| 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 | 42.7 | Very low | 39.8 | Very low | 222 Ų | 222 | 132.6 Ų | 132.6 | 100% | 1.094 | 64% | 0.644 | S | S | * | * | 0 | -43.9 | 0 | -79 | -154.2 | -105.5 | 0 | 0 | 113.3 | V3 | M1-V3 PolarHBondContact O-N 3.4Š| |||
| 2 | E | 32 | Very low | 39.8 | Very low | 180 Ų | 180 | 128.1 Ų | 128.1 | 84% | 0.841 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -72 | -22.2 | 178.9 | -77.1 | 179.7 | 146.4 | 0 | 0 | 115.3 | ||
| 3 | V | 35.8 | Very low | 39.3 | Very low | 126 Ų | 126 | 122.8 Ų | 122.8 | 76% | 0.764 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -81.2 | -33.6 | -177.6 | -175 | 0 | 0 | 0 | 0 | 112.9 | M1 H6 | M1-V3 PolarHBondContact O-N 3.4Å; V3-H6 PolarHBondContact O-N 2.84Å |
| 4 | K | 36.8 | Very low | 38.9 | Very low | 86 Ų | 86 | 122.3 Ų | 122.3 | 37% | 0.374 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -69.1 | -33.4 | 174.6 | -79.7 | -161.3 | -179.5 | -162.5 | 0 | 111.9 | H6 R7 L298 D301 E332 | K4-H6 VanDerWaalsContact C-N 3.25Å; K4-H6 PolarHBondContact O-N 2.74Å; K4-R7 PolarHBondContact O-N 3.4Å; K4-L298 PolarHBondContact NZ-O 3.49Å; K4-D301 IonicContact NZ-OD1 2.66Å; K4-D301 PolarHBondContact NZ-OD1 2.99Å; K4-E332 WeakPolarHBondContact CE-OE1 3.35Å; K4-E332 IonicContact NZ-OE1 2.86Å; K4-E332 PolarHBondContact NZ-OE1 3.37Å |
| 5 | L | 42 | Very low | 38.8 | Very low | 116 Ų | 116 | 125.1 Ų | 125.1 | 61% | 0.607 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -66.3 | -25.9 | 177.7 | -148.4 | 83.2 | 0 | 0 | 0 | 113.4 | L8 | L5-L8 HydrophobicContact CD1-CD1 4.23Å |
| 6 | H | 37.3 | Very low | 38.2 | Very low | 132 Ų | 132 | 127.3 Ų | 127.3 | 61% | 0.611 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -80.2 | -20.8 | -178.7 | -146.3 | -64.7 | 0 | 0 | 0 | 113.1 | V3 K4 | V3-H6 PolarHBondContact O-N 2.84Å; K4-H6 VanDerWaalsContact C-N 3.25Å; K4-H6 PolarHBondContact O-N 2.74Å |
| 7 | R | 40.5 | Very low | 37.4 | Very low | 138 Ų | 138 | 127 Ų | 127 | 52% | 0.521 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -77.2 | -34.4 | 169.7 | -100.4 | -176.3 | 169.6 | -147.2 | -2.2 | 111.9 | K4 L9 L10 E329 | K4-R7 PolarHBondContact O-N 3.4Å; R7-L9 VanDerWaalsContact C-N 3.3Å; R7-L9 PolarHBondContact O-N 2.86Å; R7-L10 PolarHBondContact O-N 3.04Å; R7-E329 IonicContact CZ-OE1 3.3Å; R7-E329 VanDerWaalsContact CZ-OE1 3.3Å; R7-E329 IonicContact NH1-OE1 2.68Å; R7-E329 PolarHBondContact NH1-OE1 2.88Å; R7-E329 IonicContact NH2-OE1 2.95Å; R7-E329 PolarHBondContact NH2-OE1 3.46Å |
| 8 | L | 44.8 | Very low | 36.9 | Very low | 55 Ų | 55 | 126 Ų | 126 | 29% | 0.288 | 69% | 0.689 | S | S | . | * | H | α-helix | trans | -61.5 | -32.4 | 176.4 | -79.3 | 162.6 | 0 | 0 | 0 | 113.7 | L5 M340 | L5-L8 HydrophobicContact CD1-CD1 4.23Å; L8-M340 HydrophobicContact CD2-SD 4.25Å |
| 9 | L | 41.9 | Very low | 36.5 | Very low | 127 Ų | 127 | 132.2 Ų | 132.2 | 67% | 0.665 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -80.6 | -18.4 | 179.3 | -77.4 | 168.1 | 0 | 0 | 0 | 114.2 | R7 | R7-L9 VanDerWaalsContact C-N 3.3Å; R7-L9 PolarHBondContact O-N 2.86Å |
| 10 | L | 43.7 | Very low | 35.9 | Very low | 122 Ų | 122 | 135.4 Ų | 135.4 | 64% | 0.639 | 71% | 0.714 | S | S | * | * | H | α-helix | trans | -85.5 | -29.2 | -177 | -77.8 | 165.8 | 0 | 0 | 0 | 112.9 | R7 | R7-L10 PolarHBondContact O-N 3.04Å |
| 11 | F | 40 | Very low | 35.4 | Very low | 155 Ų | 155 | 134.4 Ų | 134.4 | 68% | 0.68 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -82.7 | -24.8 | 176.2 | -84 | -79.7 | 0 | 0 | 0 | 114 | G13 | F11-G13 PolarHBondContact O-N 3.01Å |
| 12 | A | 40 | Very low | 34.6 | Very low | 78 Ų | 78 | 129.3 Ų | 129.3 | 65% | 0.645 | 71% | 0.705 | S | S | * | * | G | 310 helix | trans | -72.1 | -11.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 13 | G | 33.5 | Very low | 34.4 | Very low | 60 Ų | 60 | 127.5 Ų | 127.5 | 62% | 0.619 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -81.4 | -6.2 | -173.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | F11 | F11-G13 PolarHBondContact O-N 3.01Š|
| 14 | C | 33.5 | Very low | 33.9 | Very low | 115 Ų | 115 | 132.4 Ų | 132.4 | 78% | 0.777 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -114.1 | 9.9 | -169.5 | -75.9 | 0 | 0 | 0 | 0 | 116.1 | ||
| 15 | M | 37.4 | Very low | 33.3 | Very low | 165 Ų | 165 | 138.3 Ų | 138.3 | 81% | 0.813 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -135.9 | 74.6 | 169.7 | -71.8 | -164.7 | 71.5 | 0 | 0 | 111.7 | ||
| 16 | N | 28.8 | Very low | 32.5 | Very low | 159 Ų | 159 | 143.5 Ų | 143.5 | 85% | 0.85 | 75% | 0.748 | S | S | * | * | trans | 159.9 | 95.3 | 136.8 | -85.9 | -27.5 | 0 | 0 | 0 | 110.2 | ||||
| 17 | S | 24.8 | Very low | 31.9 | Very low | 123 Ų | 123 | 143.2 Ų | 143.2 | 86% | 0.86 | 76% | 0.755 | S | S | * | * | trans | -88.9 | 100.3 | 163 | -177 | 0 | 0 | 0 | 0 | 109 | ||||
| 18 | S | 29.1 | Very low | 31.2 | Very low | 109 Ų | 109 | 145.9 Ų | 145.9 | 76% | 0.762 | 77% | 0.771 | S | S | * | * | trans | -159.9 | 120.1 | 141.5 | -10.5 | 0 | 0 | 0 | 0 | 112 | ||||
| 19 | R | 28.2 | Very low | 30 | Very low | 244 Ų | 244 | 147.7 Ų | 147.7 | 92% | 0.921 | 79% | 0.789 | S | S | * | * | trans | 79.5 | 87.8 | 161.9 | -69 | -177.8 | 175.7 | 177.9 | -0.1 | 118.8 | ||||
| 20 | M | 25.5 | Very low | 29.2 | Very low | 195 Ų | 195 | 146.8 Ų | 146.8 | 96% | 0.961 | 79% | 0.793 | S | S | * | * | trans | -51 | 132.7 | 145 | -99.5 | 147.1 | 54.3 | 0 | 0 | 112.8 | ||||
| 21 | S | 25.9 | Very low | 28.2 | Very low | 116 Ų | 116 | 150.3 Ų | 150.3 | 81% | 0.811 | 80% | 0.803 | S | S | * | * | trans | -138.8 | 114.9 | 142.5 | 63.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 22 | S | 26.1 | Very low | 27.3 | Very low | 114 Ų | 114 | 147.9 Ų | 147.9 | 80% | 0.797 | 81% | 0.805 | S | S | * | * | trans | -69.2 | 130.2 | -179.6 | 177.3 | 0 | 0 | 0 | 0 | 112 | ||||
| 23 | V | 26.7 | Very low | 26.7 | Very low | 142 Ų | 142 | 149.4 Ų | 149.4 | 86% | 0.861 | 81% | 0.81 | S | S | * | * | trans | -133.3 | 116.7 | 156.8 | -178 | 0 | 0 | 0 | 0 | 110 | ||||
| 24 | R | 25.2 | Very low | 27.1 | Very low | 229 Ų | 229 | 151.9 Ų | 151.9 | 86% | 0.864 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 116.5 | -172 | -160.5 | 178.6 | -164.9 | -176.7 | 4 | 110.9 | ||
| 25 | K | 25.1 | Very low | 26.7 | Very low | 210 Ų | 210 | 156.7 Ų | 156.7 | 91% | 0.913 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -81.1 | 120.9 | 166.3 | -88.6 | -177.6 | 178.7 | 175.4 | 0 | 109.6 | ||
| 26 | R | 24.8 | Very low | 26.1 | Very low | 225 Ų | 225 | 152.5 Ų | 152.5 | 85% | 0.849 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 120.6 | -179.7 | -145.8 | -178 | -68.1 | -174.5 | -0.6 | 107.9 | ||
| 27 | V | 25 | Very low | 25.9 | Very low | 127 Ų | 127 | 148.4 Ų | 148.4 | 77% | 0.77 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 133.1 | 167.3 | 173.4 | 0 | 0 | 0 | 0 | 108.2 | ||
| 28 | F | 24.5 | Very low | 25.9 | Very low | 193 Ų | 193 | 148.8 Ų | 148.8 | 85% | 0.846 | 82% | 0.821 | S | S | * | * | trans | -143.5 | 128.5 | 155.2 | -106.6 | -81.1 | 0 | 0 | 0 | 109.5 | ||||
| 29 | S | 21.3 | Very low | 25.8 | Very low | 94 Ų | 94 | 152 Ų | 152 | 66% | 0.657 | 82% | 0.824 | S | S | * | * | trans | -103.4 | 170.7 | 177.7 | 49.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 30 | S | 23.1 | Very low | 25.7 | Very low | 108 Ų | 108 | 147 Ų | 147 | 76% | 0.755 | 82% | 0.821 | S | S | * | * | trans | 84.6 | 146.8 | 166.3 | 97.9 | 0 | 0 | 0 | 0 | 116 | ||||
| 31 | F | 22.9 | Very low | 25.7 | Very low | 195 Ų | 195 | 143.9 Ų | 143.9 | 86% | 0.855 | 81% | 0.807 | S | S | * | * | cis | -173.7 | 177.2 | -3.7 | -134.8 | -106.8 | 0 | 0 | 0 | 106.8 | ||||
| 32 | C | 22.9 | Very low | 25.6 | Very low | 105 Ų | 105 | 146.6 Ų | 146.6 | 71% | 0.709 | 81% | 0.811 | S | S | * | * | trans | 101.1 | 92.9 | 157.5 | -70.2 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 33 | S | 25.6 | Very low | 25.5 | Very low | 110 Ų | 110 | 146.1 Ų | 146.1 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | 41.2 | 152.7 | 120.6 | 44.9 | 0 | 0 | 0 | 0 | 125.4 | |||||
| 34 | P | 42.2 | Very low | 25.4 | Very low | 112 Ų | 112 | 147.2 Ų | 147.2 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | trans | -104.8 | 168.5 | -173.3 | 41.5 | -32.5 | 0 | 0 | 0 | 114.1 | ||||
| 35 | F | 25.5 | Very low | 25.4 | Very low | 215 Ų | 215 | 143.2 Ų | 143.2 | 94% | 0.943 | 79% | 0.788 | S | S | * | * | trans | -178.9 | 140.3 | 144.6 | -120.8 | -89.1 | 0 | 0 | 0 | 114.5 | ||||
| 36 | G | 24.7 | Very low | 25.4 | Very low | 77 Ų | 77 | 136.5 Ų | 136.5 | 79% | 0.794 | 78% | 0.779 | S | S | * | * | trans | 73.6 | 129.6 | 151.3 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 37 | G | 24.4 | Very low | 26.2 | Very low | 74 Ų | 74 | 131.6 Ų | 131.6 | 76% | 0.763 | 78% | 0.776 | S | S | * | * | cis | 118.8 | 105.7 | 13.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 38 | S | 25.8 | Very low | 26.2 | Very low | 131 Ų | 131 | 132 Ų | 132 | 92% | 0.916 | 78% | 0.779 | S | S | * | * | trans | -179.9 | 148.1 | 139.5 | -86.9 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 39 | Q | 26.6 | Very low | 26.2 | Very low | 175 Ų | 175 | 128.4 Ų | 128.4 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | trans | -80.2 | 165.8 | -161.6 | -60.6 | 160.1 | -12.6 | 0 | 0 | 113.9 | ||||
| 40 | T | 25.6 | Very low | 26.4 | Very low | 141 Ų | 141 | 129.2 Ų | 129.2 | 87% | 0.865 | 77% | 0.774 | S | S | * | * | -169 | 124.9 | 108.2 | -61.2 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 41 | L | 24.8 | Very low | 26.5 | Very low | 128 Ų | 128 | 132.1 Ų | 132.1 | 67% | 0.67 | 78% | 0.775 | S | S | * | * | trans | -73.6 | 152 | 170.7 | -79.8 | 100.8 | 0 | 0 | 0 | 111.8 | L43 | L41-L43 HydrophobicContact CD2-CD1 3.51Š| ||
| 42 | I | 25.2 | Very low | 26.6 | Very low | 173 Ų | 173 | 131.4 Ų | 131.4 | 89% | 0.887 | 78% | 0.775 | S | S | * | * | -141.3 | 125.3 | 128.9 | -62.6 | -170.3 | 0 | 0 | 0 | 109.5 | |||||
| 43 | L | 24.1 | Very low | 26.7 | Very low | 105 Ų | 105 | 134.3 Ų | 134.3 | 55% | 0.55 | 78% | 0.782 | S | S | . | * | trans | -72.8 | 153.1 | 170.9 | -91 | 92.4 | 0 | 0 | 0 | 112.2 | L41 | L41-L43 HydrophobicContact CD2-CD1 3.51Š| ||
| 44 | F | 25 | Very low | 26.6 | Very low | 164 Ų | 164 | 139.3 Ų | 139.3 | 72% | 0.719 | 78% | 0.784 | S | S | * | * | 170.8 | 141.6 | 93.7 | -105.1 | -69 | 0 | 0 | 0 | 114.1 | |||||
| 45 | N | 24.7 | Very low | 25.7 | Very low | 145 Ų | 145 | 143.3 Ų | 143.3 | 78% | 0.775 | 79% | 0.793 | S | S | * | * | trans | 59.4 | 129.6 | 150.1 | -66.1 | -26.3 | 0 | 0 | 0 | 118.5 | ||||
| 46 | G | 25.6 | Very low | 25.6 | Very low | 70 Ų | 70 | 138 Ų | 138 | 72% | 0.722 | 79% | 0.789 | S | S | * | * | cis | 131.1 | 150.6 | 32.2 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 47 | P | 41.4 | Very low | 25.5 | Very low | 122 Ų | 122 | 138.1 Ų | 138.1 | 79% | 0.792 | 79% | 0.79 | S | S | * | * | trans | -113 | 173.8 | -137.6 | 39 | -30.2 | 0 | 0 | 0 | 114.8 | ||||
| 48 | T | 25 | Very low | 25.5 | Very low | 135 Ų | 135 | 139.9 Ų | 139.9 | 83% | 0.828 | 79% | 0.79 | S | S | * | * | trans | -174.3 | 110.1 | 149.4 | 16.3 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 49 | V | 25 | Very low | 25.4 | Very low | 118 Ų | 118 | 144.5 Ų | 144.5 | 72% | 0.715 | 79% | 0.788 | S | S | * | * | 84.3 | 104.3 | 78.3 | 171.2 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 50 | T | 24 | Very low | 25.2 | Very low | 110 Ų | 110 | 145.8 Ų | 145.8 | 68% | 0.675 | 79% | 0.791 | S | S | * | * | trans | 40 | 130.5 | 138.7 | 68.1 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 51 | H | 26.1 | Very low | 25.1 | Very low | 170 Ų | 170 | 143.2 Ų | 143.2 | 79% | 0.787 | 78% | 0.784 | S | S | * | * | -170.8 | 130 | 100 | -115.2 | -87.1 | 0 | 0 | 0 | 112.3 | |||||
| 52 | Q | 24.7 | Very low | 25 | Very low | 180 Ų | 180 | 142.2 Ų | 142.2 | 84% | 0.841 | 79% | 0.787 | S | S | * | * | trans | -80.7 | 148.2 | 155.5 | -78.3 | -164.6 | -7.5 | 0 | 0 | 109.2 | ||||
| 53 | L | 24.8 | Very low | 24.9 | Very low | 165 Ų | 165 | 141.6 Ų | 141.6 | 86% | 0.864 | 79% | 0.785 | S | S | * | * | trans | -159.1 | 154.3 | 132.9 | -116.1 | 135 | 0 | 0 | 0 | 112.8 | ||||
| 54 | R | 22.7 | Very low | 24.9 | Very low | 216 Ų | 216 | 143.7 Ų | 143.7 | 82% | 0.815 | 80% | 0.796 | S | S | * | * | trans | -108.9 | 142.9 | -159.8 | 175.4 | -171.1 | -169.1 | 179 | 3.6 | 107.9 | ||||
| 55 | Q | 23.8 | Very low | 24.8 | Very low | 196 Ų | 196 | 140.9 Ų | 140.9 | 92% | 0.916 | 80% | 0.797 | S | S | * | * | 175 | 150.9 | 129.5 | -100 | 177.8 | 2.6 | 0 | 0 | 114.2 | |||||
