 3.16Å; C107-Q110 PolarHBondContact O-N 3.26Å; L108-Q110 VanDerWaalsContact C-N 3.32Å; L108-Q110 PolarHBondContact O-N 3.37Å; Q110-K113 PolarHBondContact O-N 3.38Å; Q110-S114 PolarHBondContact O-N 2.94Å; Q110-S114 PolarHBondContact O-OG 3.28Å |
| 111 | W | 87.4 | Confident | 86 | Confident | 48 Ų | 48 | 58.5 Ų | 58.5 | 18% | 0.182 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.8 | -43.6 | 178.3 | 179.9 | 93.1 | 0 | 0 | 0 | 112.6 | I79 C107 L108 K113 S114 S115 T117 E121 F127 | I79-W111 HydrophobicContact CD1-CB 4.07Å; I79-W111 HydrophobicContact CD1-CG 4.47Å; C107-W111 WeakPolarHBondContact O-CB 3.4Å; C107-W111 PolarHBondContact O-N 3.48Å; L108-W111 HydrophobicContact CD1-CE3 4.46Å; L108-W111 PolarHBondContact O-N 3.25Å; W111-K113 VanDerWaalsContact C-N 3.29Å; W111-K113 PolarHBondContact O-N 2.92Å; W111-S114 WeakPolarHBondContact CA-OG 3.31Å; W111-S114 PolarHBondContact O-N 3.41Å; W111-S114 PolarHBondContact O-OG 2.73Å; W111-S115 VanDerWaalsContact O-CB 3.3Å; W111-S115 WeakPolarHBondContact O-CB 3.4Å; W111-S115 PolarHBondContact O-N 2.84Å; W111-S115 PolarHBondContact O-OG 2.85Å; W111-T117 WeakPolarHBondContact CH2-OG1 3.41Å; W111-T117 WeakPolarHBondContact CZ3-OG1 3.28Å; W111-E121 HydrophobicContact CH2-CB 4.45Å; W111-E121 HydrophobicContact CZ2-CB 4.26Å; W111-E121 HydrophobicContact CZ2-CG 4.49Å; W111-E121 WeakPolarHBondContact CZ2-OE2 3.35Å; W111-F127 AromaticContact CZ3-CE2 3.85Å; W111-F127 HydrophobicContact CZ3-CE2 3.85Å; W111-F127 HydrophobicContact CZ3-CZ 4.18Å |
| 112 | I | 87.3 | Confident | 86.2 | Confident | 23 Ų | 23 | 60 Ų | 60 | 12% | 0.118 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.5 | -43.8 | 174.9 | -71.4 | 172.9 | 0 | 0 | 0 | 109.7 | L108 S114 S115 D116 T117 F127 V235 | L108-I112 HydrophobicContact CD1-CD1 4.23Å; L108-I112 HydrophobicContact CD1-CG1 4.34Å; L108-I112 HydrophobicContact CD2-CD1 4.48Å; L108-I112 HydrophobicContact CG-CD1 3.93Å; L108-I112 HydrophobicContact CG-CG1 4.41Å; L108-I112 WeakPolarHBondContact O-CG1 3.11Å; L108-I112 PolarHBondContact O-N 2.59Å; I112-S114 VanDerWaalsContact C-N 3.35Å; I112-S114 PolarHBondContact O-N 2.95Å; I112-S115 PolarHBondContact O-N 2.86Å; I112-S115 PolarHBondContact O-OG 3.24Å; I112-D116 WeakPolarHBondContact O-CA 3.14Å; I112-D116 PolarHBondContact O-N 2.96Å; I112-T117 WeakPolarHBondContact CG2-O 3.41Å; I112-F127 HydrophobicContact CD1-CD2 3.7Å; I112-F127 HydrophobicContact CD1-CE2 4.04Å; I112-F127 HydrophobicContact CD1-CG 4.45Å; I112-F127 HydrophobicContact CG1-CD2 4.17Å; I112-F127 HydrophobicContact CG1-CE2 4.07Å; I112-V235 HydrophobicContact CD1-CG2 3.89Å |
| 113 | K | 82.9 | Confident | 86.1 | Confident | 151 Ų | 151 | 60.9 Ų | 60.9 | 66% | 0.657 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -64.1 | -37.3 | 179.3 | -174.6 | -179.3 | 178.1 | -173.9 | 0 | 112.7 | H109 Q110 W111 | H109-K113 VanDerWaalsContact O-CB 3.3Å; H109-K113 WeakPolarHBondContact O-CB 2.97Å; H109-K113 PolarHBondContact O-N 3.23Å; Q110-K113 PolarHBondContact O-N 3.38Å; W111-K113 VanDerWaalsContact C-N 3.29Å; W111-K113 PolarHBondContact O-N 2.92Å |
| 114 | S | 83.4 | Confident | 86.1 | Confident | 91 Ų | 91 | 67.6 Ų | 67.6 | 64% | 0.636 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -79.2 | -32.6 | 178.1 | 56.1 | 0 | 0 | 0 | 0 | 113.5 | Q110 W111 I112 | Q110-S114 PolarHBondContact O-N 2.94Å; Q110-S114 PolarHBondContact O-OG 3.28Å; W111-S114 WeakPolarHBondContact CA-OG 3.31Å; W111-S114 PolarHBondContact O-N 3.41Å; W111-S114 PolarHBondContact O-OG 2.73Å; I112-S114 VanDerWaalsContact C-N 3.35Å; I112-S114 PolarHBondContact O-N 2.95Å |
| 115 | S | 85 | Confident | 86 | Confident | 43 Ų | 43 | 69.5 Ų | 69.5 | 30% | 0.301 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -90 | -18.2 | -176.6 | 62.7 | 0 | 0 | 0 | 0 | 114.1 | W111 I112 T117 | W111-S115 VanDerWaalsContact O-CB 3.3Å; W111-S115 WeakPolarHBondContact O-CB 3.4Å; W111-S115 PolarHBondContact O-N 2.84Å; W111-S115 PolarHBondContact O-OG 2.85Å; I112-S115 PolarHBondContact O-N 2.86Å; I112-S115 PolarHBondContact O-OG 3.24Å; S115-T117 PolarHBondContact O-N 2.98Å; S115-T117 VanDerWaalsContact O-N 3.15Å; S115-T117 PolarHBondContact OG-N 2.85Å; S115-T117 PolarHBondContact OG-OG1 3.26Å |
| 116 | D | 83.7 | Confident | 85.9 | Confident | 120 Ų | 120 | 73.2 Ų | 73.2 | 64% | 0.642 | 38% | 0.38 | S | S | * | . | trans | 53.7 | 22.9 | -169.2 | -156.2 | 30.3 | 0 | 0 | 0 | 113.4 | I112 | I112-D116 WeakPolarHBondContact O-CA 3.14Å; I112-D116 PolarHBondContact O-N 2.96Å | ||
| 117 | T | 83.9 | Confident | 85.9 | Confident | 53 Ų | 53 | 70.5 Ų | 70.5 | 33% | 0.325 | 36% | 0.355 | S | S | . | . | trans | -102.9 | 144.1 | 178.8 | 65.2 | 0 | 0 | 0 | 0 | 112 | W111 I112 S115 | W111-T117 WeakPolarHBondContact CH2-OG1 3.41Å; W111-T117 WeakPolarHBondContact CZ3-OG1 3.28Å; I112-T117 WeakPolarHBondContact CG2-O 3.41Å; S115-T117 PolarHBondContact O-N 2.98Å; S115-T117 VanDerWaalsContact O-N 3.15Å; S115-T117 PolarHBondContact OG-N 2.85Å; S115-T117 PolarHBondContact OG-OG1 3.26Å | ||
| 118 | R | 83.9 | Confident | 85.6 | Confident | 144 Ų | 144 | 71.7 Ų | 71.7 | 54% | 0.543 | 36% | 0.36 | S | S | . | . | trans | -111.8 | 4.2 | -176.7 | -68.9 | -172.3 | 175.1 | -150.5 | -0.1 | 114 | F127 M129 | R118-F127 VanDerWaalsContact C-CD2 3.44Å; R118-F127 VanDerWaalsContact O-CD2 3.22Å; R118-F127 WeakPolarHBondContact O-CD2 3.45Å; R118-F127 PolarHBondContact O-N 3.38Å; R118-M129 HydrophobicContact CB-CE 3.54Å; R118-M129 HydrophobicContact CG-CE 3.61Å; R118-M129 HydrophobicContact CG-SD 4.47Å | ||
| 119 | C | 86.8 | Confident | 85 | Confident | 41 Ų | 41 | 74.1 Ų | 74.1 | 28% | 0.277 | 37% | 0.371 | S | S | . | . | B | Isolated β-bridge | trans | -130.5 | 158.1 | -178.9 | 59.5 | 0 | 0 | 0 | 0 | 110.4 | E121 Y125 D126 F127 | C119-E121 PolarHBondContact O-N 2.81Å; C119-Y125 CarbonylContact C-O 3.14Å; C119-Y125 VanDerWaalsContact CA-O 3.31Å; C119-Y125 WeakPolarHBondContact CA-O 3.45Å; C119-D126 WeakPolarHBondContact CB-OD1 3.46Å; C119-F127 VanDerWaalsContact C-CE2 3.45Å; C119-F127 WeakPolarHBondContact O-CE2 3.22Å |
| 120 | C | 88.3 | Confident | 84.1 | Confident | 0 Ų | 0 | 73.9 Ų | 73.9 | 0% | 0 | 37% | 0.37 | C | S | . | . | trans | -65.6 | 132 | 176.4 | -176.9 | 0 | 0 | 0 | 0 | 111 | C94 C96 L122 C123 K124 Y125 F127 | C94-C120 HydrophobicContact CB-CB 3.76Å; C94-C120 VanDerWaalsContact SG-SG 3.65Å; C96-C120 VanDerWaalsContact SG-SG 3.65Å; C120-L122 PolarHBondContact O-N 2.85Å; C120-C123 VanDerWaalsContact CB-SG 3.55Å; C120-K124 WeakPolarHBondContact O-CA 3.43Å; C120-K124 PolarHBondContact O-N 3.47Å; C120-Y125 PolarHBondContact N-O 3.05Å; C120-F127 HydrophobicContact CB-CE1 3.95Å; C120-F127 HydrophobicContact CB-CZ 4.08Å | ||
| 121 | E | 89.1 | Confident | 83 | Confident | 90 Ų | 90 | 70.8 Ų | 70.8 | 42% | 0.421 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.5 | -28.3 | 179 | 71.5 | -155.6 | 146 | 0 | 0 | 113.5 | R78 W111 C119 K124 | R78-E121 IonicContact CZ-OE1 3.02Å; R78-E121 IonicContact NH1-OE1 3.78Å; R78-E121 PolarHBondContact NH1-OE1 3.34Å; R78-E121 IonicContact NH2-OE1 3.52Å; R78-E121 PolarHBondContact NH2-OE1 3.28Å; W111-E121 HydrophobicContact CH2-CB 4.45Å; W111-E121 HydrophobicContact CZ2-CB 4.26Å; W111-E121 HydrophobicContact CZ2-CG 4.49Å; W111-E121 WeakPolarHBondContact CZ2-OE2 3.35Å; C119-E121 PolarHBondContact O-N 2.81Å; E121-K124 PolarHBondContact O-NZ 2.82Å |
| 122 | L | 89.1 | Confident | 81.6 | Confident | 94 Ų | 94 | 74 Ų | 74 | 49% | 0.492 | 38% | 0.375 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.6 | -61.2 | -175.3 | -58.6 | 175 | 0 | 0 | 0 | 112.1 | L100 C120 | L100-L122 HydrophobicContact CB-CD1 4.47Å; L100-L122 HydrophobicContact CD1-CD1 3.92Å; C120-L122 PolarHBondContact O-N 2.85Å |
| 123 | C | 86.7 | Confident | 79.9 | Confident | 52 Ų | 52 | 76.7 Ų | 76.7 | 35% | 0.351 | 39% | 0.389 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.5 | 0.1 | -174.8 | 66.4 | 0 | 0 | 0 | 0 | 114 | C96 C120 Y125 | C96-C123 VanDerWaalsContact SG-SG 3.62Å; C120-C123 VanDerWaalsContact CB-SG 3.55Å; C123-Y125 PolarHBondContact O-N 3.28Å |
| 124 | K | 88.8 | Confident | 78.7 | Confident | 142 Ų | 142 | 73 Ų | 73 | 62% | 0.617 | 37% | 0.373 | S | S | * | . | trans | 57.6 | 7.7 | -179.3 | -53.9 | -52.7 | -172.2 | -163 | 0 | 116 | C120 E121 D126 | C120-K124 WeakPolarHBondContact O-CA 3.43Å; C120-K124 PolarHBondContact O-N 3.47Å; E121-K124 PolarHBondContact O-NZ 2.82Å; K124-D126 PolarHBondContact O-N 3.24Å | ||
| 125 | Y | 86.6 | Confident | 77.2 | Confident | 51 Ų | 51 | 73.1 Ų | 73.1 | 20% | 0.2 | 37% | 0.372 | C | S | . | . | P | Polyproline II helix | trans | -63.8 | 130.7 | 175 | -175.4 | -102.5 | 0 | 0 | 0 | 111.2 | C94 R95 C119 C120 C123 C238 | C94-Y125 HydrophobicContact CB-CD1 4.17Å; R95-Y125 HydrophobicContact CG-CD2 4.04Å; R95-Y125 HydrophobicContact CG-CE2 4.41Å; R95-Y125 HydrophobicContact CG-CG 4.17Å; R95-Y125 VanDerWaalsContact NE-CD2 3.31Å; C119-Y125 CarbonylContact C-O 3.14Å; C119-Y125 VanDerWaalsContact CA-O 3.31Å; C119-Y125 WeakPolarHBondContact CA-O 3.45Å; C120-Y125 PolarHBondContact N-O 3.05Å; C123-Y125 PolarHBondContact O-N 3.28Å; Y125-C238 HydrophobicContact CE1-CB 3.9Å |
| 126 | D | 84.4 | Confident | 75.7 | Confident | 113 Ų | 113 | 77.7 Ų | 77.7 | 60% | 0.604 | 39% | 0.392 | S | S | * | . | B | Isolated β-bridge | trans | -69.8 | 128.8 | 175.1 | -74.7 | -47.2 | 0 | 0 | 0 | 111 | C119 K124 I128 | C119-D126 WeakPolarHBondContact CB-OD1 3.46Å; K124-D126 PolarHBondContact O-N 3.24Å; D126-I128 PolarHBondContact O-N 3.24Å |
| 127 | F | 84.1 | Confident | 74.1 | Confident | 11 Ų | 11 | 83.8 Ų | 83.8 | 5% | 0.048 | 41% | 0.406 | C | S | . | . | P | Polyproline II helix | trans | -68.6 | 133.8 | 178.6 | -58.4 | -51.6 | 0 | 0 | 0 | 110.8 | P93 C94 L108 W111 I112 R118 C119 C120 M129 V235 | P93-F127 HydrophobicContact CB-CD1 3.81Å; P93-F127 HydrophobicContact CB-CE1 4Å; P93-F127 HydrophobicContact CG-CE1 4.22Å; P93-F127 WeakPolarHBondContact O-CD1 3.49Å; C94-F127 HydrophobicContact CB-CE1 4.18Å; L108-F127 HydrophobicContact CD1-CE1 4.45Å; L108-F127 HydrophobicContact CD1-CE2 4.46Å; L108-F127 HydrophobicContact CD1-CZ 4.13Å; W111-F127 AromaticContact CZ3-CE2 3.85Å; W111-F127 HydrophobicContact CZ3-CE2 3.85Å; W111-F127 HydrophobicContact CZ3-CZ 4.18Å; I112-F127 HydrophobicContact CD1-CD2 3.7Å; I112-F127 HydrophobicContact CD1-CE2 4.04Å; I112-F127 HydrophobicContact CD1-CG 4.45Å; I112-F127 HydrophobicContact CG1-CD2 4.17Å; I112-F127 HydrophobicContact CG1-CE2 4.07Å; R118-F127 VanDerWaalsContact C-CD2 3.44Å; R118-F127 VanDerWaalsContact O-CD2 3.22Å; R118-F127 WeakPolarHBondContact O-CD2 3.45Å; R118-F127 PolarHBondContact O-N 3.38Å; C119-F127 VanDerWaalsContact C-CE2 3.45Å; C119-F127 WeakPolarHBondContact O-CE2 3.22Å; C120-F127 HydrophobicContact CB-CE1 3.95Å; C120-F127 HydrophobicContact CB-CZ 4.08Å; F127-M129 HydrophobicContact CB-CE 4.17Å; F127-M129 HydrophobicContact CB-CG 4.41Å; F127-M129 PolarHBondContact O-N 2.89Å; F127-V235 HydrophobicContact CB-CG1 3.99Å |
| 128 | I | 80.5 | Confident | 72.5 | Confident | 54 Ų | 54 | 89.1 Ų | 89.1 | 28% | 0.277 | 43% | 0.425 | S | S | . | . | trans | -75.7 | 93.3 | 173.4 | -55.1 | 172.9 | 0 | 0 | 0 | 108.1 | D126 V235 Q236 | D126-I128 PolarHBondContact O-N 3.24Å; I128-V235 CarbonylContact O-C 3.56Å; I128-V235 WeakPolarHBondContact O-CA 3.29Å; I128-Q236 HydrophobicContact CB-CB 4.12Å; I128-Q236 HydrophobicContact CG2-CB 3.99Å; I128-Q236 PolarHBondContact O-N 2.89Å | ||
| 129 | M | 75.7 | Confident | 71.2 | Confident | 50 Ų | 50 | 84.7 Ų | 84.7 | 25% | 0.246 | 41% | 0.408 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.6 | 103 | 179.8 | -78.9 | 173.9 | -89.7 | 0 | 0 | 110.9 | R118 F127 I233 F234 V235 | R118-M129 HydrophobicContact CB-CE 3.54Å; R118-M129 HydrophobicContact CG-CE 3.61Å; R118-M129 HydrophobicContact CG-SD 4.47Å; F127-M129 HydrophobicContact CB-CE 4.17Å; F127-M129 HydrophobicContact CB-CG 4.41Å; F127-M129 PolarHBondContact O-N 2.89Å; M129-I233 HydrophobicContact CB-CG2 3.86Å; M129-I233 HydrophobicContact CG-CG2 3.75Å; M129-I233 HydrophobicContact SD-CG2 3.96Å; M129-F234 CarbonylContact C-O 3.55Å; M129-V235 HydrophobicContact CG-CG2 4.02Å |
| 130 | E | 64.7 | Low | 69.6 | Low | 63 Ų | 63 | 88.6 Ų | 88.6 | 29% | 0.294 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.2 | 139 | 166.5 | -75.6 | -165.1 | 155.3 | 0 | 0 | 110.4 | K132 F234 Q236 | E130-K132 WeakPolarHBondContact OE2-CE 3.47Å; E130-K132 IonicContact OE2-NZ 2.9Å; E130-K132 PolarHBondContact OE2-NZ 3.45Å; E130-F234 PolarHBondContact N-O 2.9Å; E130-F234 PolarHBondContact O-N 3.43Å; E130-Q236 VanDerWaalsContact CD-CD 3.42Å; E130-Q236 HydrophobicContact CG-CG 4.08Å; E130-Q236 PolarHBondContact OE1-NE2 2.9Å; E130-Q236 PolarHBondContact OE2-NE2 3.42Å |
| 131 | T | 61.4 | Low | 67.7 | Low | 53 Ų | 53 | 96.5 Ų | 96.5 | 33% | 0.325 | 46% | 0.457 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 111.8 | 170.9 | -48.3 | 0 | 0 | 0 | 0 | 110.3 | R231 | T131-R231 HydrophobicContact CG2-CB 4.47Å; T131-R231 HydrophobicContact CG2-CG 3.08Å; T131-R231 PolarHBondContact OG1-NH1 2.96Å; T131-R231 PolarHBondContact OG1-NH2 3.29Å |
| 132 | K | 57.5 | Low | 65.9 | Low | 116 Ų | 116 | 94 Ų | 94 | 50% | 0.504 | 45% | 0.446 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.7 | 137.7 | 172.8 | -66.3 | -171.9 | 175.8 | 158.6 | 0 | 109.6 | E130 V232 | E130-K132 WeakPolarHBondContact OE2-CE 3.47Å; E130-K132 IonicContact OE2-NZ 2.9Å; E130-K132 PolarHBondContact OE2-NZ 3.45Å; K132-V232 PolarHBondContact N-O 3.4Å; K132-V232 VanDerWaalsContact N-O 3.13Å; K132-V232 PolarHBondContact O-N 2.96Å; K132-V232 VanDerWaalsContact O-N 3.11Å |
| 133 | L | 50.8 | Low | 63.9 | Low | 78 Ų | 78 | 98.3 Ų | 98.3 | 41% | 0.408 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -66 | 139 | 168 | -62.1 | 169.6 | 0 | 0 | 0 | 106.8 | W139 K227 | L133-W139 HydrophobicContact CB-CZ2 4.39Å; L133-K227 HydrophobicContact CD2-CG 3.7Å |
| 134 | K | 57.7 | Low | 62.5 | Low | 73 Ų | 73 | 97.9 Ų | 97.9 | 32% | 0.317 | 46% | 0.457 | S | S | . | . | P | Polyproline II helix | trans | -49.1 | 144.7 | 170.2 | -71.6 | -175.7 | 175.9 | 179.6 | 0 | 108.6 | L136 W139 N230 V232 | K134-L136 PolarHBondContact O-N 2.98Å; K134-W139 PolarHBondContact O-NE1 2.99Å; K134-N230 PolarHBondContact N-O 3.46Å; K134-V232 HydrophobicContact CD-CG2 3.89Å; K134-V232 HydrophobicContact CG-CB 4.27Å; K134-V232 HydrophobicContact CG-CG2 3.37Å |
| 135 | P | 53.4 | Low | 61.6 | Low | 95 Ų | 95 | 94.5 Ų | 94.5 | 62% | 0.617 | 45% | 0.448 | S | S | * | . | P | Polyproline II helix | trans | -53.5 | 131.7 | 170.2 | -22.6 | 31.7 | 0 | 0 | 0 | 109.4 | R137 K138 W139 | P135-R137 PolarHBondContact O-N 2.79Å; P135-K138 PolarHBondContact O-N 2.78Å; P135-W139 VanDerWaalsContact O-CD1 3.28Å |
| 136 | L | 52.6 | Low | 60.9 | Low | 138 Ų | 138 | 97.5 Ų | 97.5 | 72% | 0.723 | 47% | 0.472 | S | S | * | . | G | 310 helix | trans | -50.3 | -22.9 | -173.4 | -66.7 | 172.6 | 0 | 0 | 0 | 113.9 | K134 W139 | K134-L136 PolarHBondContact O-N 2.98Å; L136-W139 VanDerWaalsContact CA-CD1 3.46Å; L136-W139 HydrophobicContact CD2-CD2 3.98Å; L136-W139 HydrophobicContact CD2-CE3 4.37Å; L136-W139 HydrophobicContact CD2-CH2 4.04Å; L136-W139 HydrophobicContact CD2-CZ2 3.6Å; L136-W139 HydrophobicContact CD2-CZ3 4.4Å |
| 137 | R | 49.4 | Very low | 60.7 | Low | 249 Ų | 249 | 94.2 Ų | 94.2 | 94% | 0.94 | 46% | 0.458 | S | S | * | . | G | 310 helix | trans | -74.1 | -23.7 | 179.4 | -60.5 | -176.5 | 179.8 | -179.4 | -0.3 | 114.8 | P135 | P135-R137 PolarHBondContact O-N 2.79Š|
| 138 | K | 50.9 | Low | 60.2 | Low | 165 Ų | 165 | 97.9 Ų | 97.9 | 72% | 0.717 | 48% | 0.475 | S | S | * | . | G | 310 helix | trans | -107.2 | 15.4 | 175.9 | -63.1 | -172.6 | -179.1 | -177.5 | 0 | 112.2 | P135 E140 | P135-K138 PolarHBondContact O-N 2.78Å; K138-E140 PolarHBondContact O-N 2.88Å; K138-E140 VanDerWaalsContact O-N 3.1Å |
| 139 | W | 57.2 | Low | 60 | Low | 51 Ų | 51 | 99.6 Ų | 99.6 | 19% | 0.193 | 48% | 0.478 | C | S | . | . | trans | -65.7 | 113.6 | 175.8 | -83.1 | 33.2 | 0 | 0 | 0 | 108.6 | L133 K134 P135 L136 K141 L226 N230 | L133-W139 HydrophobicContact CB-CZ2 4.39Å; K134-W139 PolarHBondContact O-NE1 2.99Å; P135-W139 VanDerWaalsContact O-CD1 3.28Å; L136-W139 VanDerWaalsContact CA-CD1 3.46Å; L136-W139 HydrophobicContact CD2-CD2 3.98Å; L136-W139 HydrophobicContact CD2-CE3 4.37Å; L136-W139 HydrophobicContact CD2-CH2 4.04Å; L136-W139 HydrophobicContact CD2-CZ2 3.6Å; L136-W139 HydrophobicContact CD2-CZ3 4.4Å; W139-K141 PolarHBondContact O-N 3.11Å; W139-L226 HydrophobicContact CE3-CD2 4.21Å; W139-L226 HydrophobicContact CE3-CG 4.24Å; W139-L226 HydrophobicContact CZ3-CD2 4.05Å; W139-L226 HydrophobicContact CZ3-CG 3.95Å; W139-N230 HydrophobicContact CD2-CB 4.22Å; W139-N230 VanDerWaalsContact CD2-ND2 3.32Å; W139-N230 HydrophobicContact CZ2-CB 4.29Å | ||
| 140 | E | 52.3 | Low | 60.3 | Low | 122 Ų | 122 | 104.7 Ų | 104.7 | 57% | 0.57 | 50% | 0.495 | S | S | * | . | trans | -58 | 125 | 165.2 | -101.2 | 170.7 | 121.6 | 0 | 0 | 107.7 | K138 L142 | K138-E140 PolarHBondContact O-N 2.88Å; K138-E140 VanDerWaalsContact O-N 3.1Å; E140-L142 PolarHBondContact O-N 3.13Å | ||
| 141 | K | 49.8 | Very low | 61.1 | Low | 167 Ų | 167 | 108.8 Ų | 108.8 | 73% | 0.726 | 51% | 0.511 | S | S | * | . | trans | -56.8 | 113.7 | 171.9 | -120.1 | 177.1 | 179 | 171.3 | 0 | 105.8 | W139 Q143 | W139-K141 PolarHBondContact O-N 3.11Å; K141-Q143 PolarHBondContact O-N 3.31Å; K141-Q143 VanDerWaalsContact O-N 3.09Å | ||
| 142 | L | 51.3 | Low | 62.1 | Low | 36 Ų | 36 | 109 Ų | 109 | 19% | 0.188 | 51% | 0.51 | C | S | . | . | trans | -48.1 | 125 | 169.4 | -159.4 | 60.9 | 0 | 0 | 0 | 107.4 | E140 M144 R149 L226 Y229 | E140-L142 PolarHBondContact O-N 3.13Å; L142-M144 HydrophobicContact CB-CG 4.43Å; L142-M144 HydrophobicContact CD2-CE 3.26Å; L142-M144 HydrophobicContact CD2-CG 4.25Å; L142-M144 HydrophobicContact CG-CE 4.06Å; L142-M144 HydrophobicContact CG-CG 4.46Å; L142-M144 PolarHBondContact O-N 3.04Å; L142-R149 PolarHBondContact O-NH2 3.44Å; L142-L226 HydrophobicContact CB-CD1 3.63Å; L142-L226 HydrophobicContact CD1-CD1 3.92Å; L142-L226 HydrophobicContact CD2-CB 4.03Å; L142-L226 HydrophobicContact CD2-CD1 4.02Å; L142-L226 HydrophobicContact CD2-CG 4.48Å; L142-L226 HydrophobicContact CG-CD1 4.04Å; L142-Y229 HydrophobicContact CD1-CD1 4.31Å; L142-Y229 HydrophobicContact CD1-CG 4.33Å | ||
| 143 | Q | 46.4 | Very low | 63.3 | Low | 186 Ų | 186 | 107.7 Ų | 107.7 | 87% | 0.869 | 51% | 0.512 | S | S | * | . | trans | -63.9 | 73.4 | 170 | -78.7 | -79.2 | -6.1 | 0 | 0 | 108.2 | K141 | K141-Q143 PolarHBondContact O-N 3.31Å; K141-Q143 VanDerWaalsContact O-N 3.09Å | ||
| 144 | M | 57.8 | Low | 65 | Low | 42 Ų | 42 | 107.5 Ų | 107.5 | 21% | 0.207 | 52% | 0.516 | C | S | . | . | trans | -77.3 | 128.5 | 162.6 | -78 | -74 | 139 | 0 | 0 | 105.6 | L142 T146 R149 L222 | L142-M144 HydrophobicContact CB-CG 4.43Å; L142-M144 HydrophobicContact CD2-CE 3.26Å; L142-M144 HydrophobicContact CD2-CG 4.25Å; L142-M144 HydrophobicContact CG-CE 4.06Å; L142-M144 HydrophobicContact CG-CG 4.46Å; L142-M144 PolarHBondContact O-N 3.04Å; M144-T146 PolarHBondContact O-N 2.92Å; M144-R149 HydrophobicContact CB-CG 3.8Å; M144-L222 HydrophobicContact CE-CD2 3.96Å; M144-L222 HydrophobicContact CE-CG 3.9Å; M144-L222 HydrophobicContact SD-CD2 3.5Å; M144-L222 WeakPolarHBondContact SD-CD2 3.38Å; M144-L222 HydrophobicContact SD-CG 4.12Å | ||
| 145 | T | 68.9 | Low | 66.3 | Low | 71 Ų | 71 | 105.1 Ų | 105.1 | 44% | 0.436 | 51% | 0.509 | S | S | . | . | trans | -56.8 | 141.9 | -179.6 | 59.1 | 0 | 0 | 0 | 0 | 109.2 | S147 E148 R149 | T145-S147 PolarHBondContact O-N 3.48Å; T145-S147 VanDerWaalsContact O-N 3.08Å; T145-S147 PolarHBondContact OG1-OG 2.75Å; T145-E148 PolarHBondContact N-OE2 3.45Å; T145-E148 PolarHBondContact O-N 3.43Å; T145-E148 WeakPolarHBondContact OG1-CG 3.45Å; T145-E148 PolarHBondContact OG1-OE2 3.4Å; T145-R149 PolarHBondContact O-N 2.89Å; T145-R149 VanDerWaalsContact O-N 3.14Å | ||
| 146 | T | 73.1 | Confident | 67.8 | Low | 114 Ų | 114 | 104.6 Ų | 104.6 | 70% | 0.699 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -56.6 | -28.2 | -177.5 | 47.1 | 0 | 0 | 0 | 0 | 112.2 | M144 R150 | M144-T146 PolarHBondContact O-N 2.92Å; T146-R150 VanDerWaalsContact O-CB 3.29Å; T146-R150 WeakPolarHBondContact O-CB 3.07Å; T146-R150 PolarHBondContact O-N 2.69Å |
| 147 | S | 78.3 | Confident | 69.5 | Low | 44 Ų | 44 | 101.3 Ų | 101.3 | 31% | 0.308 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -69.2 | -44.3 | 174.7 | 55.5 | 0 | 0 | 0 | 0 | 113.1 | T145 R150 K151 | T145-S147 PolarHBondContact O-N 3.48Å; T145-S147 VanDerWaalsContact O-N 3.08Å; T145-S147 PolarHBondContact OG1-OG 2.75Å; S147-R150 PolarHBondContact O-N 3.28Å; S147-K151 VanDerWaalsContact O-CG 3.27Å; S147-K151 WeakPolarHBondContact O-CG 3.18Å; S147-K151 PolarHBondContact O-N 2.96Å |
| 148 | E | 74.8 | Confident | 71.4 | Confident | 88 Ų | 88 | 95.9 Ų | 95.9 | 41% | 0.411 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.2 | -43.9 | 176.1 | -72.9 | 168.1 | 140.6 | 0 | 0 | 111.4 | T145 R150 K151 I152 | T145-E148 PolarHBondContact N-OE2 3.45Å; T145-E148 PolarHBondContact O-N 3.43Å; T145-E148 WeakPolarHBondContact OG1-CG 3.45Å; T145-E148 PolarHBondContact OG1-OE2 3.4Å; E148-R150 PolarHBondContact O-N 3.17Å; E148-K151 PolarHBondContact O-N 2.93Å; E148-I152 VanDerWaalsContact O-CG1 3.3Å; E148-I152 WeakPolarHBondContact O-CG1 3.3Å; E148-I152 PolarHBondContact O-N 2.85Å; E148-I152 VanDerWaalsContact O-N 3.07Å |
| 149 | R | 75.8 | Confident | 73.1 | Confident | 91 Ų | 91 | 89.3 Ų | 89.3 | 34% | 0.343 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.5 | -44.6 | 175.4 | -71.7 | -171.8 | 174.6 | 170.9 | 7.8 | 112 | L142 M144 T145 K151 I152 V153 | L142-R149 PolarHBondContact O-NH2 3.44Å; M144-R149 HydrophobicContact CB-CG 3.8Å; T145-R149 PolarHBondContact O-N 2.89Å; T145-R149 VanDerWaalsContact O-N 3.14Å; R149-K151 PolarHBondContact O-N 2.97Å; R149-I152 PolarHBondContact O-N 3.3Å; R149-V153 VanDerWaalsContact O-CG2 3.31Å; R149-V153 WeakPolarHBondContact O-CG2 3.3Å; R149-V153 PolarHBondContact O-N 3.27Å |
| 150 | R | 82.8 | Confident | 74.5 | Confident | 156 Ų | 156 | 90.9 Ų | 90.9 | 59% | 0.589 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -62.6 | -41.5 | 178.5 | -176.8 | 169 | 61.3 | -117.9 | 3.3 | 111.9 | T146 S147 E148 I152 V153 C154 | T146-R150 VanDerWaalsContact O-CB 3.29Å; T146-R150 WeakPolarHBondContact O-CB 3.07Å; T146-R150 PolarHBondContact O-N 2.69Å; S147-R150 PolarHBondContact O-N 3.28Å; E148-R150 PolarHBondContact O-N 3.17Å; R150-I152 VanDerWaalsContact C-N 3.34Å; R150-I152 PolarHBondContact O-N 3.1Å; R150-V153 PolarHBondContact O-N 2.86Å; R150-C154 WeakPolarHBondContact O-CB 3.48Å; R150-C154 PolarHBondContact O-N 3.15Å |