| 56 | A | 23.7 | Very low | 24.7 | Very low | 104 Ų | 104 | 145 Ų | 145 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | trans | -89.7 | 165.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 57 | G | 23.2 | Very low | 24.5 | Very low | 79 Ų | 79 | 146.6 Ų | 146.6 | 81% | 0.814 | 80% | 0.802 | S | S | * | * | trans | 152.7 | 93.6 | 154.9 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 58 | S | 24 | Very low | 23.7 | Very low | 110 Ų | 110 | 151 Ų | 151 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | trans | -8.1 | 137.3 | 149 | -167.4 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 59 | R | 23.3 | Very low | 23.6 | Very low | 229 Ų | 229 | 147.7 Ų | 147.7 | 86% | 0.864 | 80% | 0.796 | S | S | * | * | 164.1 | 128.5 | 108.8 | -86.8 | -178.8 | -175.6 | -176.4 | 1.8 | 114.7 | |||||
| 60 | K | 23.4 | Very low | 23.5 | Very low | 202 Ų | 202 | 149.4 Ų | 149.4 | 88% | 0.878 | 80% | 0.801 | S | S | * | * | trans | 30.7 | 132.5 | 138.2 | -65.3 | -176.9 | 176 | -177.4 | 0 | 123.2 | ||||
| 61 | A | 23.2 | Very low | 23.5 | Very low | 87 Ų | 87 | 152.4 Ų | 152.4 | 72% | 0.719 | 81% | 0.811 | S | S | * | * | 157.1 | 107.7 | 123.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 62 | S | 22.4 | Very low | 23.3 | Very low | 106 Ų | 106 | 147.3 Ų | 147.3 | 74% | 0.741 | 81% | 0.805 | S | S | * | * | 65.4 | 137.3 | 78.4 | 70.5 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 63 | L | 23 | Very low | 23.2 | Very low | 160 Ų | 160 | 144.3 Ų | 144.3 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | trans | 105.9 | 127.8 | 172.6 | -61.2 | 167.9 | 0 | 0 | 0 | 112.6 | ||||
| 64 | L | 24.8 | Very low | 23.1 | Very low | 150 Ų | 150 | 143.4 Ų | 143.4 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | cis | -147.1 | 137.6 | 15.8 | -80 | 107.5 | 0 | 0 | 0 | 108.3 | ||||
| 65 | S | 21.7 | Very low | 23.1 | Very low | 104 Ų | 104 | 137.9 Ų | 137.9 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | 66.3 | 101.3 | 69.8 | 166 | 0 | 0 | 0 | 0 | 116.6 | |||||
| 66 | R | 22.2 | Very low | 23.1 | Very low | 232 Ų | 232 | 135.1 Ų | 135.1 | 88% | 0.875 | 79% | 0.79 | S | S | * | * | 163.3 | 115.5 | 127 | -110.9 | 173.6 | 158.6 | 155.7 | -6.4 | 108 | |||||
| 67 | S | 22.1 | Very low | 23 | Very low | 104 Ų | 104 | 135.3 Ų | 135.3 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | cis | 86.5 | 143.2 | 37.3 | -157.8 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 68 | Y | 24.2 | Very low | 23 | Very low | 215 Ų | 215 | 141.9 Ų | 141.9 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | trans | 88.6 | 126.7 | -180 | -71.7 | -87.1 | 0 | 0 | 0 | 117.1 | ||||
| 69 | G | 24.2 | Very low | 23 | Very low | 64 Ų | 64 | 144.1 Ų | 144.1 | 66% | 0.66 | 78% | 0.784 | S | S | * | * | cis | 179.2 | 135.5 | 0.9 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 70 | D | 21.8 | Very low | 22.9 | Very low | 155 Ų | 155 | 144.5 Ų | 144.5 | 83% | 0.829 | 79% | 0.785 | S | S | * | * | 97.2 | 156.7 | 73.1 | -138.6 | -7.6 | 0 | 0 | 0 | 112.1 | |||||
| 71 | I | 24.8 | Very low | 23.7 | Very low | 172 Ų | 172 | 139.8 Ų | 139.8 | 88% | 0.882 | 78% | 0.775 | S | S | * | * | trans | 96 | 118.8 | -169.2 | -51.7 | 161 | 0 | 0 | 0 | 112.1 | ||||
| 72 | G | 22.1 | Very low | 23.8 | Very low | 63 Ų | 63 | 142.6 Ų | 142.6 | 65% | 0.649 | 78% | 0.783 | S | S | * | * | cis | 150.3 | 127.7 | 5.3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 73 | C | 21.5 | Very low | 24 | Very low | 118 Ų | 118 | 144.4 Ų | 144.4 | 80% | 0.797 | 78% | 0.783 | S | S | * | * | trans | 57.9 | 114.9 | 154 | -87 | 0 | 0 | 0 | 0 | 122 | ||||
| 74 | N | 23.1 | Very low | 24.1 | Very low | 146 Ų | 146 | 142.5 Ų | 142.5 | 78% | 0.781 | 77% | 0.773 | S | S | * | * | 157.7 | 140.7 | 92.4 | -93.7 | -11.6 | 0 | 0 | 0 | 113.5 | |||||
| 75 | S | 22.9 | Very low | 24.1 | Very low | 100 Ų | 100 | 145.7 Ų | 145.7 | 70% | 0.699 | 78% | 0.775 | S | S | * | * | trans | -57.3 | 143.3 | 166.4 | 44.8 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 76 | T | 23 | Very low | 24.1 | Very low | 137 Ų | 137 | 145.9 Ų | 145.9 | 84% | 0.84 | 78% | 0.776 | S | S | * | * | -173.3 | 136.4 | 129.2 | 26.8 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 77 | C | 22.2 | Very low | 24.3 | Very low | 108 Ų | 108 | 142.9 Ų | 142.9 | 73% | 0.73 | 78% | 0.777 | S | S | * | * | trans | -58.7 | 147 | 162 | -173.6 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 78 | Y | 23 | Very low | 24.4 | Very low | 217 Ų | 217 | 146.6 Ų | 146.6 | 85% | 0.851 | 78% | 0.782 | S | S | * | * | trans | -166.3 | 132.6 | 140.8 | -100 | -69.3 | 0 | 0 | 0 | 113.6 | ||||
| 79 | Q | 23.4 | Very low | 24.3 | Very low | 158 Ų | 158 | 148 Ų | 148 | 74% | 0.738 | 79% | 0.786 | S | S | * | * | trans | -47.1 | 143.3 | 164.2 | -89.7 | 143.9 | -46 | 0 | 0 | 116.5 | ||||
| 80 | R | 22.3 | Very low | 24.2 | Very low | 237 Ų | 237 | 153.9 Ų | 153.9 | 89% | 0.894 | 79% | 0.788 | S | S | * | * | 42.8 | 177.3 | 126.7 | -89.7 | -171.9 | -174.5 | -169.5 | 2.8 | 119.8 | |||||
| 81 | P | 39.8 | Very low | 24.1 | Very low | 103 Ų | 103 | 153.1 Ų | 153.1 | 67% | 0.669 | 79% | 0.794 | S | S | * | * | cis | -135.3 | 178.7 | -28.8 | 34.3 | -15.6 | 0 | 0 | 0 | 113 | ||||
| 82 | V | 25.5 | Very low | 24 | Very low | 146 Ų | 146 | 152.1 Ų | 152.1 | 89% | 0.885 | 79% | 0.785 | S | S | * | * | trans | -142.2 | 126.8 | 150.2 | 176.4 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 83 | L | 26.7 | Very low | 24 | Very low | 143 Ų | 143 | 154.5 Ų | 154.5 | 75% | 0.749 | 79% | 0.792 | S | S | * | * | trans | -84.3 | 164.1 | 168.4 | -76.8 | 154.2 | 0 | 0 | 0 | 109.6 | ||||
| 84 | L | 25.1 | Very low | 24 | Very low | 120 Ų | 120 | 155.3 Ų | 155.3 | 63% | 0.628 | 79% | 0.793 | S | S | * | * | 173.9 | 138.9 | 66 | -156.2 | 89.8 | 0 | 0 | 0 | 112.2 | |||||
| 85 | R | 24 | Very low | 24 | Very low | 218 Ų | 218 | 151.6 Ų | 151.6 | 82% | 0.823 | 79% | 0.79 | S | S | * | * | trans | 59 | 131.3 | 138.8 | -84.6 | 175.4 | -169.3 | 164.5 | -3 | 124.1 | ||||
| 86 | S | 22.8 | Very low | 24.1 | Very low | 108 Ų | 108 | 154.9 Ų | 154.9 | 76% | 0.755 | 80% | 0.798 | S | S | * | * | 178.1 | 155.2 | 95.6 | 57.1 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 87 | L | 25.3 | Very low | 24.1 | Very low | 169 Ų | 169 | 153.7 Ų | 153.7 | 89% | 0.885 | 79% | 0.791 | S | S | * | * | cis | -161.5 | 140.4 | -2.5 | -118.3 | 159.5 | 0 | 0 | 0 | 107 | ||||
| 88 | H | 23.8 | Very low | 24.2 | Very low | 181 Ų | 181 | 157.1 Ų | 157.1 | 84% | 0.838 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -101.4 | 134.4 | 176.1 | -156.3 | 62.2 | 0 | 0 | 0 | 108.6 | ||
| 89 | R | 22.7 | Very low | 24.3 | Very low | 244 Ų | 244 | 153.1 Ų | 153.1 | 92% | 0.921 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -97.1 | 124 | 172.4 | -139.8 | -178.6 | -155.6 | -167 | 6.1 | 109.1 | ||
| 90 | R | 21.8 | Very low | 24.3 | Very low | 189 Ų | 189 | 153.1 Ų | 153.1 | 71% | 0.713 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -89.4 | 146.2 | -175.5 | 177.7 | -173 | -79.5 | -170.8 | -4.6 | 110.4 | Q92 | R90-Q92 HydrophobicContact CG-CG 4.11Š|
| 91 | C | 20.3 | Very low | 24.5 | Very low | 139 Ų | 139 | 148.6 Ų | 148.6 | 94% | 0.939 | 78% | 0.784 | S | S | * | * | trans | -142.8 | 132.4 | 141.7 | -112.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 92 | Q | 22.1 | Very low | 23.9 | Very low | 151 Ų | 151 | 151.5 Ų | 151.5 | 71% | 0.706 | 79% | 0.792 | S | S | * | * | trans | -112.7 | 150.5 | -179.1 | -76.7 | 175.8 | -22.7 | 0 | 0 | 109.2 | R90 | R90-Q92 HydrophobicContact CG-CG 4.11Š| ||
| 93 | S | 22.4 | Very low | 23.9 | Very low | 112 Ų | 112 | 156.6 Ų | 156.6 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | trans | -148.8 | 125.3 | 142.8 | -177.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 94 | T | 22.4 | Very low | 23.9 | Very low | 135 Ų | 135 | 153.8 Ų | 153.8 | 83% | 0.828 | 80% | 0.801 | S | S | * | * | trans | -43.3 | 154.9 | 156.9 | 44.3 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 95 | G | 22.6 | Very low | 23.9 | Very low | 69 Ų | 69 | 151.6 Ų | 151.6 | 71% | 0.711 | 81% | 0.808 | S | S | * | * | cis | 141.9 | 118.7 | 7.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 96 | L | 23.9 | Very low | 24.1 | Very low | 168 Ų | 168 | 145.5 Ų | 145.5 | 88% | 0.88 | 80% | 0.804 | S | S | * | * | trans | -170.8 | 112.4 | 161.1 | -146.4 | 68 | 0 | 0 | 0 | 114.4 | ||||
| 97 | T | 23.2 | Very low | 24.1 | Very low | 113 Ų | 113 | 145 Ų | 145 | 69% | 0.693 | 81% | 0.807 | S | S | * | * | trans | 38.2 | 119.6 | 134.5 | -30.1 | 0 | 0 | 0 | 0 | 124 | ||||
| 98 | K | 24.6 | Very low | 24.4 | Very low | 179 Ų | 179 | 146.6 Ų | 146.6 | 78% | 0.778 | 80% | 0.801 | S | S | * | * | trans | 56 | 122.2 | 140.9 | -70.9 | -178.9 | 171.4 | 178.1 | 0 | 123.8 | ||||
| 99 | D | 24.8 | Very low | 24.7 | Very low | 134 Ų | 134 | 143.2 Ų | 143.2 | 72% | 0.717 | 80% | 0.795 | S | S | * | * | 46.1 | 122.6 | 129.4 | -57.7 | -36.3 | 0 | 0 | 0 | 120.6 | |||||
| 100 | I | 24.9 | Very low | 24.9 | Very low | 157 Ų | 157 | 138 Ų | 138 | 81% | 0.805 | 79% | 0.79 | S | S | * | * | -179.1 | 122.6 | 120.2 | -89.8 | 155.6 | 0 | 0 | 0 | 111.3 | |||||
| 101 | L | 25.5 | Very low | 25.3 | Very low | 143 Ų | 143 | 133.6 Ų | 133.6 | 75% | 0.749 | 79% | 0.788 | S | S | * | * | trans | 65.5 | 103.3 | 148 | -67 | 169 | 0 | 0 | 0 | 123 | ||||
| 102 | L | 27.9 | Very low | 25.6 | Very low | 163 Ų | 163 | 131.1 Ų | 131.1 | 85% | 0.853 | 78% | 0.778 | S | S | * | * | 35 | 107.6 | 117.5 | -64.9 | 172.8 | 0 | 0 | 0 | 118.9 | |||||
| 103 | R | 25.5 | Very low | 26.2 | Very low | 254 Ų | 254 | 130.3 Ų | 130.3 | 96% | 0.958 | 78% | 0.783 | S | S | * | * | trans | -143.8 | 128.2 | 137.7 | -150.9 | 171.2 | -161.6 | -102.1 | 1.9 | 109.8 | ||||
| 104 | G | 27.1 | Very low | 26.4 | Very low | 84 Ų | 84 | 135.8 Ų | 135.8 | 87% | 0.866 | 79% | 0.786 | S | S | * | * | trans | -71.1 | 156.9 | -161.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 105 | G | 24.9 | Very low | 26.9 | Very low | 74 Ų | 74 | 134 Ų | 134 | 76% | 0.763 | 78% | 0.78 | S | S | * | * | trans | -178.2 | 117.8 | 166.4 | 0 | 0 | 0 | 0 | 0 | 106.3 | A107 | G105-A107 PolarHBondContact O-N 3.25Š| ||
| 106 | A | 26.5 | Very low | 27.1 | Very low | 90 Ų | 90 | 141.1 Ų | 141.1 | 74% | 0.744 | 79% | 0.785 | S | S | * | * | trans | -45.4 | 123 | -165.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | W108 | A106-W108 VanDerWaalsContact O-CD1 3.29Å; A106-W108 PolarHBondContact O-N 2.57Å | ||
| 107 | A | 24.9 | Very low | 27.6 | Very low | 98 Ų | 98 | 139.1 Ų | 139.1 | 81% | 0.81 | 78% | 0.78 | S | S | * | * | trans | -72.8 | 114.5 | 169.6 | 0 | 0 | 0 | 0 | 0 | 108.7 | G105 | G105-A107 PolarHBondContact O-N 3.25Š| ||
| 108 | W | 30.8 | Very low | 28.1 | Very low | 201 Ų | 201 | 139 Ų | 139 | 76% | 0.761 | 78% | 0.779 | S | S | * | * | trans | -74.7 | 131.4 | 174.7 | -66.8 | 68.5 | 0 | 0 | 0 | 109.4 | A106 V110 | A106-W108 VanDerWaalsContact O-CD1 3.29Å; A106-W108 PolarHBondContact O-N 2.57Å; W108-V110 PolarHBondContact O-N 3.2Å; W108-V110 VanDerWaalsContact O-N 3.08Å | ||
| 109 | P | 29.5 | Very low | 28.8 | Very low | 111 Ų | 111 | 138.3 Ų | 138.3 | 72% | 0.721 | 78% | 0.783 | S | S | * | * | trans | -77.7 | 97.4 | 170.5 | 30.8 | -28.5 | 0 | 0 | 0 | 108 | S111 | P109-S111 PolarHBondContact O-N 3.2Š| ||
| 110 | V | 27.6 | Very low | 29.2 | Very low | 135 Ų | 135 | 135.8 Ų | 135.8 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -67 | 90 | 164.2 | 179.8 | 0 | 0 | 0 | 0 | 107.1 | W108 A112 | W108-V110 PolarHBondContact O-N 3.2Å; W108-V110 VanDerWaalsContact O-N 3.08Å; V110-A112 VanDerWaalsContact C-N 3.3Å; V110-A112 PolarHBondContact O-N 3.44Å | ||
| 111 | S | 29.1 | Very low | 29.9 | Very low | 95 Ų | 95 | 134 Ų | 134 | 66% | 0.664 | 78% | 0.78 | S | S | * | * | trans | -75.3 | 88.1 | 171.3 | -55.7 | 0 | 0 | 0 | 0 | 107.4 | P109 V113 | P109-S111 PolarHBondContact O-N 3.2Å; S111-V113 VanDerWaalsContact C-N 3.34Å; S111-V113 PolarHBondContact O-N 3.04Å | ||
| 112 | A | 28.3 | Very low | 30.9 | Very low | 88 Ų | 88 | 136.3 Ų | 136.3 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | trans | -64.2 | 97.9 | 168.1 | 0 | 0 | 0 | 0 | 0 | 108.2 | V110 R114 | V110-A112 VanDerWaalsContact C-N 3.3Å; V110-A112 PolarHBondContact O-N 3.44Å; A112-R114 VanDerWaalsContact C-N 3.3Å; A112-R114 PolarHBondContact O-N 2.87Å | ||
| 113 | V | 33.8 | Very low | 31.4 | Very low | 134 Ų | 134 | 132.7 Ų | 132.7 | 81% | 0.812 | 78% | 0.781 | S | S | * | * | trans | -69.4 | 91.3 | 174.6 | 177.5 | 0 | 0 | 0 | 0 | 108 | S111 S115 | S111-V113 VanDerWaalsContact C-N 3.34Å; S111-V113 PolarHBondContact O-N 3.04Å; V113-S115 PolarHBondContact O-N 3.01Å | ||
| 114 | R | 26.5 | Very low | 32.2 | Very low | 227 Ų | 227 | 128 Ų | 128 | 86% | 0.857 | 78% | 0.78 | S | S | * | * | trans | -80.1 | 96 | 169.9 | -165.9 | 178.5 | -161.1 | 179 | 5.4 | 108.1 | A112 R116 | A112-R114 VanDerWaalsContact C-N 3.3Å; A112-R114 PolarHBondContact O-N 2.87Å; R114-R116 PolarHBondContact O-N 2.92Å | ||
| 115 | S | 32.6 | Very low | 33.6 | Very low | 98 Ų | 98 | 129.1 Ų | 129.1 | 69% | 0.685 | 77% | 0.77 | S | S | * | * | trans | -57 | 109 | 167.2 | 167.6 | 0 | 0 | 0 | 0 | 109.4 | V113 | V113-S115 PolarHBondContact O-N 3.01Š| ||