| 151 | K | 81 | Confident | 76.4 | Confident | 149 Ų | 149 | 90.1 Ų | 90.1 | 65% | 0.648 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -59.4 | -44.3 | 175.2 | -73.5 | 171.3 | -178.1 | -179.1 | 0 | 111.6 | S147 E148 R149 S155 | S147-K151 VanDerWaalsContact O-CG 3.27Å; S147-K151 WeakPolarHBondContact O-CG 3.18Å; S147-K151 PolarHBondContact O-N 2.96Å; E148-K151 PolarHBondContact O-N 2.93Å; R149-K151 PolarHBondContact O-N 2.97Å; K151-S155 VanDerWaalsContact O-CB 3.23Å; K151-S155 WeakPolarHBondContact O-CB 3.2Å; K151-S155 PolarHBondContact O-N 3.38Å |
| 152 | I | 82.8 | Confident | 78.1 | Confident | 57 Ų | 57 | 84 Ų | 84 | 29% | 0.292 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -66.5 | -46.8 | 178.5 | -64.3 | 164.6 | 0 | 0 | 0 | 110.6 | E148 R149 R150 S155 V156 L222 | E148-I152 VanDerWaalsContact O-CG1 3.3Å; E148-I152 WeakPolarHBondContact O-CG1 3.3Å; E148-I152 PolarHBondContact O-N 2.85Å; E148-I152 VanDerWaalsContact O-N 3.07Å; R149-I152 PolarHBondContact O-N 3.3Å; R150-I152 VanDerWaalsContact C-N 3.34Å; R150-I152 PolarHBondContact O-N 3.1Å; I152-S155 PolarHBondContact O-N 2.86Å; I152-V156 HydrophobicContact CG2-CG2 4.25Å; I152-V156 WeakPolarHBondContact O-CB 3.25Å; I152-V156 VanDerWaalsContact O-CG2 3.3Å; I152-V156 WeakPolarHBondContact O-CG2 3.3Å; I152-V156 PolarHBondContact O-N 3.19Å; I152-L222 HydrophobicContact CD1-CD2 4.13Å |
| 153 | V | 83.2 | Confident | 79.9 | Confident | 89 Ų | 89 | 86.7 Ų | 86.7 | 54% | 0.539 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61.2 | -50.8 | 179.6 | 172.3 | 0 | 0 | 0 | 0 | 110.6 | R149 R150 S155 V156 T157 | R149-V153 VanDerWaalsContact O-CG2 3.31Å; R149-V153 WeakPolarHBondContact O-CG2 3.3Å; R149-V153 PolarHBondContact O-N 3.27Å; R150-V153 PolarHBondContact O-N 2.86Å; V153-S155 VanDerWaalsContact C-N 3.27Å; V153-S155 PolarHBondContact O-N 3.4Å; V153-V156 PolarHBondContact O-N 3.09Å; V153-T157 HydrophobicContact CG1-CG2 4.26Å; V153-T157 WeakPolarHBondContact O-CG2 3.48Å; V153-T157 PolarHBondContact O-N 3.42Å; V153-T157 PolarHBondContact O-OG1 3.3Å |
| 154 | C | 85.8 | Confident | 82.1 | Confident | 74 Ų | 74 | 81.7 Ų | 81.7 | 50% | 0.5 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -55.8 | -42.4 | 175.3 | -85.4 | 0 | 0 | 0 | 0 | 112.3 | R150 T157 F158 | R150-C154 WeakPolarHBondContact O-CB 3.48Å; R150-C154 PolarHBondContact O-N 3.15Å; C154-T157 WeakPolarHBondContact CA-OG1 3.38Å; C154-T157 PolarHBondContact O-OG1 2.97Å; C154-F158 VanDerWaalsContact O-CB 3.26Å; C154-F158 WeakPolarHBondContact O-CB 3.3Å; C154-F158 PolarHBondContact O-N 3.41Å |
| 155 | S | 84.4 | Confident | 83.6 | Confident | 24 Ų | 24 | 83 Ų | 83 | 17% | 0.168 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -64.7 | -47.6 | 178.6 | -174.7 | 0 | 0 | 0 | 0 | 111.4 | K151 I152 V153 F158 H159 | K151-S155 VanDerWaalsContact O-CB 3.23Å; K151-S155 WeakPolarHBondContact O-CB 3.2Å; K151-S155 PolarHBondContact O-N 3.38Å; I152-S155 PolarHBondContact O-N 2.86Å; V153-S155 VanDerWaalsContact C-N 3.27Å; V153-S155 PolarHBondContact O-N 3.4Å; S155-F158 PolarHBondContact O-N 3.45Å; S155-H159 PolarHBondContact O-N 2.75Å; S155-H159 VanDerWaalsContact O-N 3.09Å; S155-H159 PolarHBondContact O-ND1 2.88Å |
| 156 | V | 85.1 | Confident | 84.4 | Confident | 83 Ų | 83 | 81.8 Ų | 81.8 | 50% | 0.503 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -63.2 | -45.4 | 178.6 | 171.9 | 0 | 0 | 0 | 0 | 111.1 | I152 V153 F158 H159 V160 | I152-V156 HydrophobicContact CG2-CG2 4.25Å; I152-V156 WeakPolarHBondContact O-CB 3.25Å; I152-V156 VanDerWaalsContact O-CG2 3.3Å; I152-V156 WeakPolarHBondContact O-CG2 3.3Å; I152-V156 PolarHBondContact O-N 3.19Å; V153-V156 PolarHBondContact O-N 3.09Å; V156-F158 VanDerWaalsContact C-N 3.32Å; V156-F158 PolarHBondContact O-N 2.98Å; V156-H159 PolarHBondContact O-N 3.18Å; V156-H159 VanDerWaalsContact O-N 3.16Å; V156-V160 WeakPolarHBondContact O-CG2 3.43Å; V156-V160 PolarHBondContact O-N 2.75Å |
| 157 | T | 88.5 | Confident | 85.1 | Confident | 69 Ų | 69 | 80.5 Ų | 80.5 | 42% | 0.423 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -62.2 | -41 | 178.3 | 53.3 | 0 | 0 | 0 | 0 | 111.5 | V153 C154 H159 V160 I161 | V153-T157 HydrophobicContact CG1-CG2 4.26Å; V153-T157 WeakPolarHBondContact O-CG2 3.48Å; V153-T157 PolarHBondContact O-N 3.42Å; V153-T157 PolarHBondContact O-OG1 3.3Å; C154-T157 WeakPolarHBondContact CA-OG1 3.38Å; C154-T157 PolarHBondContact O-OG1 2.97Å; T157-H159 VanDerWaalsContact C-N 3.3Å; T157-H159 PolarHBondContact O-N 2.98Å; T157-V160 PolarHBondContact O-N 2.82Å; T157-I161 WeakPolarHBondContact O-CD1 3.5Å; T157-I161 VanDerWaalsContact O-CG1 3.27Å; T157-I161 WeakPolarHBondContact O-CG1 3.41Å; T157-I161 PolarHBondContact O-N 3.36Å |
| 158 | F | 89.1 | Confident | 85.8 | Confident | 136 Ų | 136 | 87 Ų | 87 | 60% | 0.596 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -59.6 | -41.2 | 175.4 | 176.3 | -97.5 | 0 | 0 | 0 | 111.9 | C154 S155 V156 I161 A162 | C154-F158 VanDerWaalsContact O-CB 3.26Å; C154-F158 WeakPolarHBondContact O-CB 3.3Å; C154-F158 PolarHBondContact O-N 3.41Å; S155-F158 PolarHBondContact O-N 3.45Å; V156-F158 VanDerWaalsContact C-N 3.32Å; V156-F158 PolarHBondContact O-N 2.98Å; F158-I161 PolarHBondContact O-N 3.16Å; F158-A162 WeakPolarHBondContact O-CB 3.34Å; F158-A162 PolarHBondContact O-N 3.4Å |
| 159 | H | 86.6 | Confident | 86.4 | Confident | 27 Ų | 27 | 85.8 Ų | 85.8 | 13% | 0.125 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -67.9 | -41.5 | 178.2 | -76.8 | 68.5 | 0 | 0 | 0 | 112.6 | S155 V156 T157 I161 A162 I163 F211 | S155-H159 PolarHBondContact O-N 2.75Å; S155-H159 VanDerWaalsContact O-N 3.09Å; S155-H159 PolarHBondContact O-ND1 2.88Å; V156-H159 PolarHBondContact O-N 3.18Å; V156-H159 VanDerWaalsContact O-N 3.16Å; T157-H159 VanDerWaalsContact C-N 3.3Å; T157-H159 PolarHBondContact O-N 2.98Å; H159-I161 VanDerWaalsContact C-N 3.29Å; H159-I161 PolarHBondContact O-N 3.35Å; H159-A162 PolarHBondContact O-N 3.18Å; H159-I163 WeakPolarHBondContact O-CB 3.31Å; H159-I163 VanDerWaalsContact O-CG1 3.23Å; H159-I163 WeakPolarHBondContact O-CG1 3.29Å; H159-I163 PolarHBondContact O-N 2.68Å; H159-F211 AromaticContact CE1-CD1 3.06Å; H159-F211 WeakPolarHBondContact CE1-CD1 3.26Å; H159-F211 AromaticContact CE1-CE1 3.01Å; H159-F211 WeakPolarHBondContact CE1-CE1 3.44Å; H159-F211 AromaticContact CE1-CZ 3.97Å; H159-F211 AromaticContact ND1-CE1 3.98Å; H159-F211 AromaticContact NE2-CD1 2.93Å; H159-F211 WeakPolarHBondContact NE2-CD1 3.44Å; H159-F211 AromaticContact NE2-CE1 3.47Å; H159-F211 WeakPolarHBondContact NE2-CE1 3.42Å; H159-F211 AromaticContact NE2-CG 3.65Å |
| 160 | V | 87.6 | Confident | 86.8 | Confident | 84 Ų | 84 | 84.2 Ų | 84.2 | 51% | 0.509 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -59.9 | -44 | 176.1 | 172 | 0 | 0 | 0 | 0 | 110.4 | V156 T157 T164 | V156-V160 WeakPolarHBondContact O-CG2 3.43Å; V156-V160 PolarHBondContact O-N 2.75Å; T157-V160 PolarHBondContact O-N 2.82Å; V160-T164 WeakPolarHBondContact O-CB 3.16Å; V160-T164 PolarHBondContact O-N 3.02Å; V160-T164 PolarHBondContact O-OG1 3.48Å |
| 161 | I | 91.8 | Very high | 87.2 | Confident | 106 Ų | 106 | 84 Ų | 84 | 54% | 0.544 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.7 | -48.7 | 176.8 | -65 | 163.8 | 0 | 0 | 0 | 110.4 | T157 F158 H159 I163 T164 C165 | T157-I161 WeakPolarHBondContact O-CD1 3.5Å; T157-I161 VanDerWaalsContact O-CG1 3.27Å; T157-I161 WeakPolarHBondContact O-CG1 3.41Å; T157-I161 PolarHBondContact O-N 3.36Å; F158-I161 PolarHBondContact O-N 3.16Å; H159-I161 VanDerWaalsContact C-N 3.29Å; H159-I161 PolarHBondContact O-N 3.35Å; I161-I163 PolarHBondContact O-N 3.37Å; I161-T164 WeakPolarHBondContact O-CB 3.24Å; I161-T164 PolarHBondContact O-N 3.34Å; I161-T164 VanDerWaalsContact O-N 3.16Å; I161-C165 PolarHBondContact O-N 3.4Å; I161-C165 PolarHBondContact O-SG 3.27Å |
| 162 | A | 86.3 | Confident | 87.6 | Confident | 39 Ų | 39 | 79.5 Ų | 79.5 | 32% | 0.322 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -58.7 | -45.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | F158 H159 T164 C165 V166 | F158-A162 WeakPolarHBondContact O-CB 3.34Å; F158-A162 PolarHBondContact O-N 3.4Å; H159-A162 PolarHBondContact O-N 3.18Å; A162-T164 VanDerWaalsContact C-N 3.34Å; A162-T164 PolarHBondContact O-N 3.42Å; A162-C165 PolarHBondContact O-N 3.03Å; A162-V166 WeakPolarHBondContact O-CG2 3.46Å; A162-V166 PolarHBondContact O-N 3.48Å |
| 163 | I | 87.1 | Confident | 87.6 | Confident | 92 Ų | 92 | 79.2 Ų | 79.2 | 47% | 0.472 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.1 | -45.2 | 175.7 | -68.3 | 165.2 | 0 | 0 | 0 | 110.3 | H159 I161 C165 V166 V167 | H159-I163 WeakPolarHBondContact O-CB 3.31Å; H159-I163 VanDerWaalsContact O-CG1 3.23Å; H159-I163 WeakPolarHBondContact O-CG1 3.29Å; H159-I163 PolarHBondContact O-N 2.68Å; I161-I163 PolarHBondContact O-N 3.37Å; I163-C165 VanDerWaalsContact C-N 3.33Å; I163-C165 PolarHBondContact O-N 2.89Å; I163-V166 PolarHBondContact O-N 3.14Å; I163-V167 HydrophobicContact CG2-CG2 4.29Å; I163-V167 VanDerWaalsContact O-CG2 3.31Å; I163-V167 WeakPolarHBondContact O-CG2 3.25Å; I163-V167 PolarHBondContact O-N 3.04Å |
| 164 | T | 92.6 | Very high | 87.7 | Confident | 80 Ų | 80 | 80.3 Ų | 80.3 | 49% | 0.491 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -59.9 | -44.3 | 178 | -55.3 | 0 | 0 | 0 | 0 | 111.3 | V160 I161 A162 V166 V167 W168 | V160-T164 WeakPolarHBondContact O-CB 3.16Å; V160-T164 PolarHBondContact O-N 3.02Å; V160-T164 PolarHBondContact O-OG1 3.48Å; I161-T164 WeakPolarHBondContact O-CB 3.24Å; I161-T164 PolarHBondContact O-N 3.34Å; I161-T164 VanDerWaalsContact O-N 3.16Å; A162-T164 VanDerWaalsContact C-N 3.34Å; A162-T164 PolarHBondContact O-N 3.42Å; T164-V166 PolarHBondContact O-N 2.81Å; T164-V167 PolarHBondContact O-N 2.86Å; T164-W168 WeakPolarHBondContact O-CB 3.47Å; T164-W168 PolarHBondContact O-N 3.27Å |
| 165 | C | 90.1 | Very high | 87.7 | Confident | 70 Ų | 70 | 80 Ų | 80 | 47% | 0.473 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -62.3 | -41.1 | 176.3 | -68 | 0 | 0 | 0 | 0 | 112.4 | I161 A162 I163 S169 | I161-C165 PolarHBondContact O-N 3.4Å; I161-C165 PolarHBondContact O-SG 3.27Å; A162-C165 PolarHBondContact O-N 3.03Å; I163-C165 VanDerWaalsContact C-N 3.33Å; I163-C165 PolarHBondContact O-N 2.89Å; C165-S169 WeakPolarHBondContact O-CB 3.39Å; C165-S169 PolarHBondContact O-N 3.08Å; C165-S169 PolarHBondContact O-OG 3.46Å |
| 166 | V | 86.6 | Confident | 87.6 | Confident | 46 Ų | 46 | 86.4 Ų | 86.4 | 28% | 0.279 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -65.1 | -46.8 | 177.1 | 171.2 | 0 | 0 | 0 | 0 | 110.8 | A162 I163 T164 S169 L170 V201 | A162-V166 WeakPolarHBondContact O-CG2 3.46Å; A162-V166 PolarHBondContact O-N 3.48Å; I163-V166 PolarHBondContact O-N 3.14Å; T164-V166 PolarHBondContact O-N 2.81Å; V166-S169 PolarHBondContact O-N 3.24Å; V166-L170 HydrophobicContact CG1-CD1 4.31Å; V166-L170 WeakPolarHBondContact O-CB 3.31Å; V166-L170 WeakPolarHBondContact O-CG 3.23Å; V166-L170 PolarHBondContact O-N 2.78Å; V166-V201 HydrophobicContact CG1-CG1 3.9Å |