| 116 | R | 26.9 | Very low | 35.1 | Very low | 217 Ų | 217 | 127.7 Ų | 127.7 | 82% | 0.819 | 75% | 0.748 | S | S | * | * | trans | -83.5 | 108.6 | 162 | -75.9 | -171.2 | -151.7 | -168.9 | 6.4 | 107 | R114 T118 | R114-R116 PolarHBondContact O-N 2.92Å; R116-T118 PolarHBondContact O-N 2.84Å; R116-T118 PolarHBondContact O-OG1 3.23Å | ||
| 117 | V | 33.8 | Very low | 37.4 | Very low | 127 Ų | 127 | 127.5 Ų | 127.5 | 77% | 0.77 | 74% | 0.74 | S | S | * | * | trans | -65.5 | 103.4 | 161.5 | -179 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 118 | T | 34.6 | Very low | 40.1 | Very low | 111 Ų | 111 | 125.7 Ų | 125.7 | 68% | 0.681 | 72% | 0.718 | S | S | * | * | trans | -109.9 | 115.1 | 171.1 | -33.2 | 0 | 0 | 0 | 0 | 105 | R116 A120 | R116-T118 PolarHBondContact O-N 2.84Å; R116-T118 PolarHBondContact O-OG1 3.23Å; T118-A120 PolarHBondContact O-N 2.86Å | ||
| 119 | D | 40.2 | Very low | 42.7 | Very low | 163 Ų | 163 | 116.5 Ų | 116.5 | 87% | 0.872 | 68% | 0.684 | S | S | * | * | trans | -61.3 | 104.1 | 179.4 | -67.2 | -44.3 | 0 | 0 | 0 | 109.6 | ||||
| 120 | A | 32.3 | Very low | 45.4 | Very low | 81 Ų | 81 | 114.7 Ų | 114.7 | 67% | 0.669 | 67% | 0.668 | S | S | * | * | trans | -131.4 | 145.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 109 | T118 | T118-A120 PolarHBondContact O-N 2.86Š| ||
| 121 | P | 39.6 | Very low | 48.4 | Very low | 120 Ų | 120 | 108.3 Ų | 108.3 | 78% | 0.779 | 63% | 0.629 | S | S | * | * | trans | -68.6 | 148.4 | -161.6 | 28.6 | -33.6 | 0 | 0 | 0 | 112.2 | S123 | P121-S123 PolarHBondContact O-N 2.97Š| ||
| 122 | L | 45.4 | Very low | 51.3 | Low | 191 Ų | 191 | 104.4 Ų | 104.4 | 100% | 1 | 60% | 0.601 | S | S | * | * | trans | -44.7 | 96.1 | 176.2 | -80.2 | 138.2 | 0 | 0 | 0 | 111.5 | ||||
| 123 | S | 39.4 | Very low | 54.3 | Low | 88 Ų | 88 | 103.2 Ų | 103.2 | 62% | 0.615 | 58% | 0.579 | S | S | * | * | trans | -111.4 | 145.9 | 169.6 | 63.8 | 0 | 0 | 0 | 0 | 109.2 | P121 V125 | P121-S123 PolarHBondContact O-N 2.97Å; S123-V125 PolarHBondContact O-N 2.95Å | ||
| 124 | T | 43.1 | Very low | 57 | Low | 154 Ų | 154 | 96.8 Ų | 96.8 | 95% | 0.945 | 54% | 0.54 | S | S | * | . | trans | -62.6 | 48.7 | -172.6 | -32 | 0 | 0 | 0 | 0 | 113.8 | S126 | T124-S126 PolarHBondContact O-N 2.82Š| ||
| 125 | V | 54.7 | Low | 60 | Low | 108 Ų | 108 | 87.6 Ų | 87.6 | 66% | 0.655 | 51% | 0.508 | S | S | * | . | trans | -83.8 | 112.4 | -179.8 | -175.4 | 0 | 0 | 0 | 0 | 108.1 | S123 | S123-V125 PolarHBondContact O-N 2.95Š| ||
| 126 | S | 58.3 | Low | 62.4 | Low | 44 Ų | 44 | 86 Ų | 86 | 31% | 0.308 | 49% | 0.492 | S | S | . | . | P | Polyproline II helix | trans | -53.1 | 134.8 | 171.5 | 55.3 | 0 | 0 | 0 | 0 | 109.8 | T124 T128 | T124-S126 PolarHBondContact O-N 2.82Å; S126-T128 PolarHBondContact O-N 2.78Å |
| 127 | P | 73.5 | Confident | 64.9 | Low | 87 Ų | 87 | 81.1 Ų | 81.1 | 57% | 0.565 | 48% | 0.478 | S | S | * | . | P | Polyproline II helix | trans | -59 | 127.4 | -175.9 | 23.6 | -33.2 | 0 | 0 | 0 | 111 | K147 | P127-K147 WeakPolarHBondContact O-CB 3.31Å; P127-K147 PolarHBondContact O-N 2.58Å |
| 128 | T | 82 | Confident | 67 | Low | 59 Ų | 59 | 75.5 Ų | 75.5 | 36% | 0.362 | 45% | 0.446 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93 | 148.8 | 173.7 | 47.6 | 0 | 0 | 0 | 0 | 110.6 | S126 E144 K146 | S126-T128 PolarHBondContact O-N 2.78Å; T128-E144 WeakPolarHBondContact CB-OE1 3.4Å; T128-E144 HydrophobicContact CG2-CG 4.15Å; T128-E144 PolarHBondContact OG1-OE1 3.08Å; T128-K146 HydrophobicContact CG2-CG 3.98Å |
| 129 | F | 84.4 | Confident | 69.4 | Low | 8 Ų | 8 | 74.6 Ų | 74.6 | 4% | 0.035 | 44% | 0.437 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.8 | 134.3 | 173.2 | -73.1 | -73.2 | 0 | 0 | 0 | 109.5 | V131 E144 K145 K147 L150 L161 F163 L195 D196 | F129-V131 HydrophobicContact CB-CG2 3.98Å; F129-V131 PolarHBondContact O-N 3.01Å; F129-E144 WeakPolarHBondContact O-CA 3.34Å; F129-K145 PolarHBondContact N-O 3.25Å; F129-K145 PolarHBondContact O-N 3.02Å; F129-K147 HydrophobicContact CD2-CB 4.02Å; F129-K147 HydrophobicContact CE2-CB 3.62Å; F129-K147 HydrophobicContact CE2-CD 3.84Å; F129-K147 HydrophobicContact CE2-CG 3.72Å; F129-K147 HydrophobicContact CZ-CD 4.2Å; F129-L150 HydrophobicContact CD2-CD2 4.33Å; F129-L161 HydrophobicContact CE2-CB 4.44Å; F129-L161 HydrophobicContact CE2-CD1 4.16Å; F129-L161 HydrophobicContact CZ-CB 4.36Å; F129-F163 HydrophobicContact CD1-CZ 4.07Å; F129-F163 AromaticContact CE1-CE1 3.95Å; F129-F163 HydrophobicContact CE1-CE1 3.95Å; F129-F163 AromaticContact CE1-CE2 3.79Å; F129-F163 HydrophobicContact CE1-CE2 3.79Å; F129-F163 AromaticContact CE1-CZ 3.23Å; F129-F163 HydrophobicContact CE1-CZ 3.23Å; F129-F163 HydrophobicContact CZ-CE2 4.1Å; F129-F163 AromaticContact CZ-CZ 4Å; F129-F163 HydrophobicContact CZ-CZ 4Å; F129-L195 HydrophobicContact CD1-CB 4.49Å; F129-D196 HydrophobicContact CD1-CB 4.23Å |
| 130 | N | 87.1 | Confident | 71.7 | Confident | 74 Ų | 74 | 68.7 Ų | 68.7 | 40% | 0.396 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.3 | 119.5 | 159.4 | -69.8 | -23.8 | 0 | 0 | 0 | 107.8 | D196 Y197 | N130-D196 PolarHBondContact O-N 2.99Å; N130-Y197 HydrophobicContact CB-CE1 4.37Å |
| 131 | V | 89.7 | Confident | 74.5 | Confident | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 129.6 | -177.3 | -173.1 | 0 | 0 | 0 | 0 | 108.8 | F129 S142 F143 K145 L193 V194 L195 | F129-V131 HydrophobicContact CB-CG2 3.98Å; F129-V131 PolarHBondContact O-N 3.01Å; V131-S142 WeakPolarHBondContact O-CA 3.41Å; V131-F143 HydrophobicContact CB-CD2 4.18Å; V131-F143 HydrophobicContact CB-CE2 3.77Å; V131-F143 HydrophobicContact CB-CZ 4.06Å; V131-F143 HydrophobicContact CG1-CE2 4.04Å; V131-F143 HydrophobicContact CG1-CZ 3.87Å; V131-F143 HydrophobicContact CG2-CE2 4.23Å; V131-F143 PolarHBondContact N-O 3.35Å; V131-F143 PolarHBondContact O-N 3.3Å; V131-K145 HydrophobicContact CG2-CB 4.35Å; V131-L193 HydrophobicContact CG1-CB 4.11Å; V131-L193 HydrophobicContact CG1-CD2 3.86Å; V131-V194 WeakPolarHBondContact CA-O 3.38Å; V131-L195 HydrophobicContact CB-CD2 4.37Å; V131-L195 HydrophobicContact CG1-CD2 4.04Å; V131-L195 HydrophobicContact CG2-CD2 3.64Å |
| 132 | M | 90.6 | Very high | 76.8 | Confident | 13 Ų | 13 | 66.2 Ų | 66.2 | 6% | 0.064 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.6 | 116.5 | 167.6 | -173 | 176.3 | -74.4 | 0 | 0 | 107.8 | F134 V140 T141 V194 Y197 L206 | M132-F134 HydrophobicContact CB-CE2 4.25Å; M132-F134 HydrophobicContact CG-CD2 4.44Å; M132-F134 HydrophobicContact CG-CE2 3.62Å; M132-F134 HydrophobicContact CG-CZ 3.82Å; M132-F134 HydrophobicContact SD-CE1 4.47Å; M132-F134 HydrophobicContact SD-CE2 3.83Å; M132-F134 HydrophobicContact SD-CZ 3.48Å; M132-F134 WeakPolarHBondContact SD-CZ 3.06Å; M132-V140 HydrophobicContact CE-CG1 4.42Å; M132-V140 HydrophobicContact CG-CG1 3.41Å; M132-V140 VanDerWaalsContact CG-CG1 3.41Å; M132-V140 HydrophobicContact SD-CG1 3.66Å; M132-T141 CarbonylContact C-O 3.59Å; M132-T141 WeakPolarHBondContact CA-O 3.31Å; M132-V194 HydrophobicContact CB-CB 4.39Å; M132-V194 PolarHBondContact N-O 3.14Å; M132-V194 PolarHBondContact O-N 3.32Å; M132-Y197 HydrophobicContact CB-CD1 3.99Å; M132-Y197 HydrophobicContact CB-CE1 3.63Å; M132-Y197 HydrophobicContact CE-CE1 4.11Å; M132-Y197 HydrophobicContact CE-CE2 3.96Å; M132-L206 HydrophobicContact SD-CB 4.1Å; M132-L206 HydrophobicContact SD-CD1 4.08Å |
| 133 | K | 92.1 | Very high | 78.9 | Confident | 63 Ų | 63 | 60.5 Ų | 60.5 | 27% | 0.274 | 35% | 0.352 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 131.5 | 179.1 | -179.7 | 176.2 | -169.4 | -103.9 | 0 | 109.6 | D135 V140 T141 F143 L192 L193 | K133-D135 WeakPolarHBondContact CE-OD1 3.46Å; K133-D135 IonicContact NZ-OD1 3.64Å; K133-D135 PolarHBondContact NZ-OD1 3.44Å; K133-V140 WeakPolarHBondContact O-CA 3.34Å; K133-T141 PolarHBondContact N-O 3.34Å; K133-T141 PolarHBondContact O-N 3.05Å; K133-F143 HydrophobicContact CB-CE1 3.66Å; K133-F143 HydrophobicContact CB-CZ 4.28Å; K133-F143 HydrophobicContact CD-CE1 4.06Å; K133-F143 HydrophobicContact CD-CZ 4.47Å; K133-L192 CarbonylContact C-O 3.56Å; K133-L192 WeakPolarHBondContact CA-O 3.44Å; K133-L193 HydrophobicContact CB-CD2 3.7Å; K133-L193 HydrophobicContact CD-CD2 4.04Å; K133-L193 HydrophobicContact CG-CD2 3.69Å |
| 134 | F | 91 | Very high | 81.3 | Confident | 0 Ų | 0 | 62.3 Ų | 62.3 | 0% | 0 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.9 | 125.8 | 170.7 | -57.5 | -104.1 | 0 | 0 | 0 | 108.3 | M132 N139 V140 S191 L192 V194 L206 L210 A211 L214 | M132-F134 HydrophobicContact CB-CE2 4.25Å; M132-F134 HydrophobicContact CG-CD2 4.44Å; M132-F134 HydrophobicContact CG-CE2 3.62Å; M132-F134 HydrophobicContact CG-CZ 3.82Å; M132-F134 HydrophobicContact SD-CE1 4.47Å; M132-F134 HydrophobicContact SD-CE2 3.83Å; M132-F134 HydrophobicContact SD-CZ 3.48Å; M132-F134 WeakPolarHBondContact SD-CZ 3.06Å; F134-N139 WeakPolarHBondContact CA-O 3.48Å; F134-V140 HydrophobicContact CD1-CG1 4.5Å; F134-V140 HydrophobicContact CD1-CG2 3.64Å; F134-V140 HydrophobicContact CE1-CB 4.39Å; F134-V140 HydrophobicContact CE1-CG1 4.06Å; F134-V140 HydrophobicContact CE1-CG2 3.48Å; F134-V140 VanDerWaalsContact CE1-CG2 3.48Å; F134-V140 HydrophobicContact CZ-CG1 4.16Å; F134-V140 HydrophobicContact CZ-CG2 4.37Å; F134-S191 CarbonylContact O-C 3.55Å; F134-S191 WeakPolarHBondContact O-CA 3.32Å; F134-S191 WeakPolarHBondContact O-CB 3.42Å; F134-L192 HydrophobicContact CB-CB 4.07Å; F134-L192 HydrophobicContact CD2-CB 4.31Å; F134-L192 HydrophobicContact CD2-CD2 4.34Å; F134-L192 PolarHBondContact N-O 2.92Å; F134-L192 PolarHBondContact O-N 3.31Å; F134-V194 HydrophobicContact CD2-CG2 4.35Å; F134-V194 HydrophobicContact CE2-CG2 3.82Å; F134-L206 WeakPolarHBondContact CE1-O 3.47Å; F134-L206 HydrophobicContact CE2-CD2 4.38Å; F134-L206 HydrophobicContact CZ-CB 4.08Å; F134-L206 HydrophobicContact CZ-CD2 4.2Å; F134-L210 HydrophobicContact CE1-CD2 4.33Å; F134-L210 HydrophobicContact CE2-CD2 4.2Å; F134-L210 HydrophobicContact CZ-CD2 4.06Å; F134-A211 HydrophobicContact CD1-CB 4.06Å; F134-A211 HydrophobicContact CE1-CB 3.9Å; F134-L214 HydrophobicContact CB-CD1 3.69Å; F134-L214 HydrophobicContact CD1-CD1 3.9Å; F134-L214 HydrophobicContact CG-CD1 3.88Å |
| 135 | D | 88.2 | Confident | 83.4 | Confident | 33 Ų | 33 | 56.4 Ų | 56.4 | 18% | 0.176 | 31% | 0.312 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.5 | 174.5 | 176.3 | -59.9 | -35.5 | 0 | 0 | 0 | 111.1 | K133 E137 G138 N139 | K133-D135 WeakPolarHBondContact CE-OD1 3.46Å; K133-D135 IonicContact NZ-OD1 3.64Å; K133-D135 PolarHBondContact NZ-OD1 3.44Å; D135-E137 PolarHBondContact O-N 2.94Å; D135-G138 PolarHBondContact O-N 3.43Å; D135-N139 PolarHBondContact N-O 2.88Å; D135-N139 VanDerWaalsContact N-O 3.1Å |
| 136 | L | 83.5 | Confident | 85 | Confident | 65 Ų | 65 | 55.4 Ų | 55.4 | 34% | 0.34 | 30% | 0.299 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.2 | -31.8 | 179.9 | -68.8 | 173.5 | 0 | 0 | 0 | 113.3 | G138 E190 F223 | L136-G138 PolarHBondContact O-N 3.04Å; L136-E190 HydrophobicContact CD1-CG 4.36Å; L136-F223 HydrophobicContact CD2-CB 3.65Å; L136-F223 HydrophobicContact CD2-CD1 4.37Å; L136-F223 HydrophobicContact CD2-CD2 3.69Å; L136-F223 HydrophobicContact CD2-CE2 4.41Å; L136-F223 HydrophobicContact CD2-CG 3.65Å |
| 137 | E | 79.5 | Confident | 86.2 | Confident | 114 Ų | 114 | 55.2 Ų | 55.2 | 53% | 0.533 | 29% | 0.293 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84 | 1.4 | 178.6 | -56.4 | 73.2 | -154.6 | 0 | 0 | 112.7 | D135 N139 A215 | D135-E137 PolarHBondContact O-N 2.94Å; E137-N139 VanDerWaalsContact C-N 3.28Å; E137-N139 PolarHBondContact O-N 3.09Å; E137-A215 WeakPolarHBondContact O-CB 3.39Å |
| 138 | G | 78.3 | Confident | 86.7 | Confident | 10 Ų | 10 | 54.8 Ų | 54.8 | 10% | 0.103 | 29% | 0.288 | C | S | . | . | trans | 75.3 | 14 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | D135 L136 | D135-G138 PolarHBondContact O-N 3.43Å; L136-G138 PolarHBondContact O-N 3.04Å | ||
| 139 | N | 85.5 | Confident | 86.9 | Confident | 92 Ų | 92 | 55.5 Ų | 55.5 | 49% | 0.492 | 29% | 0.288 | S | S | . | . | trans | -68.1 | 135.1 | 172.6 | -67.2 | -42.9 | 0 | 0 | 0 | 110.3 | F134 D135 E137 | F134-N139 WeakPolarHBondContact CA-O 3.48Å; D135-N139 PolarHBondContact N-O 2.88Å; D135-N139 VanDerWaalsContact N-O 3.1Å; E137-N139 VanDerWaalsContact C-N 3.28Å; E137-N139 PolarHBondContact O-N 3.09Å | ||
| 140 | V | 88.4 | Confident | 86.9 | Confident | 39 Ų | 39 | 55.2 Ų | 55.2 | 24% | 0.236 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.3 | 121.9 | -176.8 | -170.2 | 0 | 0 | 0 | 0 | 110 | M132 K133 F134 A211 | M132-V140 HydrophobicContact CE-CG1 4.42Å; M132-V140 HydrophobicContact CG-CG1 3.41Å; M132-V140 VanDerWaalsContact CG-CG1 3.41Å; M132-V140 HydrophobicContact SD-CG1 3.66Å; K133-V140 WeakPolarHBondContact O-CA 3.34Å; F134-V140 HydrophobicContact CD1-CG1 4.5Å; F134-V140 HydrophobicContact CD1-CG2 3.64Å; F134-V140 HydrophobicContact CE1-CB 4.39Å; F134-V140 HydrophobicContact CE1-CG1 4.06Å; F134-V140 HydrophobicContact CE1-CG2 3.48Å; F134-V140 VanDerWaalsContact CE1-CG2 3.48Å; F134-V140 HydrophobicContact CZ-CG1 4.16Å; F134-V140 HydrophobicContact CZ-CG2 4.37Å; V140-A211 HydrophobicContact CG2-CB 3.74Å |