| 167 | V | 87.8 | Confident | 87.2 | Confident | 86 Ų | 86 | 84.4 Ų | 84.4 | 52% | 0.521 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.5 | -43.9 | 178.3 | 173 | 0 | 0 | 0 | 0 | 111 | I163 T164 L170 Y171 | I163-V167 HydrophobicContact CG2-CG2 4.29Å; I163-V167 VanDerWaalsContact O-CG2 3.31Å; I163-V167 WeakPolarHBondContact O-CG2 3.25Å; I163-V167 PolarHBondContact O-N 3.04Å; T164-V167 PolarHBondContact O-N 2.86Å; V167-L170 PolarHBondContact O-N 3.44Å; V167-Y171 WeakPolarHBondContact O-CB 3.47Å; V167-Y171 PolarHBondContact O-N 3.47Å |
| 168 | W | 92.6 | Very high | 87 | Confident | 180 Ų | 180 | 83.6 Ų | 83.6 | 68% | 0.682 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -62.3 | -45 | 176.6 | -172 | -78.6 | 0 | 0 | 0 | 112.1 | T164 L170 Y171 V172 | T164-W168 WeakPolarHBondContact O-CB 3.47Å; T164-W168 PolarHBondContact O-N 3.27Å; W168-L170 VanDerWaalsContact C-N 3.34Å; W168-L170 PolarHBondContact O-N 3.48Å; W168-Y171 WeakPolarHBondContact O-CB 3.23Å; W168-Y171 PolarHBondContact O-N 3.2Å; W168-V172 WeakPolarHBondContact O-CG2 3.32Å; W168-V172 PolarHBondContact O-N 2.96Å |
| 169 | S | 86.4 | Confident | 86.7 | Confident | 64 Ų | 64 | 81.2 Ų | 81.2 | 45% | 0.448 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62.4 | -43.3 | 177.8 | -57.7 | 0 | 0 | 0 | 0 | 111.2 | C165 V166 V172 L173 | C165-S169 WeakPolarHBondContact O-CB 3.39Å; C165-S169 PolarHBondContact O-N 3.08Å; C165-S169 PolarHBondContact O-OG 3.46Å; V166-S169 PolarHBondContact O-N 3.24Å; S169-V172 PolarHBondContact O-N 3.19Å; S169-L173 VanDerWaalsContact O-CG 3.24Å; S169-L173 WeakPolarHBondContact O-CG 3.46Å; S169-L173 PolarHBondContact O-N 3.46Å |
| 170 | L | 85.6 | Confident | 86.1 | Confident | 58 Ų | 58 | 84.5 Ų | 84.5 | 30% | 0.304 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -60.4 | -45.3 | 173.5 | -82.2 | 176.9 | 0 | 0 | 0 | 112.3 | V166 V167 W168 V172 L173 I174 V201 | V166-L170 HydrophobicContact CG1-CD1 4.31Å; V166-L170 WeakPolarHBondContact O-CB 3.31Å; V166-L170 WeakPolarHBondContact O-CG 3.23Å; V166-L170 PolarHBondContact O-N 2.78Å; V167-L170 PolarHBondContact O-N 3.44Å; W168-L170 VanDerWaalsContact C-N 3.34Å; W168-L170 PolarHBondContact O-N 3.48Å; L170-V172 PolarHBondContact O-N 2.89Å; L170-L173 PolarHBondContact O-N 3.31Å; L170-I174 VanDerWaalsContact O-CG1 3.28Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 3.27Å; L170-V201 HydrophobicContact CD1-CG1 3.82Å; L170-V201 HydrophobicContact CD2-CB 4.24Å; L170-V201 HydrophobicContact CD2-CG1 3.88Å; L170-V201 HydrophobicContact CD2-CG2 3.8Å; L170-V201 HydrophobicContact CG-CG1 3.93Å; L170-V201 HydrophobicContact CG-CG2 4.17Å |
| 171 | Y | 90.4 | Very high | 85.5 | Confident | 150 Ų | 150 | 86.7 Ų | 86.7 | 59% | 0.588 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -57.2 | -49.8 | 177.9 | 174.6 | -93.4 | 0 | 0 | 0 | 111.2 | V167 W168 L173 I174 D175 | V167-Y171 WeakPolarHBondContact O-CB 3.47Å; V167-Y171 PolarHBondContact O-N 3.47Å; W168-Y171 WeakPolarHBondContact O-CB 3.23Å; W168-Y171 PolarHBondContact O-N 3.2Å; Y171-L173 VanDerWaalsContact C-N 3.27Å; Y171-L173 PolarHBondContact O-N 3.43Å; Y171-I174 PolarHBondContact O-N 3.25Å; Y171-D175 WeakPolarHBondContact O-CB 3.48Å; Y171-D175 PolarHBondContact O-N 2.94Å |
| 172 | V | 88.7 | Confident | 84.8 | Confident | 56 Ų | 56 | 89.5 Ų | 89.5 | 34% | 0.339 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -61.6 | -36.2 | 177.7 | 172.9 | 0 | 0 | 0 | 0 | 111.7 | W168 S169 L170 R176 | W168-V172 WeakPolarHBondContact O-CG2 3.32Å; W168-V172 PolarHBondContact O-N 2.96Å; S169-V172 PolarHBondContact O-N 3.19Å; L170-V172 PolarHBondContact O-N 2.89Å; V172-R176 VanDerWaalsContact O-CG 3.31Å; V172-R176 WeakPolarHBondContact O-CG 3.42Å; V172-R176 PolarHBondContact O-N 2.7Å; V172-R176 VanDerWaalsContact O-N 3.14Å |
| 173 | L | 83 | Confident | 84.3 | Confident | 50 Ų | 50 | 95.2 Ų | 95.2 | 26% | 0.262 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -68 | -45.5 | 176.6 | -72.8 | 174.8 | 0 | 0 | 0 | 112.1 | S169 L170 Y171 D175 R176 T177 K197 | S169-L173 VanDerWaalsContact O-CG 3.24Å; S169-L173 WeakPolarHBondContact O-CG 3.46Å; S169-L173 PolarHBondContact O-N 3.46Å; L170-L173 PolarHBondContact O-N 3.31Å; Y171-L173 VanDerWaalsContact C-N 3.27Å; Y171-L173 PolarHBondContact O-N 3.43Å; L173-D175 VanDerWaalsContact C-N 3.34Å; L173-R176 PolarHBondContact O-N 2.88Å; L173-T177 WeakPolarHBondContact O-CB 3.38Å; L173-T177 PolarHBondContact O-N 3.4Å; L173-T177 PolarHBondContact O-OG1 3.48Å; L173-T177 VanDerWaalsContact O-OG1 3.07Å; L173-K197 HydrophobicContact CD1-CB 4.18Å; L173-K197 HydrophobicContact CD1-CD 4.07Å; L173-K197 HydrophobicContact CD1-CG 4.49Å; L173-K197 HydrophobicContact CD2-CD 3.64Å; L173-K197 HydrophobicContact CG-CD 4.49Å |
| 174 | I | 84.9 | Confident | 83.2 | Confident | 113 Ų | 113 | 93.3 Ų | 93.3 | 58% | 0.579 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -63.2 | -43.3 | 178.6 | -66.9 | 163.7 | 0 | 0 | 0 | 110.3 | L170 Y171 R176 T177 A178 | L170-I174 VanDerWaalsContact O-CG1 3.28Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 3.27Å; Y171-I174 PolarHBondContact O-N 3.25Å; I174-R176 PolarHBondContact O-N 3.48Å; I174-T177 PolarHBondContact O-N 2.75Å; I174-A178 WeakPolarHBondContact O-CB 3.43Å; I174-A178 PolarHBondContact O-N 2.88Å |
| 175 | D | 86.4 | Confident | 81.7 | Confident | 68 Ų | 68 | 94 Ų | 94 | 36% | 0.364 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -57.6 | -47.4 | 176.8 | -175.3 | 75.2 | 0 | 0 | 0 | 111.4 | Y171 L173 A178 E179 | Y171-D175 WeakPolarHBondContact O-CB 3.48Å; Y171-D175 PolarHBondContact O-N 2.94Å; L173-D175 VanDerWaalsContact C-N 3.34Å; D175-A178 PolarHBondContact O-N 3.49Å; D175-E179 PolarHBondContact O-N 2.95Å |
| 176 | R | 82.4 | Confident | 80.2 | Confident | 158 Ų | 158 | 98 Ų | 98 | 60% | 0.596 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.6 | -40.7 | 176.6 | -68.3 | -67.3 | 164.4 | 91 | 0.8 | 113.2 | V172 L173 I174 A178 E179 E180 | V172-R176 VanDerWaalsContact O-CG 3.31Å; V172-R176 WeakPolarHBondContact O-CG 3.42Å; V172-R176 PolarHBondContact O-N 2.7Å; V172-R176 VanDerWaalsContact O-N 3.14Å; L173-R176 PolarHBondContact O-N 2.88Å; I174-R176 PolarHBondContact O-N 3.48Å; R176-A178 VanDerWaalsContact C-N 3.33Å; R176-E179 PolarHBondContact O-N 2.87Å; R176-E180 WeakPolarHBondContact O-CG 3.3Å; R176-E180 PolarHBondContact O-N 3.3Å |
| 177 | T | 77.4 | Confident | 78.7 | Confident | 41 Ų | 41 | 100 Ų | 100 | 25% | 0.252 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.3 | -37.6 | 175.4 | -62.5 | 0 | 0 | 0 | 0 | 111.7 | L173 I174 E180 I181 | L173-T177 WeakPolarHBondContact O-CB 3.38Å; L173-T177 PolarHBondContact O-N 3.4Å; L173-T177 PolarHBondContact O-OG1 3.48Å; L173-T177 VanDerWaalsContact O-OG1 3.07Å; I174-T177 PolarHBondContact O-N 2.75Å; T177-E180 PolarHBondContact O-N 3.44Å; T177-I181 HydrophobicContact CG2-CD1 3.86Å; T177-I181 HydrophobicContact CG2-CG1 4.42Å; T177-I181 VanDerWaalsContact O-CG1 3.25Å; T177-I181 WeakPolarHBondContact O-CG1 3.5Å; T177-I181 PolarHBondContact O-N 3Å |
| 178 | A | 82.8 | Confident | 77.3 | Confident | 51 Ų | 51 | 99.2 Ų | 99.2 | 42% | 0.421 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.9 | -41.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | I174 D175 R176 K182 | I174-A178 WeakPolarHBondContact O-CB 3.43Å; I174-A178 PolarHBondContact O-N 2.88Å; D175-A178 PolarHBondContact O-N 3.49Å; R176-A178 VanDerWaalsContact C-N 3.33Å; A178-K182 WeakPolarHBondContact O-CB 3.3Å; A178-K182 PolarHBondContact O-N 3.16Å; A178-K182 VanDerWaalsContact O-N 3.12Å |
| 179 | E | 83.4 | Confident | 75.6 | Confident | 86 Ų | 86 | 96.3 Ų | 96.3 | 40% | 0.402 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -67.9 | -38.8 | 175.5 | -69.5 | -58.1 | 144.9 | 0 | 0 | 112.6 | D175 R176 K182 Q183 | D175-E179 PolarHBondContact O-N 2.95Å; R176-E179 PolarHBondContact O-N 2.87Å; E179-K182 PolarHBondContact O-N 3.4Å; E179-Q183 PolarHBondContact O-N 3.42Å; E179-Q183 VanDerWaalsContact O-N 3.13Å |
| 180 | E | 75.3 | Confident | 74.3 | Confident | 96 Ų | 96 | 96.9 Ų | 96.9 | 45% | 0.449 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.3 | -42.5 | 175.9 | -75 | 173.6 | 177.4 | 0 | 0 | 112.3 | R176 T177 K182 Q183 | R176-E180 WeakPolarHBondContact O-CG 3.3Å; R176-E180 PolarHBondContact O-N 3.3Å; T177-E180 PolarHBondContact O-N 3.44Å; E180-K182 VanDerWaalsContact C-N 3.27Å; E180-K182 PolarHBondContact O-N 3.09Å; E180-Q183 PolarHBondContact O-N 2.85Å |
| 181 | I | 73 | Confident | 73.2 | Confident | 131 Ų | 131 | 100 Ų | 100 | 67% | 0.672 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -61.5 | -38.6 | 174.7 | -70 | 167.5 | 0 | 0 | 0 | 110.6 | T177 Q183 G184 | T177-I181 HydrophobicContact CG2-CD1 3.86Å; T177-I181 HydrophobicContact CG2-CG1 4.42Å; T177-I181 VanDerWaalsContact O-CG1 3.25Å; T177-I181 WeakPolarHBondContact O-CG1 3.5Å; T177-I181 PolarHBondContact O-N 3Å; I181-Q183 VanDerWaalsContact C-N 3.3Å; I181-Q183 PolarHBondContact O-N 3.33Å; I181-G184 PolarHBondContact O-N 3.16Å |
| 182 | K | 78.9 | Confident | 71.9 | Confident | 165 Ų | 165 | 102.7 Ų | 102.7 | 72% | 0.717 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -69.6 | -25.8 | 179.6 | -168.4 | 179.3 | 173.1 | -166.2 | 0 | 113.1 | A178 E179 E180 G184 | A178-K182 WeakPolarHBondContact O-CB 3.3Å; A178-K182 PolarHBondContact O-N 3.16Å; A178-K182 VanDerWaalsContact O-N 3.12Å; E179-K182 PolarHBondContact O-N 3.4Å; E180-K182 VanDerWaalsContact C-N 3.27Å; E180-K182 PolarHBondContact O-N 3.09Å; K182-G184 VanDerWaalsContact C-N 3.34Å |
| 183 | Q | 74.6 | Confident | 71.2 | Confident | 158 Ų | 158 | 102.9 Ų | 102.9 | 74% | 0.738 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.2 | -1.6 | 177.1 | -73.8 | -178.3 | 9 | 0 | 0 | 114.3 | E179 E180 I181 N185 | E179-Q183 PolarHBondContact O-N 3.42Å; E179-Q183 VanDerWaalsContact O-N 3.13Å; E180-Q183 PolarHBondContact O-N 2.85Å; I181-Q183 VanDerWaalsContact C-N 3.3Å; I181-Q183 PolarHBondContact O-N 3.33Å; Q183-N185 PolarHBondContact O-N 3.23Å |
| 184 | G | 64.2 | Low | 70.8 | Confident | 52 Ų | 52 | 105 Ų | 105 | 54% | 0.536 | 55% | 0.549 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 68.7 | 25 | 164.6 | 0 | 0 | 0 | 0 | 0 | 116 | I181 K182 D186 | I181-G184 PolarHBondContact O-N 3.16Å; K182-G184 VanDerWaalsContact C-N 3.34Å; G184-D186 PolarHBondContact O-N 3.3Å |
| 185 | N | 60.9 | Low | 70.5 | Confident | 96 Ų | 96 | 106.3 Ų | 106.3 | 51% | 0.513 | 55% | 0.547 | S | S | . | . | trans | -88.5 | 90.1 | 176.6 | -176.4 | 71.3 | 0 | 0 | 0 | 110.4 | Q183 N187 | Q183-N185 PolarHBondContact O-N 3.23Å; N185-N187 PolarHBondContact ND2-ND2 3.34Å; N185-N187 PolarHBondContact O-N 2.74Å; N185-N187 PolarHBondContact OD1-ND2 3.23Å; N185-N187 PolarHBondContact OD1-OD1 3.27Å | ||
| 186 | D | 58.1 | Low | 70.3 | Confident | 154 Ų | 154 | 106.6 Ų | 106.6 | 82% | 0.824 | 55% | 0.551 | S | S | * | * | trans | -69.3 | 61.3 | 176.3 | 47.9 | -39.6 | 0 | 0 | 0 | 112.8 | G184 | G184-D186 PolarHBondContact O-N 3.3Š| ||
| 187 | N | 56.7 | Low | 70.1 | Confident | 86 Ų | 86 | 104.1 Ų | 104.1 | 46% | 0.46 | 55% | 0.545 | S | S | . | . | trans | -108.2 | 97.9 | 171.3 | -53.2 | -2.4 | 0 | 0 | 0 | 107.3 | N185 V189 L190 | N185-N187 PolarHBondContact ND2-ND2 3.34Å; N185-N187 PolarHBondContact O-N 2.74Å; N185-N187 PolarHBondContact OD1-ND2 3.23Å; N185-N187 PolarHBondContact OD1-OD1 3.27Å; N187-V189 PolarHBondContact O-N 3.04Å; N187-L190 PolarHBondContact O-N 3.41Å | ||
| 188 | G | 57 | Low | 70.3 | Confident | 70 Ų | 70 | 106.1 Ų | 106.1 | 72% | 0.722 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.6 | 16.1 | 177 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 189 | V | 57.8 | Low | 70.5 | Confident | 119 Ų | 119 | 107.3 Ų | 107.3 | 72% | 0.721 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | -16.4 | 175.8 | 174.9 | 0 | 0 | 0 | 0 | 112.1 | N187 E191 P193 | N187-V189 PolarHBondContact O-N 3.04Å; V189-E191 VanDerWaalsContact C-N 3.25Å; V189-E191 PolarHBondContact O-N 2.92Å; V189-P193 WeakPolarHBondContact O-CD 3.16Å |
| 190 | L | 58.1 | Low | 70.6 | Confident | 77 Ų | 77 | 108 Ų | 108 | 40% | 0.403 | 57% | 0.565 | S | S | . | * | S | Bend | trans | -71.9 | -10.8 | 179.2 | -82.9 | 138.6 | 0 | 0 | 0 | 114.7 | N187 P193 F194 | N187-L190 PolarHBondContact O-N 3.41Å; L190-P193 WeakPolarHBondContact O-CD 3.27Å; L190-P193 WeakPolarHBondContact O-CG 3.49Å; L190-F194 WeakPolarHBondContact O-CB 3.36Å; L190-F194 PolarHBondContact O-N 2.99Å |
| 191 | E | 63.4 | Low | 71.1 | Confident | 124 Ų | 124 | 105 Ų | 105 | 58% | 0.579 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.2 | -49.9 | 179.4 | -76.7 | -168.8 | 116.1 | 0 | 0 | 112.1 | V189 F194 W195 | V189-E191 VanDerWaalsContact C-N 3.25Å; V189-E191 PolarHBondContact O-N 2.92Å; E191-F194 PolarHBondContact O-N 3.03Å; E191-W195 WeakPolarHBondContact O-CB 3.27Å; E191-W195 PolarHBondContact O-N 3.35Å |
| 192 | W | 62.8 | Low | 71.8 | Confident | 206 Ų | 206 | 101 Ų | 101 | 78% | 0.78 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -58.3 | -47.6 | -177.9 | -86.1 | 93.7 | 0 | 0 | 0 | 115.1 | F194 T196 | W192-F194 VanDerWaalsContact C-N 3.3Å; W192-F194 PolarHBondContact O-N 2.89Å; W192-T196 WeakPolarHBondContact O-CG2 3.26Å; W192-T196 PolarHBondContact O-N 2.87Å; W192-T196 VanDerWaalsContact O-N 3.12Å; W192-T196 PolarHBondContact O-OG1 3.32Å |
| 193 | P | 74.6 | Confident | 72.3 | Confident | 59 Ų | 59 | 98.5 Ų | 98.5 | 38% | 0.383 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -70.3 | -22.9 | 176.5 | 23.3 | -30.6 | 0 | 0 | 0 | 113.8 | V189 L190 T196 K197 | V189-P193 WeakPolarHBondContact O-CD 3.16Å; L190-P193 WeakPolarHBondContact O-CD 3.27Å; L190-P193 WeakPolarHBondContact O-CG 3.49Å; P193-T196 WeakPolarHBondContact CA-OG1 3.34Å; P193-T196 PolarHBondContact O-OG1 2.97Å; P193-K197 WeakPolarHBondContact O-CD 3.28Å; P193-K197 VanDerWaalsContact O-CG 3.26Å; P193-K197 WeakPolarHBondContact O-CG 3.33Å |
| 194 | F | 74.8 | Confident | 73 | Confident | 95 Ų | 95 | 93 Ų | 93 | 42% | 0.417 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -74.9 | -50.1 | 172 | 174.8 | -98.6 | 0 | 0 | 0 | 111.7 | L190 E191 W192 T196 K197 L198 | L190-F194 WeakPolarHBondContact O-CB 3.36Å; L190-F194 PolarHBondContact O-N 2.99Å; E191-F194 PolarHBondContact O-N 3.03Å; W192-F194 VanDerWaalsContact C-N 3.3Å; W192-F194 PolarHBondContact O-N 2.89Å; F194-T196 VanDerWaalsContact C-N 3.34Å; F194-T196 PolarHBondContact O-N 3.38Å; F194-K197 PolarHBondContact O-N 3.47Å; F194-L198 HydrophobicContact CE1-CD1 4.07Å; F194-L198 HydrophobicContact CZ-CD1 3.94Å; F194-L198 PolarHBondContact O-N 3.07Å |
| 195 | W | 78.9 | Confident | 74 | Confident | 141 Ų | 141 | 96.3 Ų | 96.3 | 53% | 0.534 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.3 | -41.8 | -179.5 | -76.9 | 112 | 0 | 0 | 0 | 112.1 | E191 K197 L198 V199 | E191-W195 WeakPolarHBondContact O-CB 3.27Å; E191-W195 PolarHBondContact O-N 3.35Å; W195-K197 PolarHBondContact O-N 2.99Å; W195-L198 PolarHBondContact O-N 2.68Å; W195-V199 WeakPolarHBondContact O-CB 3.41Å; W195-V199 VanDerWaalsContact O-CG2 3.24Å; W195-V199 WeakPolarHBondContact O-CG2 3.29Å; W195-V199 PolarHBondContact O-N 3.34Å |
| 196 | T | 81.3 | Confident | 75.5 | Confident | 73 Ų | 73 | 95.7 Ų | 95.7 | 45% | 0.448 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.7 | -40.8 | 176.8 | 47.8 | 0 | 0 | 0 | 0 | 112.6 | W192 P193 F194 V199 V200 | W192-T196 WeakPolarHBondContact O-CG2 3.26Å; W192-T196 PolarHBondContact O-N 2.87Å; W192-T196 VanDerWaalsContact O-N 3.12Å; W192-T196 PolarHBondContact O-OG1 3.32Å; P193-T196 WeakPolarHBondContact CA-OG1 3.34Å; P193-T196 PolarHBondContact O-OG1 2.97Å; F194-T196 VanDerWaalsContact C-N 3.34Å; F194-T196 PolarHBondContact O-N 3.38Å; T196-V199 PolarHBondContact O-N 3.29Å; T196-V200 VanDerWaalsContact O-CG2 3.31Å; T196-V200 WeakPolarHBondContact O-CG2 3.41Å; T196-V200 PolarHBondContact O-N 3.2Å |
| 197 | K | 78.4 | Confident | 77 | Confident | 107 Ų | 107 | 90.3 Ų | 90.3 | 47% | 0.465 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.4 | -41.7 | 175.3 | -71 | 173.5 | 178.6 | 175.3 | 0 | 112 | L173 P193 F194 W195 V199 V200 V201 | L173-K197 HydrophobicContact CD1-CB 4.18Å; L173-K197 HydrophobicContact CD1-CD 4.07Å; L173-K197 HydrophobicContact CD1-CG 4.49Å; L173-K197 HydrophobicContact CD2-CD 3.64Å; L173-K197 HydrophobicContact CG-CD 4.49Å; P193-K197 WeakPolarHBondContact O-CD 3.28Å; P193-K197 VanDerWaalsContact O-CG 3.26Å; P193-K197 WeakPolarHBondContact O-CG 3.33Å; F194-K197 PolarHBondContact O-N 3.47Å; W195-K197 PolarHBondContact O-N 2.99Å; K197-V199 VanDerWaalsContact C-N 3.35Å; K197-V200 PolarHBondContact O-N 3.49Å; K197-V201 WeakPolarHBondContact O-CG2 3.43Å; K197-V201 PolarHBondContact O-N 3.37Å; K197-V201 VanDerWaalsContact O-N 3.07Å |
| 198 | L | 82.1 | Confident | 78.5 | Confident | 83 Ų | 83 | 87.6 Ų | 87.6 | 44% | 0.435 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.1 | -39.4 | 177.6 | -164.1 | 134.9 | 0 | 0 | 0 | 111.6 | F194 W195 V201 A202 | F194-L198 HydrophobicContact CE1-CD1 4.07Å; F194-L198 HydrophobicContact CZ-CD1 3.94Å; F194-L198 PolarHBondContact O-N 3.07Å; W195-L198 PolarHBondContact O-N 2.68Å; L198-V201 PolarHBondContact O-N 2.81Å; L198-A202 WeakPolarHBondContact O-CB 3.27Å; L198-A202 PolarHBondContact O-N 3.32Å |
| 199 | V | 87.1 | Confident | 80 | Confident | 75 Ų | 75 | 87.8 Ų | 87.8 | 46% | 0.455 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.9 | -44.6 | 174.4 | 170.2 | 0 | 0 | 0 | 0 | 111.6 | W195 T196 K197 V201 A202 I203 | W195-V199 WeakPolarHBondContact O-CB 3.41Å; W195-V199 VanDerWaalsContact O-CG2 3.24Å; W195-V199 WeakPolarHBondContact O-CG2 3.29Å; W195-V199 PolarHBondContact O-N 3.34Å; T196-V199 PolarHBondContact O-N 3.29Å; K197-V199 VanDerWaalsContact C-N 3.35Å; V199-V201 VanDerWaalsContact C-N 3.33Å; V199-V201 PolarHBondContact O-N 3.28Å; V199-A202 PolarHBondContact O-N 3.47Å; V199-I203 HydrophobicContact CG1-CD1 3.78Å; V199-I203 HydrophobicContact CG1-CG1 4.42Å; V199-I203 VanDerWaalsContact O-CG1 3.29Å; V199-I203 WeakPolarHBondContact O-CG1 3.36Å; V199-I203 PolarHBondContact O-N 3.4Å |
| 200 | V | 85.3 | Confident | 81.5 | Confident | 100 Ų | 100 | 86.3 Ų | 86.3 | 61% | 0.606 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -61 | -42.4 | 177.6 | 170.2 | 0 | 0 | 0 | 0 | 111.4 | T196 K197 I203 G204 | T196-V200 VanDerWaalsContact O-CG2 3.31Å; T196-V200 WeakPolarHBondContact O-CG2 3.41Å; T196-V200 PolarHBondContact O-N 3.2Å; K197-V200 PolarHBondContact O-N 3.49Å; V200-I203 PolarHBondContact O-N 3.06Å; V200-G204 PolarHBondContact O-N 3.12Å |
| 201 | V | 85.4 | Confident | 82.9 | Confident | 33 Ų | 33 | 87 Ų | 87 | 20% | 0.2 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -65.3 | -43.5 | 175.9 | 171.5 | 0 | 0 | 0 | 0 | 111.5 | V166 L170 K197 L198 V199 I203 G204 F205 | V166-V201 HydrophobicContact CG1-CG1 3.9Å; L170-V201 HydrophobicContact CD1-CG1 3.82Å; L170-V201 HydrophobicContact CD2-CB 4.24Å; L170-V201 HydrophobicContact CD2-CG1 3.88Å; L170-V201 HydrophobicContact CD2-CG2 3.8Å; L170-V201 HydrophobicContact CG-CG1 3.93Å; L170-V201 HydrophobicContact CG-CG2 4.17Å; K197-V201 WeakPolarHBondContact O-CG2 3.43Å; K197-V201 PolarHBondContact O-N 3.37Å; K197-V201 VanDerWaalsContact O-N 3.07Å; L198-V201 PolarHBondContact O-N 2.81Å; V199-V201 VanDerWaalsContact C-N 3.33Å; V199-V201 PolarHBondContact O-N 3.28Å; V201-I203 VanDerWaalsContact C-N 3.34Å; V201-I203 PolarHBondContact O-N 2.8Å; V201-G204 PolarHBondContact O-N 2.92Å; V201-F205 WeakPolarHBondContact O-CB 3.44Å; V201-F205 PolarHBondContact O-N 3.28Å |
| 202 | A | 86.5 | Confident | 84 | Confident | 47 Ų | 47 | 85.7 Ų | 85.7 | 39% | 0.388 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.5 | -41.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L198 V199 T206 | L198-A202 WeakPolarHBondContact O-CB 3.27Å; L198-A202 PolarHBondContact O-N 3.32Å; V199-A202 PolarHBondContact O-N 3.47Å; A202-T206 VanDerWaalsContact O-CB 3.3Å; A202-T206 WeakPolarHBondContact O-CB 3.4Å; A202-T206 PolarHBondContact O-N 3.47Å; A202-T206 PolarHBondContact O-OG1 3.46Å |
| 203 | I | 91.4 | Very high | 85.1 | Confident | 114 Ų | 114 | 83.6 Ų | 83.6 | 59% | 0.585 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -64.2 | -46.6 | 174.8 | -66.5 | 166.5 | 0 | 0 | 0 | 110.5 | V199 V200 V201 F205 T206 G207 | V199-I203 HydrophobicContact CG1-CD1 3.78Å; V199-I203 HydrophobicContact CG1-CG1 4.42Å; V199-I203 VanDerWaalsContact O-CG1 3.29Å; V199-I203 WeakPolarHBondContact O-CG1 3.36Å; V199-I203 PolarHBondContact O-N 3.4Å; V200-I203 PolarHBondContact O-N 3.06Å; V201-I203 VanDerWaalsContact C-N 3.34Å; V201-I203 PolarHBondContact O-N 2.8Å; I203-F205 PolarHBondContact O-N 2.88Å; I203-T206 PolarHBondContact O-N 3.25Å; I203-G207 PolarHBondContact O-N 2.85Å |
| 204 | G | 87.5 | Confident | 85.7 | Confident | 43 Ų | 43 | 84.6 Ų | 84.6 | 44% | 0.443 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -60.5 | -43.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | V200 V201 G208 | V200-G204 PolarHBondContact O-N 3.12Å; V201-G204 PolarHBondContact O-N 2.92Å; G204-G208 PolarHBondContact O-N 3.26Å |
| 205 | F | 86.9 | Confident | 86 | Confident | 121 Ų | 121 | 83.3 Ų | 83.3 | 53% | 0.531 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.7 | -44.7 | 176.7 | -177.1 | -107 | 0 | 0 | 0 | 111.7 | V201 I203 G207 G208 L209 | V201-F205 WeakPolarHBondContact O-CB 3.44Å; V201-F205 PolarHBondContact O-N 3.28Å; I203-F205 PolarHBondContact O-N 2.88Å; F205-G207 PolarHBondContact O-N 3.34Å; F205-G208 PolarHBondContact O-N 3.17Å; F205-L209 HydrophobicContact CD1-CD1 3.8Å; F205-L209 HydrophobicContact CD1-CG 4.19Å; F205-L209 HydrophobicContact CE1-CD1 3.25Å; F205-L209 HydrophobicContact CE1-CD2 4.44Å; F205-L209 HydrophobicContact CE1-CG 3.86Å; F205-L209 HydrophobicContact CE2-CD1 4.5Å; F205-L209 HydrophobicContact CE2-CD2 4.33Å; F205-L209 HydrophobicContact CE2-CG 4.27Å; F205-L209 HydrophobicContact CZ-CD1 3.66Å; F205-L209 HydrophobicContact CZ-CD2 4Å; F205-L209 HydrophobicContact CZ-CG 3.89Å; F205-L209 WeakPolarHBondContact O-CG 3.31Å; F205-L209 PolarHBondContact O-N 3.01Å |
| 206 | T | 91.3 | Very high | 86 | Confident | 82 Ų | 82 | 79.5 Ų | 79.5 | 50% | 0.503 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -62.2 | -45.3 | 178.4 | -54.7 | 0 | 0 | 0 | 0 | 111 | A202 I203 G208 L209 V210 | A202-T206 VanDerWaalsContact O-CB 3.3Å; A202-T206 WeakPolarHBondContact O-CB 3.4Å; A202-T206 PolarHBondContact O-N 3.47Å; A202-T206 PolarHBondContact O-OG1 3.46Å; I203-T206 PolarHBondContact O-N 3.25Å; T206-G208 PolarHBondContact O-N 2.87Å; T206-L209 PolarHBondContact O-N 2.84Å; T206-V210 WeakPolarHBondContact O-CG2 3.34Å; T206-V210 PolarHBondContact O-N 3.44Å |