| 141 | T | 89.6 | Confident | 86.8 | Confident | 62 Ų | 62 | 52.3 Ų | 52.3 | 38% | 0.38 | 27% | 0.272 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.1 | 136.2 | 173.2 | 57.3 | 0 | 0 | 0 | 0 | 110.6 | M132 K133 | M132-T141 CarbonylContact C-O 3.59Å; M132-T141 WeakPolarHBondContact CA-O 3.31Å; K133-T141 PolarHBondContact N-O 3.34Å; K133-T141 PolarHBondContact O-N 3.05Å |
| 142 | S | 88.6 | Confident | 86.6 | Confident | 87 Ų | 87 | 59.5 Ų | 59.5 | 61% | 0.608 | 31% | 0.306 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 128 | 178.7 | 61.3 | 0 | 0 | 0 | 0 | 110.5 | V131 | V131-S142 WeakPolarHBondContact O-CA 3.41Å |
| 143 | F | 89.3 | Confident | 86.4 | Confident | 71 Ų | 71 | 64.6 Ų | 64.6 | 31% | 0.311 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.3 | 160.5 | 177.5 | 56.5 | -94.3 | 0 | 0 | 0 | 111.7 | V131 K133 K145 L193 | V131-F143 HydrophobicContact CB-CD2 4.18Å; V131-F143 HydrophobicContact CB-CE2 3.77Å; V131-F143 HydrophobicContact CB-CZ 4.06Å; V131-F143 HydrophobicContact CG1-CE2 4.04Å; V131-F143 HydrophobicContact CG1-CZ 3.87Å; V131-F143 HydrophobicContact CG2-CE2 4.23Å; V131-F143 PolarHBondContact N-O 3.35Å; V131-F143 PolarHBondContact O-N 3.3Å; K133-F143 HydrophobicContact CB-CE1 3.66Å; K133-F143 HydrophobicContact CB-CZ 4.28Å; K133-F143 HydrophobicContact CD-CE1 4.06Å; K133-F143 HydrophobicContact CD-CZ 4.47Å; F143-K145 HydrophobicContact CD2-CB 4.14Å; F143-K145 HydrophobicContact CE2-CB 4.11Å; F143-K145 HydrophobicContact CE2-CD 3.89Å; F143-L193 HydrophobicContact CZ-CD2 4.35Å |
| 144 | E | 89.4 | Confident | 85.9 | Confident | 126 Ų | 126 | 62.4 Ų | 62.4 | 59% | 0.589 | 32% | 0.32 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 131 | 174.7 | -171.8 | 175.1 | -169.5 | 0 | 0 | 109.6 | T128 F129 | T128-E144 WeakPolarHBondContact CB-OE1 3.4Å; T128-E144 HydrophobicContact CG2-CG 4.15Å; T128-E144 PolarHBondContact OG1-OE1 3.08Å; F129-E144 WeakPolarHBondContact O-CA 3.34Å |
| 145 | K | 87.8 | Confident | 85.6 | Confident | 30 Ų | 30 | 69.3 Ų | 69.3 | 13% | 0.13 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.5 | 140.1 | -178.3 | -163.3 | 161.1 | -174.4 | 164.7 | 0 | 111.7 | F129 V131 F143 E149 L150 E153 | F129-K145 PolarHBondContact N-O 3.25Å; F129-K145 PolarHBondContact O-N 3.02Å; V131-K145 HydrophobicContact CG2-CB 4.35Å; F143-K145 HydrophobicContact CD2-CB 4.14Å; F143-K145 HydrophobicContact CE2-CB 4.11Å; F143-K145 HydrophobicContact CE2-CD 3.89Å; K145-E149 HydrophobicContact CG-CB 4.28Å; K145-L150 HydrophobicContact CD-CB 4.47Å; K145-L150 HydrophobicContact CD-CD1 4.19Å; K145-L150 HydrophobicContact CG-CB 4.47Å; K145-E153 IonicContact NZ-OE1 2.58Å; K145-E153 PolarHBondContact NZ-OE1 2.9Å; K145-E153 IonicContact NZ-OE2 2.86Å; K145-E153 PolarHBondContact NZ-OE2 2.79Å |
| 146 | K | 88.3 | Confident | 85.5 | Confident | 87 Ų | 87 | 68.2 Ų | 68.2 | 38% | 0.378 | 35% | 0.347 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.8 | 145.4 | 176.6 | -64.2 | -176.5 | -159.6 | 130 | 0 | 110.4 | T128 T148 E149 L150 | T128-K146 HydrophobicContact CG2-CG 3.98Å; K146-T148 VanDerWaalsContact C-N 3.27Å; K146-T148 PolarHBondContact O-N 2.83Å; K146-E149 HydrophobicContact CB-CB 4.32Å; K146-E149 HydrophobicContact CB-CG 4.07Å; K146-E149 VanDerWaalsContact CD-OE1 3.31Å; K146-E149 WeakPolarHBondContact CD-OE1 3.48Å; K146-E149 IonicContact NZ-OE1 2.77Å; K146-E149 PolarHBondContact NZ-OE1 2.96Å; K146-E149 PolarHBondContact O-N 3.26Å; K146-L150 PolarHBondContact O-N 2.96Å |
| 147 | K | 83.7 | Confident | 85.5 | Confident | 39 Ų | 39 | 69.9 Ų | 69.9 | 17% | 0.17 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -54.5 | -40.6 | 176.4 | 175.3 | 162.4 | 176.7 | 160.6 | 0 | 113.3 | P127 F129 C151 A158 L161 | P127-K147 WeakPolarHBondContact O-CB 3.31Å; P127-K147 PolarHBondContact O-N 2.58Å; F129-K147 HydrophobicContact CD2-CB 4.02Å; F129-K147 HydrophobicContact CE2-CB 3.62Å; F129-K147 HydrophobicContact CE2-CD 3.84Å; F129-K147 HydrophobicContact CE2-CG 3.72Å; F129-K147 HydrophobicContact CZ-CD 4.2Å; K147-C151 WeakPolarHBondContact O-CB 3.44Å; K147-C151 PolarHBondContact O-N 3.5Å; K147-C151 PolarHBondContact O-SG 2.87Å; K147-A158 WeakPolarHBondContact CE-O 3.47Å; K147-A158 PolarHBondContact NZ-O 2.68Å; K147-A158 VanDerWaalsContact NZ-O 3.09Å; K147-L161 HydrophobicContact CG-CD1 4.23Å; K147-L161 PolarHBondContact NZ-O 3.44Å |
| 148 | T | 83.8 | Confident | 85.6 | Confident | 78 Ų | 78 | 67.3 Ų | 67.3 | 48% | 0.479 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -68 | -40.6 | -179.7 | 48.8 | 0 | 0 | 0 | 0 | 112.3 | K146 C151 Q152 | K146-T148 VanDerWaalsContact C-N 3.27Å; K146-T148 PolarHBondContact O-N 2.83Å; T148-C151 PolarHBondContact O-N 2.84Å; T148-Q152 VanDerWaalsContact O-CG 3.32Å; T148-Q152 WeakPolarHBondContact O-CG 3.21Å; T148-Q152 PolarHBondContact O-N 2.84Å |
| 149 | E | 85.9 | Confident | 85.7 | Confident | 75 Ų | 75 | 73.9 Ų | 73.9 | 35% | 0.35 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -66.8 | -42.4 | 178.3 | -67.1 | 165.6 | -169.8 | 0 | 0 | 110.4 | K145 K146 Q152 E153 | K145-E149 HydrophobicContact CG-CB 4.28Å; K146-E149 HydrophobicContact CB-CB 4.32Å; K146-E149 HydrophobicContact CB-CG 4.07Å; K146-E149 VanDerWaalsContact CD-OE1 3.31Å; K146-E149 WeakPolarHBondContact CD-OE1 3.48Å; K146-E149 IonicContact NZ-OE1 2.77Å; K146-E149 PolarHBondContact NZ-OE1 2.96Å; K146-E149 PolarHBondContact O-N 3.26Å; E149-Q152 PolarHBondContact O-N 2.91Å; E149-E153 WeakPolarHBondContact O-CB 3.32Å; E149-E153 PolarHBondContact O-N 2.97Å |
| 150 | L | 85.3 | Confident | 85.5 | Confident | 1 Ų | 1 | 70.4 Ų | 70.4 | 1% | 0.005 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -65.3 | -40 | 176.2 | -172.1 | 68.2 | 0 | 0 | 0 | 112.6 | F129 K145 K146 L154 L161 L193 L195 | F129-L150 HydrophobicContact CD2-CD2 4.33Å; K145-L150 HydrophobicContact CD-CB 4.47Å; K145-L150 HydrophobicContact CD-CD1 4.19Å; K145-L150 HydrophobicContact CG-CB 4.47Å; K146-L150 PolarHBondContact O-N 2.96Å; L150-L154 HydrophobicContact CD1-CD1 3.63Å; L150-L154 HydrophobicContact CD1-CG 4.32Å; L150-L154 HydrophobicContact CG-CD1 3.94Å; L150-L154 PolarHBondContact O-N 3.28Å; L150-L154 VanDerWaalsContact O-N 3.14Å; L150-L161 HydrophobicContact CB-CD1 4.47Å; L150-L161 HydrophobicContact CD2-CD1 3.97Å; L150-L161 HydrophobicContact CG-CD1 4.33Å; L150-L193 HydrophobicContact CD1-CD1 4.43Å; L150-L195 HydrophobicContact CD2-CD1 4.11Å; L150-L195 HydrophobicContact CD2-CD2 3.64Å |
| 151 | C | 84.4 | Confident | 85 | Confident | 13 Ų | 13 | 69 Ų | 69 | 9% | 0.088 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.7 | -41.7 | 174 | -81.8 | 0 | 0 | 0 | 0 | 112.3 | K147 T148 Q155 L156 L161 | K147-C151 WeakPolarHBondContact O-CB 3.44Å; K147-C151 PolarHBondContact O-N 3.5Å; K147-C151 PolarHBondContact O-SG 2.87Å; T148-C151 PolarHBondContact O-N 2.84Å; C151-Q155 CarbonylContact O-C 3.4Å; C151-Q155 VanDerWaalsContact O-CA 3.31Å; C151-Q155 WeakPolarHBondContact O-CA 3.47Å; C151-Q155 PolarHBondContact O-N 3.5Å; C151-L156 WeakPolarHBondContact CB-O 3.4Å; C151-L156 PolarHBondContact O-N 3.07Å; C151-L161 WeakPolarHBondContact SG-CD1 3.39Å |
| 152 | Q | 86.5 | Confident | 84.4 | Confident | 152 Ų | 152 | 73.5 Ų | 73.5 | 71% | 0.71 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -67.4 | -43.9 | 179.8 | -75.3 | 172.9 | -10.1 | 0 | 0 | 111.6 | T148 E149 Q155 | T148-Q152 VanDerWaalsContact O-CG 3.32Å; T148-Q152 WeakPolarHBondContact O-CG 3.21Å; T148-Q152 PolarHBondContact O-N 2.84Å; E149-Q152 PolarHBondContact O-N 2.91Å; Q152-Q155 PolarHBondContact O-N 2.68Å |
| 153 | E | 84.9 | Confident | 83.2 | Confident | 120 Ų | 120 | 74 Ų | 74 | 56% | 0.561 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -65 | -45.4 | -179.1 | -175.1 | 167 | 110.6 | 0 | 0 | 112.9 | K145 E149 Q155 | K145-E153 IonicContact NZ-OE1 2.58Å; K145-E153 PolarHBondContact NZ-OE1 2.9Å; K145-E153 IonicContact NZ-OE2 2.86Å; K145-E153 PolarHBondContact NZ-OE2 2.79Å; E149-E153 WeakPolarHBondContact O-CB 3.32Å; E149-E153 PolarHBondContact O-N 2.97Å; E153-Q155 VanDerWaalsContact C-N 3.25Å; E153-Q155 PolarHBondContact O-N 3.01Å |
| 154 | L | 83.3 | Confident | 82.1 | Confident | 16 Ų | 16 | 75.3 Ų | 75.3 | 8% | 0.084 | 35% | 0.354 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.9 | 4.5 | -179.3 | -59.8 | 171.5 | 0 | 0 | 0 | 112.6 | L150 L156 I186 T188 L193 | L150-L154 HydrophobicContact CD1-CD1 3.63Å; L150-L154 HydrophobicContact CD1-CG 4.32Å; L150-L154 HydrophobicContact CG-CD1 3.94Å; L150-L154 PolarHBondContact O-N 3.28Å; L150-L154 VanDerWaalsContact O-N 3.14Å; L154-L156 HydrophobicContact CB-CD1 3.94Å; L154-L156 HydrophobicContact CB-CG 3.8Å; L154-L156 HydrophobicContact CD1-CD1 4.21Å; L154-L156 WeakPolarHBondContact O-CG 3.48Å; L154-L156 PolarHBondContact O-N 3.48Å; L154-L156 VanDerWaalsContact O-N 3.07Å; L154-I186 HydrophobicContact CD1-CD1 3.7Å; L154-I186 HydrophobicContact CD1-CG2 4.07Å; L154-T188 HydrophobicContact CD2-CG2 3.93Å; L154-L193 HydrophobicContact CD1-CD1 3.92Å; L154-L193 HydrophobicContact CD2-CD1 4.16Å |
| 155 | Q | 84.6 | Confident | 81 | Confident | 145 Ų | 145 | 77.5 Ų | 77.5 | 68% | 0.678 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54 | 25.1 | -174.7 | -55 | 176.4 | 20.9 | 0 | 0 | 113.5 | C151 Q152 E153 N173 | C151-Q155 CarbonylContact O-C 3.4Å; C151-Q155 VanDerWaalsContact O-CA 3.31Å; C151-Q155 WeakPolarHBondContact O-CA 3.47Å; C151-Q155 PolarHBondContact O-N 3.5Å; Q152-Q155 PolarHBondContact O-N 2.68Å; E153-Q155 VanDerWaalsContact C-N 3.25Å; E153-Q155 PolarHBondContact O-N 3.01Å; Q155-N173 HydrophobicContact CB-CB 4.38Å; Q155-N173 PolarHBondContact O-ND2 3.17Å |
| 156 | L | 85.4 | Confident | 80.6 | Confident | 10 Ų | 10 | 78.9 Ų | 78.9 | 5% | 0.052 | 38% | 0.377 | C | S | . | . | trans | -87.7 | 152.5 | -176.7 | -64.9 | 180 | 0 | 0 | 0 | 112 | C151 L154 L161 R172 I177 I186 | C151-L156 WeakPolarHBondContact CB-O 3.4Å; C151-L156 PolarHBondContact O-N 3.07Å; L154-L156 HydrophobicContact CB-CD1 3.94Å; L154-L156 HydrophobicContact CB-CG 3.8Å; L154-L156 HydrophobicContact CD1-CD1 4.21Å; L154-L156 WeakPolarHBondContact O-CG 3.48Å; L154-L156 PolarHBondContact O-N 3.48Å; L154-L156 VanDerWaalsContact O-N 3.07Å; L156-L161 HydrophobicContact CD1-CD2 4.3Å; L156-R172 HydrophobicContact CD2-CB 3.79Å; L156-I177 HydrophobicContact CD1-CD1 3.85Å; L156-I177 HydrophobicContact CD1-CG1 4.38Å; L156-I177 HydrophobicContact CD2-CD1 3.85Å; L156-I177 HydrophobicContact CG-CD1 4.47Å; L156-I186 HydrophobicContact CD1-CD1 3.93Å; L156-I186 HydrophobicContact CD1-CG2 4.5Å | ||
| 157 | Q | 83.8 | Confident | 80.6 | Confident | 101 Ų | 101 | 75.2 Ų | 75.2 | 47% | 0.472 | 36% | 0.362 | S | S | . | . | trans | -81.4 | 150.1 | 173.7 | -61.5 | -171.7 | -3.9 | 0 | 0 | 110.6 | R159 D160 | Q157-R159 HydrophobicContact CB-CG 3.89Å; Q157-R159 PolarHBondContact O-N 3.37Å; Q157-D160 WeakPolarHBondContact CB-OD2 3.35Å; Q157-D160 PolarHBondContact N-OD2 3.19Å; Q157-D160 WeakPolarHBondContact O-CB 3.42Å; Q157-D160 PolarHBondContact O-N 3.1Å | ||
| 158 | A | 80.6 | Confident | 80.8 | Confident | 60 Ų | 60 | 74.5 Ų | 74.5 | 50% | 0.496 | 36% | 0.362 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | -20.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | K147 | K147-A158 WeakPolarHBondContact CE-O 3.47Å; K147-A158 PolarHBondContact NZ-O 2.68Å; K147-A158 VanDerWaalsContact NZ-O 3.09Å |
| 159 | R | 81.4 | Confident | 81.1 | Confident | 147 Ų | 147 | 71.6 Ų | 71.6 | 56% | 0.555 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.4 | -29 | 173.8 | 70.1 | 179.9 | -177.1 | -166 | -9.2 | 113.2 | Q157 L161 R162 | Q157-R159 HydrophobicContact CB-CG 3.89Å; Q157-R159 PolarHBondContact O-N 3.37Å; R159-L161 VanDerWaalsContact C-N 3.29Å; R159-L161 PolarHBondContact O-N 3.1Å; R159-R162 WeakPolarHBondContact O-CB 3.42Å; R159-R162 WeakPolarHBondContact O-CG 3.41Å; R159-R162 PolarHBondContact O-N 2.92Å |
| 160 | D | 80.3 | Confident | 81.3 | Confident | 19 Ų | 19 | 69 Ų | 69 | 10% | 0.102 | 33% | 0.334 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.9 | -23.7 | -178.5 | -54.5 | -38.7 | 0 | 0 | 0 | 111.1 | Q157 R162 I177 R179 | Q157-D160 WeakPolarHBondContact CB-OD2 3.35Å; Q157-D160 PolarHBondContact N-OD2 3.19Å; Q157-D160 WeakPolarHBondContact O-CB 3.42Å; Q157-D160 PolarHBondContact O-N 3.1Å; D160-R162 VanDerWaalsContact C-N 3.35Å; D160-I177 HydrophobicContact CB-CD1 3.88Å; D160-R179 PolarHBondContact O-NH2 3.21Å |
| 161 | L | 77.6 | Confident | 81.4 | Confident | 10 Ų | 10 | 69.2 Ų | 69.2 | 5% | 0.052 | 34% | 0.335 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -95.8 | 25.8 | 172.3 | -55.6 | -173.6 | 0 | 0 | 0 | 112.9 | F129 K147 L150 C151 L156 R159 I186 L195 | F129-L161 HydrophobicContact CE2-CB 4.44Å; F129-L161 HydrophobicContact CE2-CD1 4.16Å; F129-L161 HydrophobicContact CZ-CB 4.36Å; K147-L161 HydrophobicContact CG-CD1 4.23Å; K147-L161 PolarHBondContact NZ-O 3.44Å; L150-L161 HydrophobicContact CB-CD1 4.47Å; L150-L161 HydrophobicContact CD2-CD1 3.97Å; L150-L161 HydrophobicContact CG-CD1 4.33Å; C151-L161 WeakPolarHBondContact SG-CD1 3.39Å; L156-L161 HydrophobicContact CD1-CD2 4.3Å; R159-L161 VanDerWaalsContact C-N 3.29Å; R159-L161 PolarHBondContact O-N 3.1Å; L161-I186 HydrophobicContact CD2-CD1 3.66Å; L161-L195 HydrophobicContact CD2-CD1 3.96Å |