| 207 | G | 89.4 | Confident | 86.1 | Confident | 42 Ų | 42 | 81.7 Ų | 81.7 | 43% | 0.433 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -60.9 | -43.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | I203 F205 V210 F211 | I203-G207 PolarHBondContact O-N 2.85Å; F205-G207 PolarHBondContact O-N 3.34Å; G207-V210 PolarHBondContact O-N 3Å; G207-F211 PolarHBondContact O-N 3.17Å |
| 208 | G | 87.8 | Confident | 86.3 | Confident | 29 Ų | 29 | 79.5 Ų | 79.5 | 30% | 0.299 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.2 | -42.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | G204 F205 T206 F211 M212 | G204-G208 PolarHBondContact O-N 3.26Å; F205-G208 PolarHBondContact O-N 3.17Å; T206-G208 PolarHBondContact O-N 2.87Å; G208-F211 PolarHBondContact O-N 3.09Å; G208-M212 VanDerWaalsContact O-CB 3.27Å; G208-M212 WeakPolarHBondContact O-CB 3.4Å; G208-M212 PolarHBondContact O-N 3.33Å |
| 209 | L | 88.5 | Confident | 86.1 | Confident | 73 Ų | 73 | 81.2 Ų | 81.2 | 38% | 0.382 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -64.8 | -43.3 | 176.1 | -76.3 | -175.2 | 0 | 0 | 0 | 112.4 | F205 T206 M212 Y213 | F205-L209 HydrophobicContact CD1-CD1 3.8Å; F205-L209 HydrophobicContact CD1-CG 4.19Å; F205-L209 HydrophobicContact CE1-CD1 3.25Å; F205-L209 HydrophobicContact CE1-CD2 4.44Å; F205-L209 HydrophobicContact CE1-CG 3.86Å; F205-L209 HydrophobicContact CE2-CD1 4.5Å; F205-L209 HydrophobicContact CE2-CD2 4.33Å; F205-L209 HydrophobicContact CE2-CG 4.27Å; F205-L209 HydrophobicContact CZ-CD1 3.66Å; F205-L209 HydrophobicContact CZ-CD2 4Å; F205-L209 HydrophobicContact CZ-CG 3.89Å; F205-L209 WeakPolarHBondContact O-CG 3.31Å; F205-L209 PolarHBondContact O-N 3.01Å; T206-L209 PolarHBondContact O-N 2.84Å; L209-M212 HydrophobicContact CD2-CE 3.97Å; L209-M212 PolarHBondContact O-N 3.14Å; L209-Y213 VanDerWaalsContact O-CB 3.29Å; L209-Y213 WeakPolarHBondContact O-CB 3.41Å; L209-Y213 PolarHBondContact O-N 3.01Å |
| 210 | V | 90.7 | Very high | 85.6 | Confident | 89 Ų | 89 | 80.1 Ų | 80.1 | 54% | 0.539 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62.7 | -45.5 | 177.3 | 172 | 0 | 0 | 0 | 0 | 110.4 | T206 G207 Y213 V214 | T206-V210 WeakPolarHBondContact O-CG2 3.34Å; T206-V210 PolarHBondContact O-N 3.44Å; G207-V210 PolarHBondContact O-N 3Å; V210-Y213 PolarHBondContact O-N 2.92Å; V210-V214 WeakPolarHBondContact O-CG2 3.24Å; V210-V214 PolarHBondContact O-N 2.94Å; V210-V214 VanDerWaalsContact O-N 3.09Å |
| 211 | F | 86.9 | Confident | 85.3 | Confident | 92 Ų | 92 | 80 Ų | 80 | 40% | 0.404 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -62.7 | -46.9 | 175.9 | -172.3 | -78.8 | 0 | 0 | 0 | 111.4 | H159 G207 G208 Y213 V214 Q215 | H159-F211 AromaticContact CE1-CD1 3.06Å; H159-F211 WeakPolarHBondContact CE1-CD1 3.26Å; H159-F211 AromaticContact CE1-CE1 3.01Å; H159-F211 WeakPolarHBondContact CE1-CE1 3.44Å; H159-F211 AromaticContact CE1-CZ 3.97Å; H159-F211 AromaticContact ND1-CE1 3.98Å; H159-F211 AromaticContact NE2-CD1 2.93Å; H159-F211 WeakPolarHBondContact NE2-CD1 3.44Å; H159-F211 AromaticContact NE2-CE1 3.47Å; H159-F211 WeakPolarHBondContact NE2-CE1 3.42Å; H159-F211 AromaticContact NE2-CG 3.65Å; G207-F211 PolarHBondContact O-N 3.17Å; G208-F211 PolarHBondContact O-N 3.09Å; F211-Y213 VanDerWaalsContact C-N 3.27Å; F211-Y213 PolarHBondContact O-N 2.75Å; F211-V214 PolarHBondContact O-N 2.91Å; F211-V214 VanDerWaalsContact O-N 3.17Å; F211-Q215 HydrophobicContact CD1-CG 3.69Å; F211-Q215 HydrophobicContact CE1-CG 3.39Å; F211-Q215 HydrophobicContact CZ-CG 4.23Å; F211-Q215 WeakPolarHBondContact O-CG 3.35Å; F211-Q215 PolarHBondContact O-N 3.48Å |
| 212 | M | 86.9 | Confident | 84.8 | Confident | 96 Ų | 96 | 80.4 Ų | 80.4 | 47% | 0.473 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -59.8 | -38.3 | 177.2 | -172.9 | -177.8 | 75.9 | 0 | 0 | 111.7 | G208 L209 Q215 C216 | G208-M212 VanDerWaalsContact O-CB 3.27Å; G208-M212 WeakPolarHBondContact O-CB 3.4Å; G208-M212 PolarHBondContact O-N 3.33Å; L209-M212 HydrophobicContact CD2-CE 3.97Å; L209-M212 PolarHBondContact O-N 3.14Å; M212-Q215 PolarHBondContact O-N 3.38Å; M212-C216 WeakPolarHBondContact O-CB 3.47Å; M212-C216 PolarHBondContact O-N 3.21Å |
| 213 | Y | 85.8 | Confident | 83.9 | Confident | 161 Ų | 161 | 84.2 Ų | 84.2 | 63% | 0.631 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -63.4 | -42.6 | 176.2 | 176 | -103.6 | 0 | 0 | 0 | 112 | L209 V210 F211 C216 K217 | L209-Y213 VanDerWaalsContact O-CB 3.29Å; L209-Y213 WeakPolarHBondContact O-CB 3.41Å; L209-Y213 PolarHBondContact O-N 3.01Å; V210-Y213 PolarHBondContact O-N 2.92Å; F211-Y213 VanDerWaalsContact C-N 3.27Å; F211-Y213 PolarHBondContact O-N 2.75Å; Y213-C216 PolarHBondContact O-N 3.34Å; Y213-K217 PolarHBondContact O-N 3.31Å |
| 214 | V | 87.1 | Confident | 83.2 | Confident | 80 Ų | 80 | 87.4 Ų | 87.4 | 49% | 0.485 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -61.5 | -46 | 174.5 | 174.6 | 0 | 0 | 0 | 0 | 110.7 | V210 F211 C216 K217 V218 | V210-V214 WeakPolarHBondContact O-CG2 3.24Å; V210-V214 PolarHBondContact O-N 2.94Å; V210-V214 VanDerWaalsContact O-N 3.09Å; F211-V214 PolarHBondContact O-N 2.91Å; F211-V214 VanDerWaalsContact O-N 3.17Å; V214-C216 VanDerWaalsContact C-N 3.34Å; V214-C216 PolarHBondContact O-N 2.97Å; V214-K217 PolarHBondContact O-N 3.41Å; V214-V218 PolarHBondContact O-N 3.26Å |
| 215 | Q | 80.2 | Confident | 82.4 | Confident | 69 Ų | 69 | 94.5 Ų | 94.5 | 32% | 0.322 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -64.4 | -39 | 176.2 | -61 | -57.6 | -20.8 | 0 | 0 | 112.1 | F211 M212 K217 V218 Y219 | F211-Q215 HydrophobicContact CD1-CG 3.69Å; F211-Q215 HydrophobicContact CE1-CG 3.39Å; F211-Q215 HydrophobicContact CZ-CG 4.23Å; F211-Q215 WeakPolarHBondContact O-CG 3.35Å; F211-Q215 PolarHBondContact O-N 3.48Å; M212-Q215 PolarHBondContact O-N 3.38Å; Q215-K217 VanDerWaalsContact C-N 3.34Å; Q215-K217 PolarHBondContact O-N 2.91Å; Q215-V218 PolarHBondContact O-N 3.34Å; Q215-Y219 WeakPolarHBondContact O-CB 3.01Å; Q215-Y219 PolarHBondContact O-N 3.43Å |
| 216 | C | 80.5 | Confident | 81.4 | Confident | 60 Ų | 60 | 90.4 Ų | 90.4 | 41% | 0.405 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.6 | -40 | 177.1 | -173.5 | 0 | 0 | 0 | 0 | 111 | M212 Y213 V214 V218 Y219 V220 | M212-C216 WeakPolarHBondContact O-CB 3.47Å; M212-C216 PolarHBondContact O-N 3.21Å; Y213-C216 PolarHBondContact O-N 3.34Å; V214-C216 VanDerWaalsContact C-N 3.34Å; V214-C216 PolarHBondContact O-N 2.97Å; C216-V218 VanDerWaalsContact C-N 3.34Å; C216-V218 PolarHBondContact O-N 3.43Å; C216-Y219 WeakPolarHBondContact O-CB 2.93Å; C216-Y219 PolarHBondContact O-N 2.86Å; C216-V220 WeakPolarHBondContact O-CB 3.06Å; C216-V220 VanDerWaalsContact O-CG2 3.24Å; C216-V220 WeakPolarHBondContact O-CG2 3.25Å; C216-V220 PolarHBondContact O-N 2.92Å |
| 217 | K | 83.3 | Confident | 80.1 | Confident | 119 Ų | 119 | 91.5 Ų | 91.5 | 52% | 0.517 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -61.3 | -43.1 | 175.7 | -171.1 | 175.2 | 179.8 | 163.7 | 0 | 111.8 | Y213 V214 Q215 V220 Q221 | Y213-K217 PolarHBondContact O-N 3.31Å; V214-K217 PolarHBondContact O-N 3.41Å; Q215-K217 VanDerWaalsContact C-N 3.34Å; Q215-K217 PolarHBondContact O-N 2.91Å; K217-V220 PolarHBondContact O-N 3.33Å; K217-Q221 WeakPolarHBondContact O-CB 3.3Å; K217-Q221 VanDerWaalsContact O-CG 3.25Å; K217-Q221 WeakPolarHBondContact O-CG 3.48Å; K217-Q221 PolarHBondContact O-N 3.49Å |
| 218 | V | 81.5 | Confident | 79.1 | Confident | 61 Ų | 61 | 92.8 Ų | 92.8 | 37% | 0.37 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -63.2 | -45.6 | 174.2 | 176.6 | 0 | 0 | 0 | 0 | 110.3 | V214 Q215 C216 V220 Q221 L222 | V214-V218 PolarHBondContact O-N 3.26Å; Q215-V218 PolarHBondContact O-N 3.34Å; C216-V218 VanDerWaalsContact C-N 3.34Å; C216-V218 PolarHBondContact O-N 3.43Å; V218-V220 PolarHBondContact O-N 2.99Å; V218-Q221 WeakPolarHBondContact O-CB 3.33Å; V218-Q221 PolarHBondContact O-N 3.33Å; V218-L222 HydrophobicContact CG1-CD1 3.93Å; V218-L222 VanDerWaalsContact O-CD1 3.23Å; V218-L222 WeakPolarHBondContact O-CD1 3.39Å; V218-L222 PolarHBondContact O-N 3.22Å |
| 219 | Y | 77.3 | Confident | 77.9 | Confident | 120 Ų | 120 | 96.7 Ų | 96.7 | 47% | 0.471 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -59.3 | -45.7 | 177.1 | -177.2 | -105.1 | 0 | 0 | 0 | 112.6 | Q215 C216 Q221 L222 W223 | Q215-Y219 WeakPolarHBondContact O-CB 3.01Å; Q215-Y219 PolarHBondContact O-N 3.43Å; C216-Y219 WeakPolarHBondContact O-CB 2.93Å; C216-Y219 PolarHBondContact O-N 2.86Å; Y219-Q221 VanDerWaalsContact C-N 3.33Å; Y219-Q221 PolarHBondContact O-N 3.34Å; Y219-L222 PolarHBondContact O-N 2.67Å; Y219-W223 HydrophobicContact CD1-CE3 4.31Å; Y219-W223 AromaticContact CE1-CE3 3.39Å; Y219-W223 HydrophobicContact CE1-CE3 3.39Å; Y219-W223 AromaticContact CE1-CZ3 3.69Å; Y219-W223 HydrophobicContact CE1-CZ3 3.69Å; Y219-W223 AromaticContact CZ-CE3 3.64Å; Y219-W223 AromaticContact CZ-CZ3 3.84Å; Y219-W223 WeakPolarHBondContact O-CB 3.43Å; Y219-W223 PolarHBondContact O-N 3.4Å; Y219-W223 VanDerWaalsContact OH-CZ3 3.25Å; Y219-W223 WeakPolarHBondContact OH-CZ3 3.47Å |
| 220 | V | 77.8 | Confident | 76.6 | Confident | 52 Ų | 52 | 93.3 Ų | 93.3 | 32% | 0.315 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -64.9 | -37.2 | 177.3 | 170.6 | 0 | 0 | 0 | 0 | 110.9 | C216 K217 V218 W223 R224 | C216-V220 WeakPolarHBondContact O-CB 3.06Å; C216-V220 VanDerWaalsContact O-CG2 3.24Å; C216-V220 WeakPolarHBondContact O-CG2 3.25Å; C216-V220 PolarHBondContact O-N 2.92Å; K217-V220 PolarHBondContact O-N 3.33Å; V218-V220 PolarHBondContact O-N 2.99Å; V220-W223 PolarHBondContact O-N 3.41Å; V220-R224 HydrophobicContact CG1-CG 4.39Å; V220-R224 WeakPolarHBondContact O-CB 3.23Å; V220-R224 VanDerWaalsContact O-CG 3.26Å; V220-R224 WeakPolarHBondContact O-CG 3.41Å; V220-R224 PolarHBondContact O-N 3.4Å |
| 221 | Q | 78.2 | Confident | 75.4 | Confident | 97 Ų | 97 | 95.7 Ų | 95.7 | 45% | 0.453 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -64.6 | -44.1 | 174.2 | -76.3 | 175.9 | -11.2 | 0 | 0 | 111.9 | K217 V218 Y219 W223 R224 R225 | K217-Q221 WeakPolarHBondContact O-CB 3.3Å; K217-Q221 VanDerWaalsContact O-CG 3.25Å; K217-Q221 WeakPolarHBondContact O-CG 3.48Å; K217-Q221 PolarHBondContact O-N 3.49Å; V218-Q221 WeakPolarHBondContact O-CB 3.33Å; V218-Q221 PolarHBondContact O-N 3.33Å; Y219-Q221 VanDerWaalsContact C-N 3.33Å; Y219-Q221 PolarHBondContact O-N 3.34Å; Q221-W223 VanDerWaalsContact C-N 3.34Å; Q221-R224 PolarHBondContact O-N 3Å; Q221-R225 WeakPolarHBondContact O-CG 3.34Å; Q221-R225 PolarHBondContact O-N 3.07Å |
| 222 | L | 74.4 | Confident | 74.3 | Confident | 42 Ų | 42 | 93.5 Ų | 93.5 | 22% | 0.22 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -61.7 | -43.2 | 173.7 | -92.4 | 67.6 | 0 | 0 | 0 | 111 | M144 I152 V218 Y219 R225 L226 | M144-L222 HydrophobicContact CE-CD2 3.96Å; M144-L222 HydrophobicContact CE-CG 3.9Å; M144-L222 HydrophobicContact SD-CD2 3.5Å; M144-L222 WeakPolarHBondContact SD-CD2 3.38Å; M144-L222 HydrophobicContact SD-CG 4.12Å; I152-L222 HydrophobicContact CD1-CD2 4.13Å; V218-L222 HydrophobicContact CG1-CD1 3.93Å; V218-L222 VanDerWaalsContact O-CD1 3.23Å; V218-L222 WeakPolarHBondContact O-CD1 3.39Å; V218-L222 PolarHBondContact O-N 3.22Å; Y219-L222 PolarHBondContact O-N 2.67Å; L222-R225 PolarHBondContact O-N 2.94Å; L222-L226 WeakPolarHBondContact O-CB 3.24Å; L222-L226 PolarHBondContact O-N 3.13Å |