| 162 | R | 76.9 | Confident | 81.5 | Confident | 157 Ų | 157 | 74 Ų | 74 | 59% | 0.592 | 35% | 0.351 | S | S | * | . | trans | -79.9 | 137.8 | 173.4 | -77.2 | 177.6 | 173.4 | -168 | -2.3 | 110 | R159 D160 Q164 | R159-R162 WeakPolarHBondContact O-CB 3.42Å; R159-R162 WeakPolarHBondContact O-CG 3.41Å; R159-R162 PolarHBondContact O-N 2.92Å; D160-R162 VanDerWaalsContact C-N 3.35Å; R162-Q164 VanDerWaalsContact C-N 3.34Å; R162-Q164 PolarHBondContact O-N 3.46Å | ||
| 163 | F | 64.6 | Low | 81.4 | Confident | 98 Ų | 98 | 71.2 Ų | 71.2 | 43% | 0.43 | 34% | 0.341 | S | S | . | . | trans | -72.3 | 87.6 | 173.1 | -64 | -88.4 | 0 | 0 | 0 | 109.3 | F129 K184 D196 | F129-F163 HydrophobicContact CD1-CZ 4.07Å; F129-F163 AromaticContact CE1-CE1 3.95Å; F129-F163 HydrophobicContact CE1-CE1 3.95Å; F129-F163 AromaticContact CE1-CE2 3.79Å; F129-F163 HydrophobicContact CE1-CE2 3.79Å; F129-F163 AromaticContact CE1-CZ 3.23Å; F129-F163 HydrophobicContact CE1-CZ 3.23Å; F129-F163 HydrophobicContact CZ-CE2 4.1Å; F129-F163 AromaticContact CZ-CZ 4Å; F129-F163 HydrophobicContact CZ-CZ 4Å; F163-K184 HydrophobicContact CD1-CD 4.21Å; F163-K184 VanDerWaalsContact CD1-NZ 3.27Å; F163-K184 HydrophobicContact CE1-CD 4.44Å; F163-D196 HydrophobicContact CE1-CB 4.08Å; F163-D196 WeakPolarHBondContact CE1-OD2 3.49Å; F163-D196 HydrophobicContact CZ-CB 4.49Å | ||
| 164 | Q | 65.9 | Low | 81.3 | Confident | 97 Ų | 97 | 68.8 Ų | 68.8 | 45% | 0.453 | 33% | 0.332 | S | S | . | . | trans | -100.1 | 147.3 | 168.1 | -72.7 | 176 | -11.2 | 0 | 0 | 109.4 | R162 | R162-Q164 VanDerWaalsContact C-N 3.34Å; R162-Q164 PolarHBondContact O-N 3.46Å | ||
| 165 | H | 65.8 | Low | 81.6 | Confident | 172 Ų | 172 | 68.5 Ų | 68.5 | 80% | 0.796 | 33% | 0.331 | S | S | * | . | trans | -92 | -8.4 | -176.2 | -60.3 | -21.6 | 0 | 0 | 0 | 113.6 | ||||
| 166 | S | 79.3 | Confident | 81.9 | Confident | 60 Ų | 60 | 61.6 Ų | 61.6 | 42% | 0.42 | 30% | 0.299 | S | S | . | . | S | Bend | trans | -79 | 140.6 | 178.6 | 54.2 | 0 | 0 | 0 | 0 | 111.7 | S168 | S166-S168 PolarHBondContact O-N 3.21Š|
| 167 | T | 88.2 | Confident | 82.2 | Confident | 9 Ų | 9 | 61.3 Ų | 61.3 | 6% | 0.055 | 30% | 0.297 | C | S | . | . | trans | -63.4 | 128.9 | 169 | -61.4 | 0 | 0 | 0 | 0 | 109.7 | R179 M180 F290 | T167-R179 CarbonylContact C-O 3.58Å; T167-R179 WeakPolarHBondContact CA-O 3.17Å; T167-M180 HydrophobicContact CG2-CG 3.88Å; T167-F290 HydrophobicContact CG2-CB 4.29Å; T167-F290 HydrophobicContact CG2-CD2 3.97Å | ||
| 168 | S | 88.7 | Confident | 82.6 | Confident | 24 Ų | 24 | 56.5 Ų | 56.5 | 17% | 0.168 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.3 | 134.1 | 179.8 | 70.6 | 0 | 0 | 0 | 0 | 110.8 | S166 R179 | S166-S168 PolarHBondContact O-N 3.21Å; S168-R179 PolarHBondContact N-O 2.91Å; S168-R179 PolarHBondContact O-N 2.69Å; S168-R179 PolarHBondContact OG-NH1 3.05Å |
| 169 | L | 90.6 | Very high | 83 | Confident | 17 Ų | 17 | 54.9 Ų | 54.9 | 9% | 0.089 | 26% | 0.256 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.9 | 123 | 170.1 | -178.9 | 58 | 0 | 0 | 0 | 107.7 | I176 I178 L228 I297 L307 | L169-I176 HydrophobicContact CD1-CG2 3.45Å; L169-I176 VanDerWaalsContact CD1-CG2 3.45Å; L169-I178 HydrophobicContact CD1-CB 4.3Å; L169-I178 HydrophobicContact CD1-CD1 3.9Å; L169-I178 HydrophobicContact CD1-CG1 3.56Å; L169-I178 HydrophobicContact CD1-CG2 4.31Å; L169-L228 HydrophobicContact CD1-CD1 4.35Å; L169-L228 HydrophobicContact CD2-CD1 4.32Å; L169-I297 HydrophobicContact CB-CD1 3.56Å; L169-I297 HydrophobicContact CD2-CD1 3.26Å; L169-I297 HydrophobicContact CG-CD1 3.32Å; L169-L307 HydrophobicContact CD1-CD2 4.43Å; L169-L307 HydrophobicContact CG-CD2 4.46Å |
| 170 | S | 88.9 | Confident | 83.4 | Confident | 22 Ų | 22 | 48.2 Ų | 48.2 | 15% | 0.154 | 23% | 0.231 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -147.2 | 138.9 | -177.1 | 61.7 | 0 | 0 | 0 | 0 | 112 | I177 | S170-I177 PolarHBondContact N-O 2.78Å; S170-I177 PolarHBondContact O-N 2.81Å |
| 171 | T | 88.3 | Confident | 83.4 | Confident | 5 Ų | 5 | 49 Ų | 49 | 3% | 0.031 | 24% | 0.243 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -98.7 | 130.8 | 177.1 | 46.7 | 0 | 0 | 0 | 0 | 110.3 | C175 I176 Q306 L307 | T171-C175 WeakPolarHBondContact CA-O 3.38Å; T171-I176 HydrophobicContact CG2-CG1 4.4Å; T171-Q306 HydrophobicContact CG2-CB 3.82Å; T171-Q306 WeakPolarHBondContact CG2-O 3.44Å; T171-Q306 PolarHBondContact OG1-OE1 3.44Å; T171-L307 HydrophobicContact CG2-CD2 3.44Å; T171-L307 VanDerWaalsContact CG2-CD2 3.44Å; T171-L307 HydrophobicContact CG2-CG 3.89Å |
| 172 | R | 86.8 | Confident | 83.6 | Confident | 114 Ų | 114 | 51 Ų | 51 | 43% | 0.43 | 26% | 0.258 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.1 | 128.8 | 176.6 | -66.3 | -64.6 | 173.6 | -117.7 | 9.2 | 109.5 | L156 N174 C175 I177 | L156-R172 HydrophobicContact CD2-CB 3.79Å; R172-N174 PolarHBondContact O-N 3.3Å; R172-C175 PolarHBondContact N-O 3.29Å; R172-C175 WeakPolarHBondContact O-CA 3.37Å; R172-C175 WeakPolarHBondContact O-CB 3.48Å; R172-C175 PolarHBondContact O-N 2.84Å; R172-C175 VanDerWaalsContact O-O 3.11Å; R172-I177 HydrophobicContact CB-CD1 4.25Å; R172-I177 HydrophobicContact CG-CD1 4.29Å |
| 173 | N | 82.9 | Confident | 84.1 | Confident | 93 Ų | 93 | 43.7 Ų | 43.7 | 50% | 0.497 | 23% | 0.231 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 48.5 | 53.8 | 170.9 | -57 | -18.8 | 0 | 0 | 0 | 113.3 | Q155 C175 | Q155-N173 HydrophobicContact CB-CB 4.38Å; Q155-N173 PolarHBondContact O-ND2 3.17Å; N173-C175 PolarHBondContact O-N 2.92Å; N173-C175 VanDerWaalsContact O-N 3.15Å; N173-C175 PolarHBondContact O-SG 2.86Å |
| 174 | N | 84.1 | Confident | 85.3 | Confident | 69 Ų | 69 | 40.5 Ų | 40.5 | 37% | 0.369 | 22% | 0.217 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 57.2 | 25.5 | -178.1 | -143.4 | 41.1 | 0 | 0 | 0 | 114.9 | R172 L309 | R172-N174 PolarHBondContact O-N 3.3Å; N174-L309 WeakPolarHBondContact O-CD2 3.47Å |
| 175 | C | 88.5 | Confident | 86.5 | Confident | 9 Ų | 9 | 36 Ų | 36 | 6% | 0.061 | 20% | 0.196 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.6 | 143.1 | 173.4 | -57.5 | 0 | 0 | 0 | 0 | 109.8 | T171 R172 N173 I186 L187 | T171-C175 WeakPolarHBondContact CA-O 3.38Å; R172-C175 PolarHBondContact N-O 3.29Å; R172-C175 WeakPolarHBondContact O-CA 3.37Å; R172-C175 WeakPolarHBondContact O-CB 3.48Å; R172-C175 PolarHBondContact O-N 2.84Å; R172-C175 VanDerWaalsContact O-O 3.11Å; N173-C175 PolarHBondContact O-N 2.92Å; N173-C175 VanDerWaalsContact O-N 3.15Å; N173-C175 PolarHBondContact O-SG 2.86Å; C175-I186 HydrophobicContact CB-CG2 4.01Å; C175-L187 CarbonylContact C-O 3.54Å; C175-L187 VanDerWaalsContact CA-O 3.28Å; C175-L187 WeakPolarHBondContact CA-O 3.33Å |
| 176 | I | 91.5 | Very high | 87.7 | Confident | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 16% | 0.159 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -98.7 | 122.4 | 171.8 | -45.2 | 174 | 0 | 0 | 0 | 108.2 | L169 T171 I178 I186 L187 E224 L307 L309 | L169-I176 HydrophobicContact CD1-CG2 3.45Å; L169-I176 VanDerWaalsContact CD1-CG2 3.45Å; T171-I176 HydrophobicContact CG2-CG1 4.4Å; I176-I178 HydrophobicContact CG2-CD1 4.34Å; I176-I178 HydrophobicContact CG2-CG1 3.99Å; I176-I186 CarbonylContact O-C 3.49Å; I176-I186 WeakPolarHBondContact O-CA 3.44Å; I176-L187 HydrophobicContact CB-CB 4.1Å; I176-L187 HydrophobicContact CD1-CD2 3.91Å; I176-L187 HydrophobicContact CG1-CD2 4.28Å; I176-L187 PolarHBondContact N-O 3.28Å; I176-L187 PolarHBondContact O-N 3.49Å; I176-E224 HydrophobicContact CD1-CB 4.45Å; I176-L307 HydrophobicContact CB-CD2 4.37Å; I176-L307 HydrophobicContact CD1-CB 4.24Å; I176-L307 HydrophobicContact CD1-CD2 3.72Å; I176-L307 WeakPolarHBondContact CD1-O 3.34Å; I176-L307 HydrophobicContact CG1-CD2 3.94Å; I176-L307 HydrophobicContact CG2-CD2 3.55Å; I176-L309 HydrophobicContact CD1-CD1 4.43Å; I176-L309 HydrophobicContact CD1-CG 4.3Å; I176-L309 HydrophobicContact CG1-CD1 4.15Å; I176-L309 HydrophobicContact CG1-CD2 4.12Å; I176-L309 HydrophobicContact CG1-CG 4.17Å |
| 177 | I | 91.7 | Very high | 88.3 | Confident | 4 Ų | 4 | 25 Ų | 25 | 2% | 0.021 | 14% | 0.139 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -103.9 | 116 | 177.7 | -52.9 | 175.7 | 0 | 0 | 0 | 107.7 | L156 D160 S170 R172 R179 | L156-I177 HydrophobicContact CD1-CD1 3.85Å; L156-I177 HydrophobicContact CD1-CG1 4.38Å; L156-I177 HydrophobicContact CD2-CD1 3.85Å; L156-I177 HydrophobicContact CG-CD1 4.47Å; D160-I177 HydrophobicContact CB-CD1 3.88Å; S170-I177 PolarHBondContact N-O 2.78Å; S170-I177 PolarHBondContact O-N 2.81Å; R172-I177 HydrophobicContact CB-CD1 4.25Å; R172-I177 HydrophobicContact CG-CD1 4.29Å; I177-R179 HydrophobicContact CG2-CG 4.41Å |
| 178 | I | 91.9 | Very high | 88.4 | Confident | 1 Ų | 1 | 25.7 Ų | 25.7 | 1% | 0.005 | 14% | 0.142 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -113.5 | 125.8 | -179.3 | -42.2 | -166.8 | 0 | 0 | 0 | 108.8 | L169 I176 M180 V185 L228 I231 | L169-I178 HydrophobicContact CD1-CB 4.3Å; L169-I178 HydrophobicContact CD1-CD1 3.9Å; L169-I178 HydrophobicContact CD1-CG1 3.56Å; L169-I178 HydrophobicContact CD1-CG2 4.31Å; I176-I178 HydrophobicContact CG2-CD1 4.34Å; I176-I178 HydrophobicContact CG2-CG1 3.99Å; I178-M180 HydrophobicContact CG2-CE 3.44Å; I178-M180 VanDerWaalsContact CG2-CE 3.44Å; I178-M180 HydrophobicContact CG2-CG 4.04Å; I178-M180 HydrophobicContact CG2-SD 3.93Å; I178-V185 HydrophobicContact CB-CB 4.3Å; I178-V185 PolarHBondContact N-O 2.89Å; I178-V185 PolarHBondContact O-N 2.8Å; I178-L228 HydrophobicContact CD1-CD1 3.49Å; I178-L228 VanDerWaalsContact CD1-CD1 3.49Å; I178-I231 HydrophobicContact CD1-CD1 3.9Å; I178-I231 HydrophobicContact CD1-CG2 4.27Å; I178-I231 HydrophobicContact CG2-CG2 4.03Å |
| 179 | R | 89.9 | Confident | 88.2 | Confident | 26 Ų | 26 | 27.2 Ų | 27.2 | 10% | 0.098 | 15% | 0.147 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -124.2 | 122.2 | 173.7 | -51.4 | -174 | -165.8 | 103.5 | 1.9 | 108 | D160 T167 S168 I177 | D160-R179 PolarHBondContact O-NH2 3.21Å; T167-R179 CarbonylContact C-O 3.58Å; T167-R179 WeakPolarHBondContact CA-O 3.17Å; S168-R179 PolarHBondContact N-O 2.91Å; S168-R179 PolarHBondContact O-N 2.69Å; S168-R179 PolarHBondContact OG-NH1 3.05Å; I177-R179 HydrophobicContact CG2-CG 4.41Å |
| 180 | M | 88.1 | Confident | 87.8 | Confident | 7 Ų | 7 | 31.8 Ų | 31.8 | 3% | 0.034 | 17% | 0.168 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -140.8 | 78.5 | -179 | -71.3 | 175.1 | -176.5 | 0 | 0 | 109.2 | T167 I178 S182 L183 I231 L232 K235 F290 | T167-M180 HydrophobicContact CG2-CG 3.88Å; I178-M180 HydrophobicContact CG2-CE 3.44Å; I178-M180 VanDerWaalsContact CG2-CE 3.44Å; I178-M180 HydrophobicContact CG2-CG 4.04Å; I178-M180 HydrophobicContact CG2-SD 3.93Å; M180-S182 PolarHBondContact O-N 2.61Å; M180-S182 VanDerWaalsContact O-N 3.1Å; M180-L183 HydrophobicContact CB-CB 4.48Å; M180-L183 PolarHBondContact N-O 2.86Å; M180-L183 PolarHBondContact O-N 2.84Å; M180-L183 VanDerWaalsContact O-N 3.12Å; M180-I231 HydrophobicContact CE-CG2 4.15Å; M180-I231 HydrophobicContact SD-CG2 3.69Å; M180-L232 HydrophobicContact CE-CD2 3.68Å; M180-K235 HydrophobicContact CB-CD 4.34Å; M180-K235 HydrophobicContact SD-CB 3.71Å; M180-K235 HydrophobicContact SD-CD 4.46Å; M180-K235 HydrophobicContact SD-CG 3.95Å; M180-F290 HydrophobicContact CE-CD2 4.42Å; M180-F290 HydrophobicContact CE-CE2 3.9Å |
| 181 | G | 81.9 | Confident | 87.9 | Confident | 34 Ų | 34 | 31.3 Ų | 31.3 | 35% | 0.351 | 17% | 0.165 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 63.1 | -108.4 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 182 | S | 80.4 | Confident | 88.1 | Confident | 52 Ų | 52 | 31.1 Ų | 31.1 | 36% | 0.364 | 16% | 0.163 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -77.8 | -22.6 | 178 | 56.1 | 0 | 0 | 0 | 0 | 113.4 | M180 | M180-S182 PolarHBondContact O-N 2.61Å; M180-S182 VanDerWaalsContact O-N 3.1Å |
| 183 | L | 88 | Confident | 88.3 | Confident | 5 Ų | 5 | 26 Ų | 26 | 3% | 0.026 | 14% | 0.144 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -87.6 | 121.2 | -178.6 | -179.9 | 61.5 | 0 | 0 | 0 | 109.9 | M180 V185 V194 L202 W205 I231 | M180-L183 HydrophobicContact CB-CB 4.48Å; M180-L183 PolarHBondContact N-O 2.86Å; M180-L183 PolarHBondContact O-N 2.84Å; M180-L183 VanDerWaalsContact O-N 3.12Å; L183-V185 HydrophobicContact CD1-CG2 3.5Å; L183-V185 VanDerWaalsContact CD1-CG2 3.5Å; L183-V185 HydrophobicContact CD2-CG2 4.19Å; L183-V185 HydrophobicContact CG-CG2 3.63Å; L183-V194 HydrophobicContact CD1-CG1 3.87Å; L183-L202 HydrophobicContact CD1-CD1 4.26Å; L183-W205 HydrophobicContact CD2-CZ3 4.49Å; L183-I231 HydrophobicContact CD2-CG2 4.01Å |