| 223 | W | 67.9 | Low | 73.4 | Confident | 127 Ų | 127 | 91.7 Ų | 91.7 | 48% | 0.481 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.5 | -45.7 | 176.3 | -166.7 | -51.5 | 0 | 0 | 0 | 111.4 | Y219 V220 Q221 R225 L226 K227 | Y219-W223 HydrophobicContact CD1-CE3 4.31Å; Y219-W223 AromaticContact CE1-CE3 3.39Å; Y219-W223 HydrophobicContact CE1-CE3 3.39Å; Y219-W223 AromaticContact CE1-CZ3 3.69Å; Y219-W223 HydrophobicContact CE1-CZ3 3.69Å; Y219-W223 AromaticContact CZ-CE3 3.64Å; Y219-W223 AromaticContact CZ-CZ3 3.84Å; Y219-W223 WeakPolarHBondContact O-CB 3.43Å; Y219-W223 PolarHBondContact O-N 3.4Å; Y219-W223 VanDerWaalsContact OH-CZ3 3.25Å; Y219-W223 WeakPolarHBondContact OH-CZ3 3.47Å; V220-W223 PolarHBondContact O-N 3.41Å; Q221-W223 VanDerWaalsContact C-N 3.34Å; W223-R225 VanDerWaalsContact C-N 3.31Å; W223-R225 PolarHBondContact O-N 3.3Å; W223-L226 CarbonylContact O-C 3.59Å; W223-L226 WeakPolarHBondContact O-CB 3.39Å; W223-L226 PolarHBondContact O-N 2.97Å; W223-L226 VanDerWaalsContact O-N 3.16Å; W223-K227 VanDerWaalsContact O-CB 3.3Å; W223-K227 WeakPolarHBondContact O-CB 3.48Å; W223-K227 PolarHBondContact O-N 3.25Å |
| 224 | R | 77.5 | Confident | 72.7 | Confident | 180 Ų | 180 | 88.3 Ų | 88.3 | 68% | 0.679 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -60.3 | -41.8 | 177.9 | -75.5 | 177.5 | -170.2 | 178.4 | 4.2 | 111.3 | V220 Q221 K227 A228 | V220-R224 HydrophobicContact CG1-CG 4.39Å; V220-R224 WeakPolarHBondContact O-CB 3.23Å; V220-R224 VanDerWaalsContact O-CG 3.26Å; V220-R224 WeakPolarHBondContact O-CG 3.41Å; V220-R224 PolarHBondContact O-N 3.4Å; Q221-R224 PolarHBondContact O-N 3Å; R224-K227 PolarHBondContact O-N 3.45Å; R224-A228 WeakPolarHBondContact O-CB 3.35Å; R224-A228 PolarHBondContact O-N 2.85Å |
| 225 | R | 70.9 | Confident | 72.2 | Confident | 192 Ų | 192 | 84.6 Ų | 84.6 | 73% | 0.725 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -63.6 | -42.9 | 173.8 | -73.4 | -177.6 | 176.1 | -172 | -0 | 111.8 | Q221 L222 W223 A228 Y229 | Q221-R225 WeakPolarHBondContact O-CG 3.34Å; Q221-R225 PolarHBondContact O-N 3.07Å; L222-R225 PolarHBondContact O-N 2.94Å; W223-R225 VanDerWaalsContact C-N 3.31Å; W223-R225 PolarHBondContact O-N 3.3Å; R225-A228 PolarHBondContact O-N 3.24Å; R225-Y229 PolarHBondContact O-N 3.35Å |
| 226 | L | 64.7 | Low | 72.2 | Confident | 36 Ų | 36 | 84.4 Ų | 84.4 | 19% | 0.188 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -62.9 | -43.6 | 175.6 | -178 | 50.2 | 0 | 0 | 0 | 112.3 | W139 L142 L222 W223 A228 Y229 N230 | W139-L226 HydrophobicContact CE3-CD2 4.21Å; W139-L226 HydrophobicContact CE3-CG 4.24Å; W139-L226 HydrophobicContact CZ3-CD2 4.05Å; W139-L226 HydrophobicContact CZ3-CG 3.95Å; L142-L226 HydrophobicContact CB-CD1 3.63Å; L142-L226 HydrophobicContact CD1-CD1 3.92Å; L142-L226 HydrophobicContact CD2-CB 4.03Å; L142-L226 HydrophobicContact CD2-CD1 4.02Å; L142-L226 HydrophobicContact CD2-CG 4.48Å; L142-L226 HydrophobicContact CG-CD1 4.04Å; L222-L226 WeakPolarHBondContact O-CB 3.24Å; L222-L226 PolarHBondContact O-N 3.13Å; W223-L226 CarbonylContact O-C 3.59Å; W223-L226 WeakPolarHBondContact O-CB 3.39Å; W223-L226 PolarHBondContact O-N 2.97Å; W223-L226 VanDerWaalsContact O-N 3.16Å; L226-A228 VanDerWaalsContact C-N 3.28Å; L226-A228 PolarHBondContact O-N 3.49Å; L226-Y229 PolarHBondContact O-N 3.24Å; L226-N230 WeakPolarHBondContact CD1-ND2 3.26Å; L226-N230 WeakPolarHBondContact O-CB 3.37Å; L226-N230 PolarHBondContact O-N 3.46Å |
| 227 | K | 65.3 | Low | 72.2 | Confident | 105 Ų | 105 | 84.9 Ų | 84.9 | 46% | 0.457 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.5 | -35.8 | 177.3 | -172.7 | 173.5 | 177.7 | 165.7 | 0 | 111.4 | L133 W223 R224 R231 | L133-K227 HydrophobicContact CD2-CG 3.7Å; W223-K227 VanDerWaalsContact O-CB 3.3Å; W223-K227 WeakPolarHBondContact O-CB 3.48Å; W223-K227 PolarHBondContact O-N 3.25Å; R224-K227 PolarHBondContact O-N 3.45Å; K227-R231 PolarHBondContact O-N 3Å |
| 228 | A | 67.1 | Low | 71.8 | Confident | 68 Ų | 68 | 79.2 Ų | 79.2 | 56% | 0.562 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -68.8 | -39.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | R224 R225 L226 R231 | R224-A228 WeakPolarHBondContact O-CB 3.35Å; R224-A228 PolarHBondContact O-N 2.85Å; R225-A228 PolarHBondContact O-N 3.24Å; L226-A228 VanDerWaalsContact C-N 3.28Å; L226-A228 PolarHBondContact O-N 3.49Å; A228-R231 VanDerWaalsContact O-CB 3.3Å; A228-R231 WeakPolarHBondContact O-CB 3.31Å |
| 229 | Y | 62.8 | Low | 71.1 | Confident | 112 Ų | 112 | 79.6 Ų | 79.6 | 44% | 0.439 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -69.6 | -37.9 | 177.9 | -169.8 | -94.5 | 0 | 0 | 0 | 113.1 | P12 L142 R225 L226 R231 | P12-Y229 HydrophobicContact CB-CD2 4.37Å; P12-Y229 HydrophobicContact CB-CE2 3.89Å; P12-Y229 HydrophobicContact CG-CD2 4.26Å; P12-Y229 HydrophobicContact CG-CE2 3.75Å; L142-Y229 HydrophobicContact CD1-CD1 4.31Å; L142-Y229 HydrophobicContact CD1-CG 4.33Å; R225-Y229 PolarHBondContact O-N 3.35Å; L226-Y229 PolarHBondContact O-N 3.24Å; Y229-R231 VanDerWaalsContact C-N 3.27Å; Y229-R231 PolarHBondContact O-N 2.89Å |
| 230 | N | 62.1 | Low | 70.2 | Confident | 1 Ų | 1 | 78.1 Ų | 78.1 | 1% | 0.005 | 36% | 0.364 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.9 | 12.2 | 179.4 | -75.6 | -30.8 | 0 | 0 | 0 | 114.2 | K134 W139 L226 V232 | K134-N230 PolarHBondContact N-O 3.46Å; W139-N230 HydrophobicContact CD2-CB 4.22Å; W139-N230 VanDerWaalsContact CD2-ND2 3.32Å; W139-N230 HydrophobicContact CZ2-CB 4.29Å; L226-N230 WeakPolarHBondContact CD1-ND2 3.26Å; L226-N230 WeakPolarHBondContact O-CB 3.37Å; L226-N230 PolarHBondContact O-N 3.46Å; N230-V232 PolarHBondContact O-N 2.94Å |
| 231 | R | 65.8 | Low | 69.2 | Low | 139 Ų | 139 | 76.7 Ų | 76.7 | 53% | 0.525 | 36% | 0.355 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.1 | 114.9 | 176.1 | -165.9 | -177.6 | -160.4 | -92.2 | -3.9 | 109 | T131 K227 A228 Y229 | T131-R231 HydrophobicContact CG2-CB 4.47Å; T131-R231 HydrophobicContact CG2-CG 3.08Å; T131-R231 PolarHBondContact OG1-NH1 2.96Å; T131-R231 PolarHBondContact OG1-NH2 3.29Å; K227-R231 PolarHBondContact O-N 3Å; A228-R231 VanDerWaalsContact O-CB 3.3Å; A228-R231 WeakPolarHBondContact O-CB 3.31Å; Y229-R231 VanDerWaalsContact C-N 3.27Å; Y229-R231 PolarHBondContact O-N 2.89Å |
| 232 | V | 63.7 | Low | 68 | Low | 46 Ų | 46 | 74.4 Ų | 74.4 | 28% | 0.279 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.4 | 135.4 | 174.2 | 173.6 | 0 | 0 | 0 | 0 | 109.4 | K132 K134 N230 | K132-V232 PolarHBondContact N-O 3.4Å; K132-V232 VanDerWaalsContact N-O 3.13Å; K132-V232 PolarHBondContact O-N 2.96Å; K132-V232 VanDerWaalsContact O-N 3.11Å; K134-V232 HydrophobicContact CD-CG2 3.89Å; K134-V232 HydrophobicContact CG-CB 4.27Å; K134-V232 HydrophobicContact CG-CG2 3.37Å; N230-V232 PolarHBondContact O-N 2.94Å |
| 233 | I | 67.7 | Low | 66.8 | Low | 59 Ų | 59 | 79.7 Ų | 79.7 | 30% | 0.303 | 37% | 0.374 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.6 | 116.9 | 176.8 | -56 | 171.5 | 0 | 0 | 0 | 106.6 | M129 | M129-I233 HydrophobicContact CB-CG2 3.86Å; M129-I233 HydrophobicContact CG-CG2 3.75Å; M129-I233 HydrophobicContact SD-CG2 3.96Å |
| 234 | F | 71.1 | Confident | 66.1 | Low | 89 Ų | 89 | 81 Ų | 81 | 39% | 0.39 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.4 | 127.6 | 176.3 | -158.2 | -88.1 | 0 | 0 | 0 | 108.2 | Q105 M129 E130 | Q105-F234 HydrophobicContact CG-CD2 4.15Å; Q105-F234 HydrophobicContact CG-CE2 3.7Å; Q105-F234 HydrophobicContact CG-CZ 4.03Å; Q105-F234 VanDerWaalsContact NE2-CE1 3.28Å; Q105-F234 VanDerWaalsContact NE2-CZ 3.32Å; M129-F234 CarbonylContact C-O 3.55Å; E130-F234 PolarHBondContact N-O 2.9Å; E130-F234 PolarHBondContact O-N 3.43Å |
| 235 | V | 77.5 | Confident | 64.8 | Low | 2 Ų | 2 | 79.1 Ų | 79.1 | 1% | 0.012 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.3 | 130.5 | 174.9 | -174.9 | 0 | 0 | 0 | 0 | 108.5 | I91 P93 Q105 L108 I112 F127 I128 M129 | I91-V235 HydrophobicContact CD1-CB 4.23Å; P93-V235 HydrophobicContact CB-CG1 3.82Å; Q105-V235 PolarHBondContact NE2-O 3.29Å; L108-V235 HydrophobicContact CD2-CB 3.77Å; L108-V235 HydrophobicContact CD2-CG1 3.68Å; L108-V235 HydrophobicContact CD2-CG2 3.84Å; L108-V235 HydrophobicContact CG-CG2 4.46Å; I112-V235 HydrophobicContact CD1-CG2 3.89Å; F127-V235 HydrophobicContact CB-CG1 3.99Å; I128-V235 CarbonylContact O-C 3.56Å; I128-V235 WeakPolarHBondContact O-CA 3.29Å; M129-V235 HydrophobicContact CG-CG2 4.02Å |
| 236 | Q | 78.8 | Confident | 63.8 | Low | 66 Ų | 66 | 76.8 Ų | 76.8 | 31% | 0.308 | 38% | 0.381 | S | S | . | . | P | Polyproline II helix | trans | -89.2 | 160.5 | 175.5 | -79.7 | -168.4 | -16.3 | 0 | 0 | 112.2 | I128 E130 | I128-Q236 HydrophobicContact CB-CB 4.12Å; I128-Q236 HydrophobicContact CG2-CB 3.99Å; I128-Q236 PolarHBondContact O-N 2.89Å; E130-Q236 VanDerWaalsContact CD-CD 3.42Å; E130-Q236 HydrophobicContact CG-CG 4.08Å; E130-Q236 PolarHBondContact OE1-NE2 2.9Å; E130-Q236 PolarHBondContact OE2-NE2 3.42Å |
| 237 | N | 80.6 | Confident | 63 | Low | 69 Ų | 69 | 81.7 Ų | 81.7 | 37% | 0.369 | 40% | 0.403 | S | S | . | . | P | Polyproline II helix | trans | -64.9 | 141.5 | 167.6 | -68.6 | -33 | 0 | 0 | 0 | 110.7 | I91 T92 | I91-N237 VanDerWaalsContact CA-OD1 3.24Å; I91-N237 WeakPolarHBondContact CA-OD1 3.38Å; I91-N237 WeakPolarHBondContact CB-OD1 3.4Å; T92-N237 PolarHBondContact N-OD1 3.27Å; T92-N237 WeakPolarHBondContact O-CA 3.49Å; T92-N237 PolarHBondContact OG1-OD1 3.42Å |
| 238 | C | 76.1 | Confident | 62.1 | Low | 1 Ų | 1 | 84.5 Ų | 84.5 | 1% | 0.007 | 42% | 0.415 | C | S | . | . | P | Polyproline II helix | trans | -65.3 | 144.1 | 169.1 | 68.3 | 0 | 0 | 0 | 0 | 110.2 | T92 C94 Y125 D240 T241 | T92-C238 PolarHBondContact O-N 3.44Å; C94-C238 PolarHBondContact O-SG 3.43Å; Y125-C238 HydrophobicContact CE1-CB 3.9Å; C238-D240 PolarHBondContact O-N 2.91Å; C238-D240 VanDerWaalsContact O-N 3.16Å; C238-T241 PolarHBondContact O-N 3.29Å; C238-T241 PolarHBondContact O-OG1 3.03Å |
| 239 | P | 64.9 | Low | 60.9 | Low | 68 Ų | 68 | 87.8 Ų | 87.8 | 44% | 0.442 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.4 | -20.9 | -171.1 | 21.5 | -32.4 | 0 | 0 | 0 | 114.8 | T241 | P239-T241 VanDerWaalsContact C-N 3.25Å; P239-T241 PolarHBondContact O-N 2.91Å |
| 240 | D | 60 | Low | 59.7 | Low | 89 Ų | 89 | 87.6 Ų | 87.6 | 48% | 0.476 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -73.4 | -16.1 | -178.6 | -58 | -48.2 | 0 | 0 | 0 | 113.5 | R95 C238 | R95-D240 IonicContact CZ-OD2 3.24Å; R95-D240 IonicContact NE-OD2 2.81Å; R95-D240 IonicContact NH1-OD2 2.59Å; R95-D240 PolarHBondContact NH1-OD2 2.82Å; R95-D240 IonicContact NH2-OD2 2.86Å; R95-D240 PolarHBondContact NH2-OD2 3.28Å; C238-D240 PolarHBondContact O-N 2.91Å; C238-D240 VanDerWaalsContact O-N 3.16Å |