| 184 | K | 89.2 | Confident | 88.7 | Confident | 31 Ų | 31 | 21.6 Ų | 21.6 | 14% | 0.135 | 12% | 0.121 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -125.3 | 120.5 | 174.3 | -58.8 | -171.4 | -159.4 | 79.2 | 0 | 108.6 | F163 V194 L195 | F163-K184 HydrophobicContact CD1-CD 4.21Å; F163-K184 VanDerWaalsContact CD1-NZ 3.27Å; F163-K184 HydrophobicContact CE1-CD 4.44Å; K184-V194 WeakPolarHBondContact O-CA 3.28Å; K184-L195 HydrophobicContact CB-CB 4.19Å; K184-L195 PolarHBondContact O-N 3.23Å |
| 185 | V | 91.1 | Very high | 88.9 | Confident | 2 Ų | 2 | 18.6 Ų | 18.6 | 1% | 0.012 | 11% | 0.105 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -131.7 | 138.9 | -172.9 | -167.9 | 0 | 0 | 0 | 0 | 109.6 | I178 L183 L192 L193 V194 I231 | I178-V185 HydrophobicContact CB-CB 4.3Å; I178-V185 PolarHBondContact N-O 2.89Å; I178-V185 PolarHBondContact O-N 2.8Å; L183-V185 HydrophobicContact CD1-CG2 3.5Å; L183-V185 VanDerWaalsContact CD1-CG2 3.5Å; L183-V185 HydrophobicContact CD2-CG2 4.19Å; L183-V185 HydrophobicContact CG-CG2 3.63Å; V185-L192 HydrophobicContact CG1-CD1 3.24Å; V185-L192 HydrophobicContact CG1-CD2 4.12Å; V185-L192 HydrophobicContact CG1-CG 3.52Å; V185-L193 CarbonylContact C-O 3.55Å; V185-L193 WeakPolarHBondContact CA-O 3.41Å; V185-V194 HydrophobicContact CG1-CG2 4.32Å; V185-V194 HydrophobicContact CG2-CG2 4.19Å; V185-I231 HydrophobicContact CB-CD1 4.13Å; V185-I231 HydrophobicContact CG1-CD1 3.82Å; V185-I231 HydrophobicContact CG2-CD1 4.07Å |
| 186 | I | 91.9 | Very high | 88.6 | Confident | 2 Ų | 2 | 19.2 Ų | 19.2 | 1% | 0.01 | 11% | 0.107 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.2 | 122.6 | 165.8 | -53.7 | 171.3 | 0 | 0 | 0 | 107 | L154 L156 L161 C175 I176 L193 L195 | L154-I186 HydrophobicContact CD1-CD1 3.7Å; L154-I186 HydrophobicContact CD1-CG2 4.07Å; L156-I186 HydrophobicContact CD1-CD1 3.93Å; L156-I186 HydrophobicContact CD1-CG2 4.5Å; L161-I186 HydrophobicContact CD2-CD1 3.66Å; C175-I186 HydrophobicContact CB-CG2 4.01Å; I176-I186 CarbonylContact O-C 3.49Å; I176-I186 WeakPolarHBondContact O-CA 3.44Å; I186-L193 HydrophobicContact CB-CB 4.34Å; I186-L193 PolarHBondContact N-O 3.07Å; I186-L193 PolarHBondContact O-N 3.02Å; I186-L195 HydrophobicContact CD1-CD1 3.73Å; I186-L195 HydrophobicContact CD1-CG 4.44Å; I186-L195 HydrophobicContact CG1-CD1 4.21Å |
| 187 | L | 92.4 | Very high | 88.1 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 12% | 0.115 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -106.5 | 129.4 | -179.5 | -170.8 | 157.1 | 0 | 0 | 0 | 108.4 | C175 I176 L192 E224 A227 L309 | C175-L187 CarbonylContact C-O 3.54Å; C175-L187 VanDerWaalsContact CA-O 3.28Å; C175-L187 WeakPolarHBondContact CA-O 3.33Å; I176-L187 HydrophobicContact CB-CB 4.1Å; I176-L187 HydrophobicContact CD1-CD2 3.91Å; I176-L187 HydrophobicContact CG1-CD2 4.28Å; I176-L187 PolarHBondContact N-O 3.28Å; I176-L187 PolarHBondContact O-N 3.49Å; L187-L192 HydrophobicContact CB-CD1 3.68Å; L187-L192 HydrophobicContact CD1-CD1 3.74Å; L187-L192 HydrophobicContact CG-CD1 3.71Å; L187-E224 HydrophobicContact CD2-CB 3.44Å; L187-E224 VanDerWaalsContact CD2-CB 3.44Å; L187-A227 HydrophobicContact CD1-CB 3.43Å; L187-A227 VanDerWaalsContact CD1-CB 3.43Å; L187-A227 HydrophobicContact CG-CB 4.3Å; L187-L309 HydrophobicContact CD2-CD1 3.65Å |
| 188 | T | 89.6 | Confident | 87.2 | Confident | 22 Ų | 22 | 29.5 Ų | 29.5 | 14% | 0.135 | 15% | 0.146 | C | C | . | . | trans | -117.4 | 169.7 | 171.3 | 65.1 | 0 | 0 | 0 | 0 | 108.1 | L154 E190 S191 | L154-T188 HydrophobicContact CD2-CG2 3.93Å; T188-E190 PolarHBondContact O-N 3.43Å; T188-S191 PolarHBondContact N-O 2.9Å; T188-S191 PolarHBondContact OG1-N 2.68Å; T188-S191 PolarHBondContact OG1-O 3.15Å; T188-S191 PolarHBondContact OG1-OG 2.93Å | ||
| 189 | Q | 83.6 | Confident | 86.2 | Confident | 56 Ų | 56 | 31.2 Ų | 31.2 | 26% | 0.262 | 16% | 0.164 | S | C | . | . | S | Bend | trans | -61.4 | -29.4 | -179.3 | 91.9 | -173.1 | 5.5 | 0 | 0 | 113.1 | L309 T313 | Q189-L309 HydrophobicContact CB-CB 4.45Å; Q189-T313 VanDerWaalsContact OE1-CG2 3.28Å; Q189-T313 PolarHBondContact OE1-OG1 2.96Å |
| 190 | E | 83.4 | Confident | 85.5 | Confident | 114 Ų | 114 | 37 Ų | 37 | 53% | 0.533 | 20% | 0.196 | S | C | . | . | S | Bend | trans | -108.8 | -17.6 | -170.4 | -86.6 | 161.3 | -143.3 | 0 | 0 | 113 | L136 T188 | L136-E190 HydrophobicContact CD1-CG 4.36Å; T188-E190 PolarHBondContact O-N 3.43Å |
| 191 | S | 90 | Very high | 85.1 | Confident | 12 Ų | 12 | 41.4 Ų | 41.4 | 8% | 0.084 | 23% | 0.228 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -156.4 | 151.5 | -173.9 | 68.3 | 0 | 0 | 0 | 0 | 114.1 | F134 T188 | F134-S191 CarbonylContact O-C 3.55Å; F134-S191 WeakPolarHBondContact O-CA 3.32Å; F134-S191 WeakPolarHBondContact O-CB 3.42Å; T188-S191 PolarHBondContact N-O 2.9Å; T188-S191 PolarHBondContact OG1-N 2.68Å; T188-S191 PolarHBondContact OG1-O 3.15Å; T188-S191 PolarHBondContact OG1-OG 2.93Å |
| 192 | L | 92.5 | Very high | 85.2 | Confident | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 21% | 0.214 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 125.4 | 173.7 | -166.6 | 72.4 | 0 | 0 | 0 | 109.5 | K133 F134 V185 L187 L210 L214 F223 A227 I231 | K133-L192 CarbonylContact C-O 3.56Å; K133-L192 WeakPolarHBondContact CA-O 3.44Å; F134-L192 HydrophobicContact CB-CB 4.07Å; F134-L192 HydrophobicContact CD2-CB 4.31Å; F134-L192 HydrophobicContact CD2-CD2 4.34Å; F134-L192 PolarHBondContact N-O 2.92Å; F134-L192 PolarHBondContact O-N 3.31Å; V185-L192 HydrophobicContact CG1-CD1 3.24Å; V185-L192 HydrophobicContact CG1-CD2 4.12Å; V185-L192 HydrophobicContact CG1-CG 3.52Å; L187-L192 HydrophobicContact CB-CD1 3.68Å; L187-L192 HydrophobicContact CD1-CD1 3.74Å; L187-L192 HydrophobicContact CG-CD1 3.71Å; L192-L210 HydrophobicContact CD2-CD1 4.35Å; L192-L210 HydrophobicContact CD2-CD2 3.79Å; L192-L210 HydrophobicContact CD2-CG 4.44Å; L192-L214 HydrophobicContact CD2-CD1 4.08Å; L192-F223 HydrophobicContact CB-CE1 4.25Å; L192-F223 HydrophobicContact CB-CZ 4Å; L192-A227 HydrophobicContact CD1-CB 4.04Å; L192-A227 HydrophobicContact CD2-CB 4.45Å; L192-I231 HydrophobicContact CD1-CD1 4.1Å; L192-I231 HydrophobicContact CD2-CD1 4.29Å |
| 193 | L | 91.4 | Very high | 85.4 | Confident | 6 Ų | 6 | 41.1 Ų | 41.1 | 3% | 0.031 | 21% | 0.212 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.3 | 112.4 | -179.3 | -60 | 170.3 | 0 | 0 | 0 | 109.8 | V131 K133 F143 L150 L154 V185 I186 | V131-L193 HydrophobicContact CG1-CB 4.11Å; V131-L193 HydrophobicContact CG1-CD2 3.86Å; K133-L193 HydrophobicContact CB-CD2 3.7Å; K133-L193 HydrophobicContact CD-CD2 4.04Å; K133-L193 HydrophobicContact CG-CD2 3.69Å; F143-L193 HydrophobicContact CZ-CD2 4.35Å; L150-L193 HydrophobicContact CD1-CD1 4.43Å; L154-L193 HydrophobicContact CD1-CD1 3.92Å; L154-L193 HydrophobicContact CD2-CD1 4.16Å; V185-L193 CarbonylContact C-O 3.55Å; V185-L193 WeakPolarHBondContact CA-O 3.41Å; I186-L193 HydrophobicContact CB-CB 4.34Å; I186-L193 PolarHBondContact N-O 3.07Å; I186-L193 PolarHBondContact O-N 3.02Å |
| 194 | V | 91.7 | Very high | 85.4 | Confident | 1 Ų | 1 | 49.3 Ų | 49.3 | 1% | 0.006 | 24% | 0.242 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -97.7 | 122 | 175.6 | -175.1 | 0 | 0 | 0 | 0 | 109.6 | V131 M132 F134 L183 K184 V185 L206 | V131-V194 WeakPolarHBondContact CA-O 3.38Å; M132-V194 HydrophobicContact CB-CB 4.39Å; M132-V194 PolarHBondContact N-O 3.14Å; M132-V194 PolarHBondContact O-N 3.32Å; F134-V194 HydrophobicContact CD2-CG2 4.35Å; F134-V194 HydrophobicContact CE2-CG2 3.82Å; L183-V194 HydrophobicContact CD1-CG1 3.87Å; K184-V194 WeakPolarHBondContact O-CA 3.28Å; V185-V194 HydrophobicContact CG1-CG2 4.32Å; V185-V194 HydrophobicContact CG2-CG2 4.19Å; V194-L206 HydrophobicContact CG1-CD1 4.04Å; V194-L206 HydrophobicContact CG1-CD2 4.31Å; V194-L206 HydrophobicContact CG2-CD2 3.9Å |
| 195 | L | 88.6 | Confident | 85.4 | Confident | 7 Ų | 7 | 48.6 Ų | 48.6 | 4% | 0.037 | 24% | 0.239 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.3 | 134.1 | -173.4 | -55.4 | -177.9 | 0 | 0 | 0 | 112.3 | F129 V131 L150 L161 K184 I186 Y197 | F129-L195 HydrophobicContact CD1-CB 4.49Å; V131-L195 HydrophobicContact CB-CD2 4.37Å; V131-L195 HydrophobicContact CG1-CD2 4.04Å; V131-L195 HydrophobicContact CG2-CD2 3.64Å; L150-L195 HydrophobicContact CD2-CD1 4.11Å; L150-L195 HydrophobicContact CD2-CD2 3.64Å; L161-L195 HydrophobicContact CD2-CD1 3.96Å; K184-L195 HydrophobicContact CB-CB 4.19Å; K184-L195 PolarHBondContact O-N 3.23Å; I186-L195 HydrophobicContact CD1-CD1 3.73Å; I186-L195 HydrophobicContact CD1-CG 4.44Å; I186-L195 HydrophobicContact CG1-CD1 4.21Å; L195-Y197 VanDerWaalsContact C-N 3.28Å; L195-Y197 PolarHBondContact O-N 2.87Å |
| 196 | D | 82.3 | Confident | 85.2 | Confident | 21 Ų | 21 | 48.5 Ų | 48.5 | 11% | 0.112 | 24% | 0.238 | C | C | . | . | S | Bend | trans | 46.6 | 53.8 | 173 | -166.5 | 16.3 | 0 | 0 | 0 | 111.3 | F129 N130 F163 R198 | F129-D196 HydrophobicContact CD1-CB 4.23Å; N130-D196 PolarHBondContact O-N 2.99Å; F163-D196 HydrophobicContact CE1-CB 4.08Å; F163-D196 WeakPolarHBondContact CE1-OD2 3.49Å; F163-D196 HydrophobicContact CZ-CB 4.49Å; D196-R198 PolarHBondContact O-N 3.21Å; D196-R198 WeakPolarHBondContact OD1-CG 3.38Å; D196-R198 IonicContact OD1-CZ 2.68Å; D196-R198 IonicContact OD1-NE 3.44Å; D196-R198 PolarHBondContact OD1-NE 3.5Å; D196-R198 IonicContact OD1-NH2 3.43Å; D196-R198 PolarHBondContact OD1-NH2 3.14Å; D196-R198 IonicContact OD2-CZ 2.78Å; D196-R198 IonicContact OD2-NE 2.84Å; D196-R198 PolarHBondContact OD2-NE 3.37Å; D196-R198 IonicContact OD2-NH2 3.59Å; D196-R198 PolarHBondContact OD2-NH2 3.1Å |
| 197 | Y | 80.6 | Confident | 84.9 | Confident | 39 Ų | 39 | 51.8 Ų | 51.8 | 15% | 0.153 | 26% | 0.258 | C | S | . | . | trans | -67.2 | 118.9 | 172.2 | 55.9 | -89.1 | 0 | 0 | 0 | 107.9 | N130 M132 L195 E203 L206 | N130-Y197 HydrophobicContact CB-CE1 4.37Å; M132-Y197 HydrophobicContact CB-CD1 3.99Å; M132-Y197 HydrophobicContact CB-CE1 3.63Å; M132-Y197 HydrophobicContact CE-CE1 4.11Å; M132-Y197 HydrophobicContact CE-CE2 3.96Å; L195-Y197 VanDerWaalsContact C-N 3.28Å; L195-Y197 PolarHBondContact O-N 2.87Å; Y197-E203 HydrophobicContact CD2-CG 3.43Å; Y197-E203 VanDerWaalsContact CD2-CG 3.43Å; Y197-E203 WeakPolarHBondContact CD2-OE1 3.25Å; Y197-E203 HydrophobicContact CE2-CG 3.74Å; Y197-E203 WeakPolarHBondContact CE2-OE1 3.46Å; Y197-L206 HydrophobicContact CG-CD1 4.4Å | ||
| 198 | R | 71.6 | Confident | 84.6 | Confident | 182 Ų | 182 | 56.9 Ų | 56.9 | 69% | 0.687 | 29% | 0.285 | S | S | * | . | trans | -121.2 | 122.6 | 177.8 | -62.1 | -168.3 | -169.5 | -177.6 | 7.4 | 109.3 | D196 | D196-R198 PolarHBondContact O-N 3.21Å; D196-R198 WeakPolarHBondContact OD1-CG 3.38Å; D196-R198 IonicContact OD1-CZ 2.68Å; D196-R198 IonicContact OD1-NE 3.44Å; D196-R198 PolarHBondContact OD1-NE 3.5Å; D196-R198 IonicContact OD1-NH2 3.43Å; D196-R198 PolarHBondContact OD1-NH2 3.14Å; D196-R198 IonicContact OD2-CZ 2.78Å; D196-R198 IonicContact OD2-NE 2.84Å; D196-R198 PolarHBondContact OD2-NE 3.37Å; D196-R198 IonicContact OD2-NH2 3.59Å; D196-R198 PolarHBondContact OD2-NH2 3.1Å | ||
| 199 | G | 72.1 | Confident | 84.5 | Confident | 37 Ų | 37 | 60.4 Ų | 60.4 | 38% | 0.381 | 30% | 0.3 | S | S | . | . | S | Bend | trans | 113 | 136.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | S201 L202 E203 | G199-S201 PolarHBondContact O-N 3.3Å; G199-L202 PolarHBondContact O-N 3.29Å; G199-L202 VanDerWaalsContact O-N 3.17Å; G199-E203 PolarHBondContact O-N 3.49Å |
| 200 | L | 74.7 | Confident | 84.6 | Confident | 146 Ų | 146 | 57.8 Ų | 57.8 | 76% | 0.764 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -60.3 | -30.6 | -177.3 | -66.8 | 164 | 0 | 0 | 0 | 113.1 | R204 | L200-R204 WeakPolarHBondContact O-CB 3.48Å; L200-R204 PolarHBondContact O-N 2.94Å |
| 201 | S | 80.6 | Confident | 84.8 | Confident | 101 Ų | 101 | 52.8 Ų | 52.8 | 71% | 0.706 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -67.8 | -40.6 | 178.2 | 51 | 0 | 0 | 0 | 0 | 112.2 | G199 W205 | G199-S201 PolarHBondContact O-N 3.3Å; S201-W205 WeakPolarHBondContact O-CB 3.47Å; S201-W205 PolarHBondContact O-N 2.99Å; S201-W205 VanDerWaalsContact O-N 3.07Å |
| 202 | L | 84 | Confident | 84.5 | Confident | 9 Ų | 9 | 55.6 Ų | 55.6 | 5% | 0.047 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -70.5 | -46.3 | 178.3 | -171.9 | 67.5 | 0 | 0 | 0 | 110.6 | L183 G199 R204 W205 L206 | L183-L202 HydrophobicContact CD1-CD1 4.26Å; G199-L202 PolarHBondContact O-N 3.29Å; G199-L202 VanDerWaalsContact O-N 3.17Å; L202-R204 VanDerWaalsContact C-N 3.28Å; L202-R204 PolarHBondContact O-N 2.77Å; L202-W205 HydrophobicContact CD1-CE3 4.42Å; L202-W205 PolarHBondContact O-N 3.12Å; L202-L206 HydrophobicContact CG-CD1 4.07Å; L202-L206 HydrophobicContact CG-CG 4.36Å; L202-L206 WeakPolarHBondContact O-CB 3.49Å; L202-L206 WeakPolarHBondContact O-CG 3.39Å; L202-L206 PolarHBondContact O-N 3.08Å |