| 241 | T | 56.9 | Low | 58.9 | Low | 23 Ų | 23 | 91.9 Ų | 91.9 | 14% | 0.141 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -96.8 | -26.1 | 179 | 51.8 | 0 | 0 | 0 | 0 | 113.4 | T92 C238 P239 K244 M245 | T92-T241 HydrophobicContact CG2-CG2 4.22Å; T92-T241 WeakPolarHBondContact OG1-CB 3.33Å; T92-T241 PolarHBondContact OG1-OG1 3.38Å; C238-T241 PolarHBondContact O-N 3.29Å; C238-T241 PolarHBondContact O-OG1 3.03Å; P239-T241 VanDerWaalsContact C-N 3.25Å; P239-T241 PolarHBondContact O-N 2.91Å; T241-K244 PolarHBondContact O-N 3.16Å; T241-M245 PolarHBondContact O-N 3.36Å |
| 242 | A | 53 | Low | 57.6 | Low | 48 Ų | 48 | 88.5 Ų | 88.5 | 40% | 0.397 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.5 | -44.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | K244 M245 E246 | A242-K244 VanDerWaalsContact C-N 3.27Å; A242-K244 PolarHBondContact O-N 3.07Å; A242-M245 PolarHBondContact O-N 3.19Å; A242-E246 PolarHBondContact O-N 3.44Å |
| 243 | K | 49.3 | Very low | 56.3 | Low | 153 Ų | 153 | 92.3 Ų | 92.3 | 67% | 0.665 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61 | -34.4 | 179.9 | -64.9 | -173.5 | 176.7 | -177.1 | 0 | 113.1 | E247 | K243-E247 PolarHBondContact O-N 3.42Å |
| 244 | K | 51.5 | Low | 55.2 | Low | 154 Ų | 154 | 98.2 Ų | 98.2 | 67% | 0.67 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -77.7 | -22.4 | -177.3 | -154.1 | 175.5 | -173.8 | 178.7 | 0 | 113.2 | T241 A242 K248 | T241-K244 PolarHBondContact O-N 3.16Å; A242-K244 VanDerWaalsContact C-N 3.27Å; A242-K244 PolarHBondContact O-N 3.07Å; K244-K248 PolarHBondContact O-N 2.99Å |
| 245 | M | 50.6 | Low | 53.6 | Low | 141 Ų | 141 | 102.1 Ų | 102.1 | 70% | 0.695 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -83 | -34.1 | 177.9 | -159.1 | 164.8 | 167.1 | 0 | 0 | 111.2 | T241 A242 K248 N249 | T241-M245 PolarHBondContact O-N 3.36Å; A242-M245 PolarHBondContact O-N 3.19Å; M245-K248 PolarHBondContact O-N 3.47Å; M245-N249 PolarHBondContact O-N 2.68Å |
| 246 | E | 49.3 | Very low | 51.6 | Low | 143 Ų | 143 | 107 Ų | 107 | 67% | 0.668 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -68.5 | -41.2 | 172.5 | -71.6 | -179.4 | 138.7 | 0 | 0 | 112.7 | A242 K248 N249 S250 | A242-E246 PolarHBondContact O-N 3.44Å; E246-K248 VanDerWaalsContact C-N 3.31Å; E246-K248 PolarHBondContact O-N 2.93Å; E246-N249 PolarHBondContact O-N 3.01Å; E246-S250 PolarHBondContact O-N 3.33Å |
| 247 | E | 48.7 | Very low | 49.4 | Very low | 139 Ų | 139 | 111.8 Ų | 111.8 | 65% | 0.65 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -64.6 | -33.7 | 175.1 | -82.4 | -179.2 | 141.2 | 0 | 0 | 113 | K243 S250 S251 | K243-E247 PolarHBondContact O-N 3.42Å; E247-S250 PolarHBondContact O-N 3.31Å; E247-S251 PolarHBondContact O-N 3.17Å; E247-S251 PolarHBondContact O-OG 2.92Å |
| 248 | K | 47.2 | Very low | 47.7 | Very low | 165 Ų | 165 | 114.7 Ų | 114.7 | 72% | 0.717 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -75.2 | -28.1 | 179.2 | -144.1 | 177.7 | -176.8 | -171 | 0 | 112.5 | K244 M245 E246 S251 | K244-K248 PolarHBondContact O-N 2.99Å; M245-K248 PolarHBondContact O-N 3.47Å; E246-K248 VanDerWaalsContact C-N 3.31Å; E246-K248 PolarHBondContact O-N 2.93Å; K248-S251 PolarHBondContact O-OG 3.12Å |
| 249 | N | 40.9 | Very low | 45.7 | Very low | 136 Ų | 136 | 124.2 Ų | 124.2 | 73% | 0.727 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -77.4 | -21.8 | 172.5 | -85.1 | 10.7 | 0 | 0 | 0 | 113.5 | M245 E246 | M245-N249 PolarHBondContact O-N 2.68Å; E246-N249 PolarHBondContact O-N 3.01Å |
| 250 | S | 38.9 | Very low | 44.2 | Very low | 108 Ų | 108 | 128 Ų | 128 | 76% | 0.755 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -85.6 | -20.3 | 174 | -79.9 | 0 | 0 | 0 | 0 | 114.5 | E246 E247 | E246-S250 PolarHBondContact O-N 3.33Å; E247-S250 PolarHBondContact O-N 3.31Å |
| 251 | S | 44.5 | Very low | 42.8 | Very low | 92 Ų | 92 | 128.6 Ų | 128.6 | 64% | 0.643 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -95 | 2.8 | -174.8 | 44.8 | 0 | 0 | 0 | 0 | 114.8 | E247 K248 | E247-S251 PolarHBondContact O-N 3.17Å; E247-S251 PolarHBondContact O-OG 2.92Å; K248-S251 PolarHBondContact O-OG 3.12Å |
| 252 | G | 38.5 | Very low | 41.9 | Very low | 67 Ų | 67 | 134.2 Ų | 134.2 | 69% | 0.691 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -91.7 | 1.7 | -175.1 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||
| 253 | T | 37.3 | Very low | 40.9 | Very low | 127 Ų | 127 | 138.2 Ų | 138.2 | 78% | 0.779 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -123.5 | 55.1 | -176 | -45.1 | 0 | 0 | 0 | 0 | 112.7 | ||
| 254 | Q | 43.6 | Very low | 40.1 | Very low | 183 Ų | 183 | 137.2 Ų | 137.2 | 86% | 0.855 | 77% | 0.768 | S | S | * | * | trans | -155.6 | 95.9 | 153.1 | -69.1 | -161.8 | 1.4 | 0 | 0 | 109.6 | ||||
| 255 | N | 38.1 | Very low | 39.5 | Very low | 170 Ų | 170 | 134.8 Ų | 134.8 | 91% | 0.909 | 77% | 0.768 | S | S | * | * | trans | -175.7 | 98.5 | 137.1 | -102.8 | -10.7 | 0 | 0 | 0 | 112 | ||||
| 256 | S | 35.6 | Very low | 38.5 | Very low | 106 Ų | 106 | 135.4 Ų | 135.4 | 74% | 0.741 | 77% | 0.773 | S | S | * | * | trans | -172.5 | 100.9 | 148.2 | 47 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 257 | D | 32.5 | Very low | 37.7 | Very low | 165 Ų | 165 | 132.7 Ų | 132.7 | 88% | 0.882 | 77% | 0.774 | S | S | * | * | 177.6 | 126.3 | 120.3 | -92.4 | -47 | 0 | 0 | 0 | 111.2 | |||||
| 258 | V | 44.2 | Very low | 36.9 | Very low | 130 Ų | 130 | 135.6 Ų | 135.6 | 79% | 0.788 | 79% | 0.788 | S | S | * | * | trans | -79.8 | 131.3 | 170.6 | 169.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 259 | K | 33.9 | Very low | 36.1 | Very low | 202 Ų | 202 | 134.6 Ų | 134.6 | 88% | 0.878 | 80% | 0.796 | S | S | * | * | trans | -154.1 | 126.4 | 146.5 | -137.4 | 171.9 | -176.8 | 175.5 | 0 | 113.2 | ||||
| 260 | D | 33.4 | Very low | 35.6 | Very low | 148 Ų | 148 | 131.7 Ų | 131.7 | 79% | 0.791 | 80% | 0.798 | S | S | * | * | trans | -52 | 139.3 | 172.9 | -64.4 | -81.3 | 0 | 0 | 0 | 114.3 | ||||
| 261 | A | 29.9 | Very low | 35.2 | Very low | 101 Ų | 101 | 132.3 Ų | 132.3 | 84% | 0.835 | 80% | 0.798 | S | S | * | * | trans | -162.3 | 112.4 | 140.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 262 | V | 38.3 | Very low | 34.5 | Very low | 141 Ų | 141 | 134.9 Ų | 134.9 | 86% | 0.855 | 80% | 0.804 | S | S | * | * | trans | -64.9 | 123.3 | 168.9 | 166.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 263 | V | 32.1 | Very low | 34.2 | Very low | 132 Ų | 132 | 136.5 Ų | 136.5 | 80% | 0.8 | 81% | 0.805 | S | S | * | * | trans | -155.9 | 126 | 142.5 | -178.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 264 | V | 33 | Very low | 33.9 | Very low | 132 Ų | 132 | 138.7 Ų | 138.7 | 80% | 0.8 | 81% | 0.806 | S | S | * | * | trans | -116.3 | 134.6 | 162.1 | 170 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 265 | P | 39.5 | Very low | 33.4 | Very low | 102 Ų | 102 | 137.5 Ų | 137.5 | 66% | 0.662 | 81% | 0.805 | S | S | * | * | -152.8 | 143.3 | 92.7 | 33.9 | -11 | 0 | 0 | 0 | 119.2 | |||||
| 266 | I | 29.7 | Very low | 33.2 | Very low | 155 Ų | 155 | 133.4 Ų | 133.4 | 80% | 0.795 | 80% | 0.795 | S | S | * | * | 71 | 112.6 | 129.8 | -59.9 | 169.5 | 0 | 0 | 0 | 121.3 | |||||
| 267 | A | 32 | Very low | 33.1 | Very low | 85 Ų | 85 | 133 Ų | 133 | 70% | 0.702 | 80% | 0.798 | S | S | * | * | trans | 38.1 | 132 | 134.6 | 0 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 268 | Q | 31.2 | Very low | 33.2 | Very low | 200 Ų | 200 | 134.8 Ų | 134.8 | 94% | 0.935 | 80% | 0.801 | S | S | * | * | -165.4 | 139.9 | 114.2 | -102.9 | 172.2 | 11.8 | 0 | 0 | 113.5 | |||||
| 269 | T | 30.1 | Very low | 32.7 | Very low | 144 Ų | 144 | 136.9 Ų | 136.9 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | trans | -86.3 | 147.3 | 175.2 | -39 | 0 | 0 | 0 | 0 | 110 | ||||
| 270 | G | 31 | Very low | 32.6 | Very low | 76 Ų | 76 | 136 Ų | 136 | 78% | 0.784 | 80% | 0.803 | S | S | * | * | trans | 177.5 | 134.4 | 166.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 271 | T | 30.4 | Very low | 32.5 | Very low | 121 Ų | 121 | 133.5 Ų | 133.5 | 74% | 0.742 | 79% | 0.794 | S | S | * | * | trans | -114.2 | 161.8 | -155.9 | -38.4 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 272 | N | 30.2 | Very low | 32.7 | Very low | 145 Ų | 145 | 133.7 Ų | 133.7 | 78% | 0.775 | 79% | 0.789 | S | S | * | * | trans | 72.4 | 143.5 | 155.5 | -84.7 | -4.3 | 0 | 0 | 0 | 118.3 | ||||
| 273 | S | 32.1 | Very low | 32.7 | Very low | 102 Ų | 102 | 135.6 Ų | 135.6 | 71% | 0.713 | 79% | 0.788 | S | S | * | * | cis | -156 | 137.6 | 33.6 | -56.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 274 | Q | 31.1 | Very low | 32.9 | Very low | 172 Ų | 172 | 135.7 Ų | 135.7 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | 62.7 | 119.5 | 82.4 | -154.6 | 176.3 | 1.4 | 0 | 0 | 116.4 | |||||
| 275 | L | 32.7 | Very low | 33.3 | Very low | 158 Ų | 158 | 137.3 Ų | 137.3 | 83% | 0.827 | 79% | 0.79 | S | S | * | * | trans | 164.7 | 105.2 | 136 | -86.3 | 160.3 | 0 | 0 | 0 | 108.3 | ||||
| 276 | A | 33.1 | Very low | 34.2 | Very low | 84 Ų | 84 | 137.3 Ų | 137.3 | 69% | 0.694 | 79% | 0.79 | S | S | * | * | 60.3 | 97.1 | 90.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 277 | A | 34.7 | Very low | 35.1 | Very low | 97 Ų | 97 | 140.3 Ų | 140.3 | 80% | 0.802 | 82% | 0.815 | S | S | * | * | 62.7 | 111.2 | 88.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 278 | E | 34.7 | Very low | 35.3 | Very low | 204 Ų | 204 | 143.1 Ų | 143.1 | 95% | 0.953 | 82% | 0.82 | S | S | * | * | -158.1 | 136.5 | 129.3 | -108.6 | 179.7 | 155.7 | 0 | 0 | 111.5 | |||||
| 279 | E | 32.9 | Very low | 35.5 | Very low | 174 Ų | 174 | 140.1 Ų | 140.1 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | trans | -88.4 | 140.1 | -178.2 | 176.3 | -166.6 | 142.6 | 0 | 0 | 108.6 | ||||
| 280 | M | 32 | Very low | 35.8 | Very low | 182 Ų | 182 | 139.9 Ų | 139.9 | 90% | 0.897 | 81% | 0.811 | S | S | * | * | trans | -161 | 156.6 | 142.2 | -155.7 | 159.8 | 179.2 | 0 | 0 | 111.5 | ||||
| 281 | T | 32.4 | Very low | 36.1 | Very low | 97 Ų | 97 | 143.6 Ų | 143.6 | 60% | 0.595 | 81% | 0.812 | S | S | * | * | trans | -111 | -176.8 | -143.1 | 41.2 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 282 | S | 33.5 | Very low | 36.4 | Very low | 104 Ų | 104 | 145.1 Ų | 145.1 | 73% | 0.727 | 82% | 0.816 | S | S | * | * | trans | 87.8 | 104.7 | 161 | -68.1 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 283 | E | 38.3 | Very low | 36.8 | Very low | 182 Ų | 182 | 145.1 Ų | 145.1 | 85% | 0.85 | 82% | 0.819 | S | S | * | * | 66.5 | 122.2 | 60.3 | -154.3 | -169.6 | 151.1 | 0 | 0 | 112.7 | |||||
| 284 | V | 37.1 | Very low | 37.2 | Very low | 133 Ų | 133 | 148.1 Ų | 148.1 | 81% | 0.806 | 83% | 0.827 | S | S | * | * | trans | 163.1 | 119.1 | 131.9 | 162.4 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 285 | M | 40.5 | Very low | 37.7 | Very low | 167 Ų | 167 | 146.3 Ų | 146.3 | 82% | 0.823 | 83% | 0.829 | S | S | * | * | trans | -100.9 | -179.4 | 151.7 | -83.4 | -172.1 | 79.7 | 0 | 0 | 107.4 | ||||
| 286 | P | 57.8 | Low | 38.1 | Very low | 102 Ų | 102 | 145.3 Ų | 145.3 | 66% | 0.662 | 83% | 0.829 | S | S | * | * | cis | -131.8 | -179.4 | -28.7 | 26.2 | -4.5 | 0 | 0 | 0 | 112.3 | ||||
| 287 | V | 49.8 | Very low | 38.5 | Very low | 218 Ų | 218 | 150.9 Ų | 150.9 | 100% | 1.321 | 84% | 0.841 | S | S | * | * | trans | -136.9 | 0 | 139.8 | 179.3 | 0 | 0 | 0 | 0 | 107.9 |
Retrieved 287 of 287 residues in 1360.7 ms
(Link to these results)