| 203 | E | 84.6 | Confident | 84.1 | Confident | 70 Ų | 70 | 58.8 Ų | 58.8 | 33% | 0.327 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -56.6 | -43.8 | 175 | -73.5 | 174.6 | -171.1 | 0 | 0 | 112 | Y197 G199 L206 V207 | Y197-E203 HydrophobicContact CD2-CG 3.43Å; Y197-E203 VanDerWaalsContact CD2-CG 3.43Å; Y197-E203 WeakPolarHBondContact CD2-OE1 3.25Å; Y197-E203 HydrophobicContact CE2-CG 3.74Å; Y197-E203 WeakPolarHBondContact CE2-OE1 3.46Å; G199-E203 PolarHBondContact O-N 3.49Å; E203-L206 PolarHBondContact O-N 2.93Å; E203-V207 WeakPolarHBondContact O-CG2 3.39Å; E203-V207 PolarHBondContact O-N 3.18Å; E203-V207 VanDerWaalsContact O-N 3.1Å |
| 204 | R | 87.4 | Confident | 83.8 | Confident | 177 Ų | 177 | 58.5 Ų | 58.5 | 67% | 0.668 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -61.9 | -45.4 | 177.8 | -175 | 174.2 | -174.9 | -178.9 | 0.3 | 111.7 | L200 L202 V207 L208 | L200-R204 WeakPolarHBondContact O-CB 3.48Å; L200-R204 PolarHBondContact O-N 2.94Å; L202-R204 VanDerWaalsContact C-N 3.28Å; L202-R204 PolarHBondContact O-N 2.77Å; R204-V207 PolarHBondContact O-N 3.49Å; R204-L208 HydrophobicContact CG-CD1 3.49Å; R204-L208 VanDerWaalsContact CG-CD1 3.49Å; R204-L208 HydrophobicContact CG-CG 4.21Å; R204-L208 VanDerWaalsContact O-CB 3.25Å; R204-L208 WeakPolarHBondContact O-CB 3.42Å; R204-L208 WeakPolarHBondContact O-CG 3.5Å; R204-L208 PolarHBondContact O-N 2.93Å |
| 205 | W | 89.8 | Confident | 83.2 | Confident | 17 Ų | 17 | 60.5 Ų | 60.5 | 6% | 0.064 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -62.7 | -46.1 | 176.7 | 178.4 | 79 | 0 | 0 | 0 | 111.8 | L183 S201 L202 V207 E209 L210 H234 | L183-W205 HydrophobicContact CD2-CZ3 4.49Å; S201-W205 WeakPolarHBondContact O-CB 3.47Å; S201-W205 PolarHBondContact O-N 2.99Å; S201-W205 VanDerWaalsContact O-N 3.07Å; L202-W205 HydrophobicContact CD1-CE3 4.42Å; L202-W205 PolarHBondContact O-N 3.12Å; W205-V207 VanDerWaalsContact C-N 3.29Å; W205-V207 PolarHBondContact O-N 2.63Å; W205-E209 HydrophobicContact CG-CB 4.44Å; W205-E209 PolarHBondContact NE1-OE2 3.1Å; W205-E209 WeakPolarHBondContact O-CA 3.46Å; W205-E209 WeakPolarHBondContact O-CB 3.19Å; W205-E209 PolarHBondContact O-N 3.38Å; W205-L210 HydrophobicContact CE3-CB 4.48Å; W205-L210 HydrophobicContact CH2-CB 3.85Å; W205-L210 HydrophobicContact CH2-CD1 3.9Å; W205-L210 HydrophobicContact CH2-CD2 4.07Å; W205-L210 HydrophobicContact CH2-CG 4.16Å; W205-L210 HydrophobicContact CZ2-CB 4.08Å; W205-L210 HydrophobicContact CZ2-CD1 4.45Å; W205-L210 HydrophobicContact CZ3-CB 4.07Å; W205-L210 HydrophobicContact CZ3-CD2 3.93Å; W205-L210 HydrophobicContact CZ3-CG 4.43Å; W205-L210 PolarHBondContact O-N 2.87Å; W205-L210 VanDerWaalsContact O-N 3.1Å; W205-H234 AromaticContact CD1-CE1 3.79Å; W205-H234 AromaticContact CD1-ND1 3.3Å; W205-H234 VanDerWaalsContact CD1-ND1 3.3Å; W205-H234 HydrophobicContact CD2-CB 4.35Å; W205-H234 AromaticContact CD2-CE1 3.55Å; W205-H234 AromaticContact CD2-CG 3.74Å; W205-H234 AromaticContact CD2-ND1 3.17Å; W205-H234 AromaticContact CE2-CE1 3.98Å; W205-H234 AromaticContact CE2-CG 3.5Å; W205-H234 AromaticContact CE2-ND1 3.13Å; W205-H234 AromaticContact CE3-CE1 3.98Å; W205-H234 AromaticContact CE3-ND1 3.82Å; W205-H234 AromaticContact CG-CE1 3.54Å; W205-H234 AromaticContact CG-ND1 3.39Å; W205-H234 HydrophobicContact CH2-CB 3.65Å; W205-H234 AromaticContact CH2-CG 3.89Å; W205-H234 HydrophobicContact CZ2-CB 3.33Å; W205-H234 AromaticContact CZ2-CG 3.67Å; W205-H234 AromaticContact CZ2-ND1 3.8Å; W205-H234 HydrophobicContact CZ3-CB 4.3Å; W205-H234 AromaticContact NE1-CG 3.91Å; W205-H234 AromaticContact NE1-ND1 3.15Å; W205-H234 PolarHBondContact NE1-ND1 3.16Å; W205-H234 VanDerWaalsContact NE1-ND1 3.15Å |
| 206 | L | 87.3 | Confident | 82.5 | Confident | 0 Ų | 0 | 62.2 Ų | 62.2 | 0% | 0 | 33% | 0.326 | C | S | . | . | I | π-helix | trans | -56.3 | -40.7 | 179.1 | -75.9 | 173.3 | 0 | 0 | 0 | 112.6 | M132 F134 V194 Y197 L202 E203 L210 A211 | M132-L206 HydrophobicContact SD-CB 4.1Å; M132-L206 HydrophobicContact SD-CD1 4.08Å; F134-L206 WeakPolarHBondContact CE1-O 3.47Å; F134-L206 HydrophobicContact CE2-CD2 4.38Å; F134-L206 HydrophobicContact CZ-CB 4.08Å; F134-L206 HydrophobicContact CZ-CD2 4.2Å; V194-L206 HydrophobicContact CG1-CD1 4.04Å; V194-L206 HydrophobicContact CG1-CD2 4.31Å; V194-L206 HydrophobicContact CG2-CD2 3.9Å; Y197-L206 HydrophobicContact CG-CD1 4.4Å; L202-L206 HydrophobicContact CG-CD1 4.07Å; L202-L206 HydrophobicContact CG-CG 4.36Å; L202-L206 WeakPolarHBondContact O-CB 3.49Å; L202-L206 WeakPolarHBondContact O-CG 3.39Å; L202-L206 PolarHBondContact O-N 3.08Å; E203-L206 PolarHBondContact O-N 2.93Å; L206-L210 HydrophobicContact CD2-CD2 3.45Å; L206-L210 VanDerWaalsContact CD2-CD2 3.45Å; L206-L210 WeakPolarHBondContact O-CB 3.37Å; L206-A211 PolarHBondContact O-N 2.87Å; L206-A211 VanDerWaalsContact O-N 3.14Å |
| 207 | V | 85.7 | Confident | 81.7 | Confident | 71 Ų | 71 | 69.1 Ų | 69.1 | 43% | 0.43 | 36% | 0.358 | S | S | . | . | I | π-helix | trans | -88.4 | -40.5 | -177.1 | 178.6 | 0 | 0 | 0 | 0 | 112.6 | E203 R204 W205 | E203-V207 WeakPolarHBondContact O-CG2 3.39Å; E203-V207 PolarHBondContact O-N 3.18Å; E203-V207 VanDerWaalsContact O-N 3.1Å; R204-V207 PolarHBondContact O-N 3.49Å; W205-V207 VanDerWaalsContact C-N 3.29Å; W205-V207 PolarHBondContact O-N 2.63Å |
| 208 | L | 85.9 | Confident | 80.4 | Confident | 106 Ų | 106 | 71.9 Ų | 71.9 | 56% | 0.555 | 38% | 0.379 | S | S | * | . | I | π-helix | trans | -87.9 | -25.2 | -173.1 | -63.5 | -178.9 | 0 | 0 | 0 | 114 | R204 P212 | R204-L208 HydrophobicContact CG-CD1 3.49Å; R204-L208 VanDerWaalsContact CG-CD1 3.49Å; R204-L208 HydrophobicContact CG-CG 4.21Å; R204-L208 VanDerWaalsContact O-CB 3.25Å; R204-L208 WeakPolarHBondContact O-CB 3.42Å; R204-L208 WeakPolarHBondContact O-CG 3.5Å; R204-L208 PolarHBondContact O-N 2.93Å; L208-P212 WeakPolarHBondContact O-CG 3.37Å |
| 209 | E | 85.9 | Confident | 79.6 | Confident | 96 Ų | 96 | 69.3 Ų | 69.3 | 45% | 0.449 | 38% | 0.375 | S | S | . | . | I | π-helix | trans | -116.1 | -50.7 | -175.8 | -67.2 | 178.1 | -143.4 | 0 | 0 | 111.3 | W205 P212 Q213 | W205-E209 HydrophobicContact CG-CB 4.44Å; W205-E209 PolarHBondContact NE1-OE2 3.1Å; W205-E209 WeakPolarHBondContact O-CA 3.46Å; W205-E209 WeakPolarHBondContact O-CB 3.19Å; W205-E209 PolarHBondContact O-N 3.38Å; E209-P212 WeakPolarHBondContact O-CD 3.41Å; E209-Q213 WeakPolarHBondContact O-CB 3.31Å; E209-Q213 WeakPolarHBondContact O-CG 3.18Å; E209-Q213 PolarHBondContact O-N 3.35Å |
| 210 | L | 87.3 | Confident | 79.3 | Confident | 1 Ų | 1 | 73.8 Ų | 73.8 | 1% | 0.005 | 40% | 0.4 | C | S | . | . | I | π-helix | trans | -69.6 | -50.6 | -176 | 179.5 | 67.6 | 0 | 0 | 0 | 112.8 | F134 L192 W205 L206 Q213 L214 A230 | F134-L210 HydrophobicContact CE1-CD2 4.33Å; F134-L210 HydrophobicContact CE2-CD2 4.2Å; F134-L210 HydrophobicContact CZ-CD2 4.06Å; L192-L210 HydrophobicContact CD2-CD1 4.35Å; L192-L210 HydrophobicContact CD2-CD2 3.79Å; L192-L210 HydrophobicContact CD2-CG 4.44Å; W205-L210 HydrophobicContact CE3-CB 4.48Å; W205-L210 HydrophobicContact CH2-CB 3.85Å; W205-L210 HydrophobicContact CH2-CD1 3.9Å; W205-L210 HydrophobicContact CH2-CD2 4.07Å; W205-L210 HydrophobicContact CH2-CG 4.16Å; W205-L210 HydrophobicContact CZ2-CB 4.08Å; W205-L210 HydrophobicContact CZ2-CD1 4.45Å; W205-L210 HydrophobicContact CZ3-CB 4.07Å; W205-L210 HydrophobicContact CZ3-CD2 3.93Å; W205-L210 HydrophobicContact CZ3-CG 4.43Å; W205-L210 PolarHBondContact O-N 2.87Å; W205-L210 VanDerWaalsContact O-N 3.1Å; L206-L210 HydrophobicContact CD2-CD2 3.45Å; L206-L210 VanDerWaalsContact CD2-CD2 3.45Å; L206-L210 WeakPolarHBondContact O-CB 3.37Å; L210-Q213 PolarHBondContact O-N 2.86Å; L210-L214 HydrophobicContact CD1-CD1 4.04Å; L210-L214 HydrophobicContact CD1-CD2 4.47Å; L210-L214 HydrophobicContact CD1-CG 4.11Å; L210-L214 HydrophobicContact CD2-CD1 4.5Å; L210-L214 HydrophobicContact CG-CD1 3.86Å; L210-L214 HydrophobicContact CG-CG 4.32Å; L210-L214 VanDerWaalsContact O-CG 3.31Å; L210-L214 WeakPolarHBondContact O-CG 3.33Å; L210-L214 PolarHBondContact O-N 3.2Å; L210-A230 HydrophobicContact CD1-CB 3.42Å; L210-A230 VanDerWaalsContact CD1-CB 3.42Å |
| 211 | A | 86.1 | Confident | 79.4 | Confident | 10 Ų | 10 | 68.9 Ų | 68.9 | 8% | 0.083 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -56.4 | -46.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | F134 V140 L206 Q213 L214 A215 | F134-A211 HydrophobicContact CD1-CB 4.06Å; F134-A211 HydrophobicContact CE1-CB 3.9Å; V140-A211 HydrophobicContact CG2-CB 3.74Å; L206-A211 PolarHBondContact O-N 2.87Å; L206-A211 VanDerWaalsContact O-N 3.14Å; A211-Q213 PolarHBondContact O-N 3.25Å; A211-L214 PolarHBondContact O-N 3.3Å; A211-A215 WeakPolarHBondContact O-CB 3.14Å; A211-A215 PolarHBondContact O-N 3.17Å |
| 212 | P | 84.9 | Confident | 79.6 | Confident | 70 Ų | 70 | 65.1 Ų | 65.1 | 46% | 0.455 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -63.7 | -38.4 | 175.5 | -24.7 | 35.5 | 0 | 0 | 0 | 113.7 | L208 E209 L214 A215 S216 | L208-P212 WeakPolarHBondContact O-CG 3.37Å; E209-P212 WeakPolarHBondContact O-CD 3.41Å; P212-L214 VanDerWaalsContact C-N 3.29Å; P212-L214 PolarHBondContact O-N 3.29Å; P212-A215 PolarHBondContact O-N 2.97Å; P212-S216 WeakPolarHBondContact O-CB 3.22Å; P212-S216 PolarHBondContact O-N 3.18Å |
| 213 | Q | 84.5 | Confident | 79.7 | Confident | 67 Ų | 67 | 65.1 Ų | 65.1 | 31% | 0.313 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -63.6 | -36.5 | 176.4 | -74.4 | 178.7 | 1.1 | 0 | 0 | 111.7 | E209 L210 A211 | E209-Q213 WeakPolarHBondContact O-CB 3.31Å; E209-Q213 WeakPolarHBondContact O-CG 3.18Å; E209-Q213 PolarHBondContact O-N 3.35Å; L210-Q213 PolarHBondContact O-N 2.86Å; A211-Q213 PolarHBondContact O-N 3.25Å |
| 214 | L | 83.5 | Confident | 79.9 | Confident | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -72.7 | -37.3 | 175.1 | -64.9 | 174.1 | 0 | 0 | 0 | 112.8 | F134 L192 L210 A211 P212 S216 F223 R226 A227 | F134-L214 HydrophobicContact CB-CD1 3.69Å; F134-L214 HydrophobicContact CD1-CD1 3.9Å; F134-L214 HydrophobicContact CG-CD1 3.88Å; L192-L214 HydrophobicContact CD2-CD1 4.08Å; L210-L214 HydrophobicContact CD1-CD1 4.04Å; L210-L214 HydrophobicContact CD1-CD2 4.47Å; L210-L214 HydrophobicContact CD1-CG 4.11Å; L210-L214 HydrophobicContact CD2-CD1 4.5Å; L210-L214 HydrophobicContact CG-CD1 3.86Å; L210-L214 HydrophobicContact CG-CG 4.32Å; L210-L214 VanDerWaalsContact O-CG 3.31Å; L210-L214 WeakPolarHBondContact O-CG 3.33Å; L210-L214 PolarHBondContact O-N 3.2Å; A211-L214 PolarHBondContact O-N 3.3Å; P212-L214 VanDerWaalsContact C-N 3.29Å; P212-L214 PolarHBondContact O-N 3.29Å; L214-S216 VanDerWaalsContact C-N 3.29Å; L214-S216 PolarHBondContact O-N 3.14Å; L214-F223 HydrophobicContact CB-CE2 4.41Å; L214-F223 HydrophobicContact CD2-CE2 3.92Å; L214-F223 HydrophobicContact CD2-CZ 4.26Å; L214-R226 PolarHBondContact O-NH1 3.16Å; L214-A227 HydrophobicContact CD2-CB 3.57Å |
| 215 | A | 80.6 | Confident | 80 | Confident | 43 Ų | 43 | 53.6 Ų | 53.6 | 36% | 0.355 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -70.3 | -26.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | E137 A211 P212 Q217 | E137-A215 WeakPolarHBondContact O-CB 3.39Å; A211-A215 WeakPolarHBondContact O-CB 3.14Å; A211-A215 PolarHBondContact O-N 3.17Å; P212-A215 PolarHBondContact O-N 2.97Å; A215-Q217 PolarHBondContact O-N 3.42Å |
| 216 | S | 72.9 | Confident | 79.9 | Confident | 43 Ų | 43 | 54.4 Ų | 54.4 | 30% | 0.301 | 30% | 0.304 | S | S | . | . | trans | -66.8 | 102.9 | -178.5 | -166.8 | 0 | 0 | 0 | 0 | 110.9 | P212 L214 T218 R226 | P212-S216 WeakPolarHBondContact O-CB 3.22Å; P212-S216 PolarHBondContact O-N 3.18Å; L214-S216 VanDerWaalsContact C-N 3.29Å; L214-S216 PolarHBondContact O-N 3.14Å; S216-T218 PolarHBondContact O-N 2.98Å; S216-T218 VanDerWaalsContact O-N 3.09Å; S216-T218 WeakPolarHBondContact OG-CG2 3.24Å; S216-T218 PolarHBondContact OG-OG1 2.97Å; S216-R226 PolarHBondContact O-NH1 3.28Å | ||
| 217 | Q | 65 | Low | 80.1 | Confident | 167 Ų | 167 | 54.4 Ų | 54.4 | 78% | 0.78 | 30% | 0.304 | S | S | * | . | trans | -79.7 | 34.6 | 171.3 | -63.6 | -174.8 | 0.3 | 0 | 0 | 111.8 | A215 H219 | A215-Q217 PolarHBondContact O-N 3.42Å; Q217-H219 PolarHBondContact O-N 2.77Å | ||
| 218 | T | 54.5 | Low | 80.4 | Confident | 97 Ų | 97 | 51 Ų | 51 | 60% | 0.595 | 28% | 0.283 | S | S | * | . | trans | -71.2 | -15.7 | -172.1 | 38.6 | 0 | 0 | 0 | 0 | 113.7 | S216 | S216-T218 PolarHBondContact O-N 2.98Å; S216-T218 VanDerWaalsContact O-N 3.09Å; S216-T218 WeakPolarHBondContact OG-CG2 3.24Å; S216-T218 PolarHBondContact OG-OG1 2.97Å | ||
| 219 | H | 53.8 | Low | 80.7 | Confident | 128 Ų | 128 | 49.7 Ų | 49.7 | 59% | 0.593 | 28% | 0.275 | S | S | * | . | S | Bend | trans | -138.6 | 144 | 177.4 | -61.8 | -74.4 | 0 | 0 | 0 | 109.4 | Q217 L221 | Q217-H219 PolarHBondContact O-N 2.77Å; H219-L221 HydrophobicContact CB-CB 4.41Å; H219-L221 HydrophobicContact CB-CD1 4.02Å; H219-L221 HydrophobicContact CB-CG 4.16Å; H219-L221 PolarHBondContact O-N 3.02Å |
| 220 | S | 67 | Low | 81 | Confident | 130 Ų | 130 | 45.2 Ų | 45.2 | 91% | 0.909 | 25% | 0.254 | S | S | * | . | S | Bend | trans | -64.2 | 15.9 | 174.9 | 57 | 0 | 0 | 0 | 0 | 114.1 | ||
| 221 | L | 76.4 | Confident | 81.2 | Confident | 43 Ų | 43 | 45.2 Ų | 45.2 | 23% | 0.225 | 25% | 0.254 | C | S | . | . | trans | -78.3 | 139.1 | -176.9 | -72.5 | 167.2 | 0 | 0 | 0 | 110.3 | H219 F225 E330 | H219-L221 HydrophobicContact CB-CB 4.41Å; H219-L221 HydrophobicContact CB-CD1 4.02Å; H219-L221 HydrophobicContact CB-CG 4.16Å; H219-L221 PolarHBondContact O-N 3.02Å; L221-F225 HydrophobicContact CB-CB 4.27Å; L221-F225 HydrophobicContact CD2-CD1 4.4Å; L221-E330 VanDerWaalsContact CD2-OE2 3.31Å; L221-E330 WeakPolarHBondContact CD2-OE2 2.87Å | ||
| 222 | P | 83.6 | Confident | 81.6 | Confident | 23 Ų | 23 | 44.7 Ų | 44.7 | 15% | 0.149 | 25% | 0.25 | C | C | . | . | trans | -58 | 159.5 | 177.4 | -23.1 | 32.4 | 0 | 0 | 0 | 113.5 | E224 F225 R226 T310 | P222-E224 VanDerWaalsContact C-N 3.26Å; P222-E224 VanDerWaalsContact CB-CD 3.45Å; P222-E224 HydrophobicContact CB-CG 4.5Å; P222-E224 WeakPolarHBondContact CB-OE2 3.38Å; P222-E224 PolarHBondContact O-N 2.72Å; P222-F225 HydrophobicContact CB-CD2 3.86Å; P222-F225 HydrophobicContact CB-CE2 4.23Å; P222-F225 HydrophobicContact CG-CD2 3.89Å; P222-F225 HydrophobicContact CG-CE2 3.93Å; P222-F225 PolarHBondContact O-N 3.31Å; P222-F225 VanDerWaalsContact O-N 3.16Å; P222-R226 PolarHBondContact O-N 2.87Å; P222-T310 WeakPolarHBondContact CB-OG1 3.27Å | ||
| 223 | F | 86.5 | Confident | 82 | Confident | 8 Ų | 8 | 44.6 Ų | 44.6 | 4% | 0.035 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -58.6 | -37 | -175.3 | 176.4 | -99.5 | 0 | 0 | 0 | 112.8 | L136 L192 L214 F225 R226 A227 | L136-F223 HydrophobicContact CD2-CB 3.65Å; L136-F223 HydrophobicContact CD2-CD1 4.37Å; L136-F223 HydrophobicContact CD2-CD2 3.69Å; L136-F223 HydrophobicContact CD2-CE2 4.41Å; L136-F223 HydrophobicContact CD2-CG 3.65Å; L192-F223 HydrophobicContact CB-CE1 4.25Å; L192-F223 HydrophobicContact CB-CZ 4Å; L214-F223 HydrophobicContact CB-CE2 4.41Å; L214-F223 HydrophobicContact CD2-CE2 3.92Å; L214-F223 HydrophobicContact CD2-CZ 4.26Å; F223-F225 VanDerWaalsContact C-N 3.31Å; F223-F225 PolarHBondContact O-N 3.45Å; F223-R226 PolarHBondContact O-N 2.85Å; F223-A227 HydrophobicContact CE1-CB 4.38Å; F223-A227 WeakPolarHBondContact O-CB 3.3Å; F223-A227 PolarHBondContact O-N 2.86Å |
| 224 | E | 89 | Confident | 82.4 | Confident | 2 Ų | 2 | 43 Ų | 43 | 1% | 0.009 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.4 | -35 | 179.2 | 65.5 | -86.4 | -150.5 | 0 | 0 | 113.3 | I176 L187 P222 L228 L309 T310 | I176-E224 HydrophobicContact CD1-CB 4.45Å; L187-E224 HydrophobicContact CD2-CB 3.44Å; L187-E224 VanDerWaalsContact CD2-CB 3.44Å; P222-E224 VanDerWaalsContact C-N 3.26Å; P222-E224 VanDerWaalsContact CB-CD 3.45Å; P222-E224 HydrophobicContact CB-CG 4.5Å; P222-E224 WeakPolarHBondContact CB-OE2 3.38Å; P222-E224 PolarHBondContact O-N 2.72Å; E224-L228 WeakPolarHBondContact O-CB 3.4Å; E224-L228 PolarHBondContact O-N 2.83Å; E224-L309 PolarHBondContact OE1-N 2.96Å; E224-T310 VanDerWaalsContact CD-OG1 3.23Å; E224-T310 VanDerWaalsContact OE1-CB 3.24Å; E224-T310 WeakPolarHBondContact OE1-CB 3.19Å; E224-T310 PolarHBondContact OE1-N 3.32Å; E224-T310 PolarHBondContact OE1-OG1 3.5Å; E224-T310 PolarHBondContact OE2-OG1 3.38Å; E224-T310 VanDerWaalsContact OE2-OG1 3.08Å |
| 225 | F | 89.4 | Confident | 82.9 | Confident | 3 Ų | 3 | 43.4 Ų | 43.4 | 1% | 0.013 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -68.3 | -49.8 | 178 | -72.2 | -107.8 | 0 | 0 | 0 | 110.2 | L221 P222 F223 A227 L228 E229 H327 E330 M331 L334 | L221-F225 HydrophobicContact CB-CB 4.27Å; L221-F225 HydrophobicContact CD2-CD1 4.4Å; P222-F225 HydrophobicContact CB-CD2 3.86Å; P222-F225 HydrophobicContact CB-CE2 4.23Å; P222-F225 HydrophobicContact CG-CD2 3.89Å; P222-F225 HydrophobicContact CG-CE2 3.93Å; P222-F225 PolarHBondContact O-N 3.31Å; P222-F225 VanDerWaalsContact O-N 3.16Å; F223-F225 VanDerWaalsContact C-N 3.31Å; F223-F225 PolarHBondContact O-N 3.45Å; F225-A227 VanDerWaalsContact C-N 3.34Å; F225-A227 PolarHBondContact O-N 3.09Å; F225-L228 PolarHBondContact O-N 3.26Å; F225-E229 VanDerWaalsContact O-CB 3.24Å; F225-E229 WeakPolarHBondContact O-CB 3.39Å; F225-E229 PolarHBondContact O-N 3.15Å; F225-H327 HydrophobicContact CZ-CB 4.24Å; F225-H327 WeakPolarHBondContact CZ-O 3.32Å; F225-E330 HydrophobicContact CE1-CB 4.12Å; F225-M331 HydrophobicContact CD1-CE 3.71Å; F225-M331 HydrophobicContact CD1-SD 4.39Å; F225-M331 HydrophobicContact CD2-CE 3.97Å; F225-M331 HydrophobicContact CE1-CB 3.65Å; F225-M331 HydrophobicContact CE1-CE 3.62Å; F225-M331 HydrophobicContact CE1-CG 4.48Å; F225-M331 HydrophobicContact CE1-SD 4.29Å; F225-M331 HydrophobicContact CE2-CE 3.86Å; F225-M331 HydrophobicContact CG-CE 3.89Å; F225-M331 HydrophobicContact CZ-CB 3.99Å; F225-M331 HydrophobicContact CZ-CE 3.69Å; F225-L334 HydrophobicContact CD1-CD1 4.33Å |
| 226 | R | 88.3 | Confident | 83.6 | Confident | 34 Ų | 34 | 41.6 Ų | 41.6 | 13% | 0.128 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.3 | -43 | 179.9 | -65.5 | -173.1 | -72.9 | 147.1 | 8.2 | 111.8 | L214 S216 P222 F223 A230 | L214-R226 PolarHBondContact O-NH1 3.16Å; S216-R226 PolarHBondContact O-NH1 3.28Å; P222-R226 PolarHBondContact O-N 2.87Å; F223-R226 PolarHBondContact O-N 2.85Å; R226-A230 WeakPolarHBondContact O-CB 3.05Å; R226-A230 PolarHBondContact O-N 3.01Å |
| 227 | A | 91 | Very high | 84.6 | Confident | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -70.1 | -40.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | L187 L192 L214 F223 F225 I231 | L187-A227 HydrophobicContact CD1-CB 3.43Å; L187-A227 VanDerWaalsContact CD1-CB 3.43Å; L187-A227 HydrophobicContact CG-CB 4.3Å; L192-A227 HydrophobicContact CD1-CB 4.04Å; L192-A227 HydrophobicContact CD2-CB 4.45Å; L214-A227 HydrophobicContact CD2-CB 3.57Å; F223-A227 HydrophobicContact CE1-CB 4.38Å; F223-A227 WeakPolarHBondContact O-CB 3.3Å; F223-A227 PolarHBondContact O-N 2.86Å; F225-A227 VanDerWaalsContact C-N 3.34Å; F225-A227 PolarHBondContact O-N 3.09Å; A227-I231 WeakPolarHBondContact O-CD1 3.49Å; A227-I231 WeakPolarHBondContact O-CG1 3.22Å; A227-I231 PolarHBondContact O-N 3.42Å; A227-I231 VanDerWaalsContact O-N 3.16Å |
| 228 | L | 92.4 | Very high | 85.9 | Confident | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -65.6 | -44 | 175.9 | -176 | 63 | 0 | 0 | 0 | 111.4 | L169 I178 E224 F225 A230 I231 L232 M331 L334 L335 | L169-L228 HydrophobicContact CD1-CD1 4.35Å; L169-L228 HydrophobicContact CD2-CD1 4.32Å; I178-L228 HydrophobicContact CD1-CD1 3.49Å; I178-L228 VanDerWaalsContact CD1-CD1 3.49Å; E224-L228 WeakPolarHBondContact O-CB 3.4Å; E224-L228 PolarHBondContact O-N 2.83Å; F225-L228 PolarHBondContact O-N 3.26Å; L228-A230 PolarHBondContact O-N 3.06Å; L228-I231 PolarHBondContact O-N 2.97Å; L228-L232 HydrophobicContact CD1-CD1 4.15Å; L228-L232 HydrophobicContact CD1-CG 4.21Å; L228-L232 HydrophobicContact CG-CD1 3.88Å; L228-L232 HydrophobicContact CG-CG 4.34Å; L228-L232 WeakPolarHBondContact O-CB 3.46Å; L228-L232 VanDerWaalsContact O-CG 3.29Å; L228-L232 WeakPolarHBondContact O-CG 3.25Å; L228-L232 PolarHBondContact O-N 3.16Å; L228-M331 HydrophobicContact CD2-CE 4.05Å; L228-M331 HydrophobicContact CD2-SD 3.54Å; L228-M331 VanDerWaalsContact CD2-SD 3.54Å; L228-L334 HydrophobicContact CD2-CD2 4.46Å; L228-L335 HydrophobicContact CD2-CD2 4.15Å |
| 229 | E | 92.1 | Very high | 87.8 | Confident | 79 Ų | 79 | 35.1 Ų | 35.1 | 37% | 0.369 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -54.8 | -53 | 175.1 | -171.6 | 174.9 | -165.2 | 0 | 0 | 111.2 | F225 I231 L232 Q233 L334 Y338 | F225-E229 VanDerWaalsContact O-CB 3.24Å; F225-E229 WeakPolarHBondContact O-CB 3.39Å; F225-E229 PolarHBondContact O-N 3.15Å; E229-I231 VanDerWaalsContact C-N 3.29Å; E229-I231 PolarHBondContact O-N 3.37Å; E229-L232 PolarHBondContact O-N 3.26Å; E229-Q233 VanDerWaalsContact O-CB 3.24Å; E229-Q233 WeakPolarHBondContact O-CB 3.46Å; E229-Q233 PolarHBondContact O-N 3.25Å; E229-L334 HydrophobicContact CB-CD1 4.1Å; E229-Y338 HydrophobicContact CG-CE2 3.97Å; E229-Y338 WeakPolarHBondContact CG-OH 3.44Å; E229-Y338 PolarHBondContact O-OH 3.45Å |
| 230 | A | 91.6 | Very high | 89.8 | Confident | 1 Ų | 1 | 31 Ų | 31 | 1% | 0.008 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -58.4 | -40.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L210 R226 L228 H234 | L210-A230 HydrophobicContact CD1-CB 3.42Å; L210-A230 VanDerWaalsContact CD1-CB 3.42Å; R226-A230 WeakPolarHBondContact O-CB 3.05Å; R226-A230 PolarHBondContact O-N 3.01Å; L228-A230 PolarHBondContact O-N 3.06Å; A230-H234 WeakPolarHBondContact O-CB 3.39Å; A230-H234 PolarHBondContact O-N 3.5Å |
| 231 | I | 93 | Very high | 91.1 | Very high | 1 Ų | 1 | 28.4 Ų | 28.4 | 1% | 0.005 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -70.7 | -43.8 | 179.4 | -67.8 | 164.9 | 0 | 0 | 0 | 111.4 | I178 M180 L183 V185 L192 A227 L228 E229 H234 K235 | I178-I231 HydrophobicContact CD1-CD1 3.9Å; I178-I231 HydrophobicContact CD1-CG2 4.27Å; I178-I231 HydrophobicContact CG2-CG2 4.03Å; M180-I231 HydrophobicContact CE-CG2 4.15Å; M180-I231 HydrophobicContact SD-CG2 3.69Å; L183-I231 HydrophobicContact CD2-CG2 4.01Å; V185-I231 HydrophobicContact CB-CD1 4.13Å; V185-I231 HydrophobicContact CG1-CD1 3.82Å; V185-I231 HydrophobicContact CG2-CD1 4.07Å; L192-I231 HydrophobicContact CD1-CD1 4.1Å; L192-I231 HydrophobicContact CD2-CD1 4.29Å; A227-I231 WeakPolarHBondContact O-CD1 3.49Å; A227-I231 WeakPolarHBondContact O-CG1 3.22Å; A227-I231 PolarHBondContact O-N 3.42Å; A227-I231 VanDerWaalsContact O-N 3.16Å; L228-I231 PolarHBondContact O-N 2.97Å; E229-I231 VanDerWaalsContact C-N 3.29Å; E229-I231 PolarHBondContact O-N 3.37Å; I231-H234 PolarHBondContact O-N 3.3Å; I231-K235 PolarHBondContact O-N 3.46Å |
| 232 | L | 94.1 | Very high | 91.9 | Very high | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.2 | -42.6 | 177 | -69.1 | 174.6 | 0 | 0 | 0 | 111.2 | M180 L228 E229 H234 K235 V236 F290 L294 L334 L335 Y338 | M180-L232 HydrophobicContact CE-CD2 3.68Å; L228-L232 HydrophobicContact CD1-CD1 4.15Å; L228-L232 HydrophobicContact CD1-CG 4.21Å; L228-L232 HydrophobicContact CG-CD1 3.88Å; L228-L232 HydrophobicContact CG-CG 4.34Å; L228-L232 WeakPolarHBondContact O-CB 3.46Å; L228-L232 VanDerWaalsContact O-CG 3.29Å; L228-L232 WeakPolarHBondContact O-CG 3.25Å; L228-L232 PolarHBondContact O-N 3.16Å; E229-L232 PolarHBondContact O-N 3.26Å; L232-H234 VanDerWaalsContact C-N 3.33Å; L232-H234 PolarHBondContact O-N 3.28Å; L232-K235 PolarHBondContact O-N 2.82Å; L232-K235 VanDerWaalsContact O-N 3.15Å; L232-V236 PolarHBondContact O-N 2.92Å; L232-F290 HydrophobicContact CD2-CE2 3.65Å; L232-F290 HydrophobicContact CD2-CZ 3.8Å; L232-L294 HydrophobicContact CD2-CD2 3.95Å; L232-L334 HydrophobicContact CD1-CD2 3.82Å; L232-L335 HydrophobicContact CD1-CD2 3.85Å; L232-Y338 HydrophobicContact CB-CD1 3.95Å; L232-Y338 HydrophobicContact CB-CD2 3.74Å; L232-Y338 HydrophobicContact CB-CE1 4.2Å; L232-Y338 HydrophobicContact CB-CE2 4Å; L232-Y338 HydrophobicContact CB-CG 3.73Å; L232-Y338 HydrophobicContact CD1-CD2 3.69Å; L232-Y338 HydrophobicContact CD1-CE2 4.34Å; L232-Y338 HydrophobicContact CD1-CG 4.17Å; L232-Y338 HydrophobicContact CG-CD2 4.37Å |
| 233 | Q | 93.6 | Very high | 92.5 | Very high | 68 Ų | 68 | 28.7 Ų | 28.7 | 32% | 0.318 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -58.3 | -45.4 | 174.7 | -167.8 | -179.6 | 13.9 | 0 | 0 | 111.4 | E229 K235 V236 N237 Y338 | E229-Q233 VanDerWaalsContact O-CB 3.24Å; E229-Q233 WeakPolarHBondContact O-CB 3.46Å; E229-Q233 PolarHBondContact O-N 3.25Å; Q233-K235 VanDerWaalsContact C-N 3.33Å; Q233-K235 PolarHBondContact O-N 2.91Å; Q233-V236 PolarHBondContact O-N 3.06Å; Q233-N237 VanDerWaalsContact O-CB 3.31Å; Q233-N237 WeakPolarHBondContact O-CB 3.46Å; Q233-N237 VanDerWaalsContact O-CG 3.22Å; Q233-N237 PolarHBondContact O-N 3.38Å; Q233-N237 PolarHBondContact O-ND2 2.66Å; Q233-Y338 HydrophobicContact CB-CE1 4Å |
| 234 | H | 92.8 | Very high | 92.8 | Very high | 34 Ų | 34 | 32.3 Ų | 32.3 | 16% | 0.157 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -59.3 | -43.9 | 175.1 | -179 | 71.3 | 0 | 0 | 0 | 112.6 | W205 A230 I231 L232 N237 K238 | W205-H234 AromaticContact CD1-CE1 3.79Å; W205-H234 AromaticContact CD1-ND1 3.3Å; W205-H234 VanDerWaalsContact CD1-ND1 3.3Å; W205-H234 HydrophobicContact CD2-CB 4.35Å; W205-H234 AromaticContact CD2-CE1 3.55Å; W205-H234 AromaticContact CD2-CG 3.74Å; W205-H234 AromaticContact CD2-ND1 3.17Å; W205-H234 AromaticContact CE2-CE1 3.98Å; W205-H234 AromaticContact CE2-CG 3.5Å; W205-H234 AromaticContact CE2-ND1 3.13Å; W205-H234 AromaticContact CE3-CE1 3.98Å; W205-H234 AromaticContact CE3-ND1 3.82Å; W205-H234 AromaticContact CG-CE1 3.54Å; W205-H234 AromaticContact CG-ND1 3.39Å; W205-H234 HydrophobicContact CH2-CB 3.65Å; W205-H234 AromaticContact CH2-CG 3.89Å; W205-H234 HydrophobicContact CZ2-CB 3.33Å; W205-H234 AromaticContact CZ2-CG 3.67Å; W205-H234 AromaticContact CZ2-ND1 3.8Å; W205-H234 HydrophobicContact CZ3-CB 4.3Å; W205-H234 AromaticContact NE1-CG 3.91Å; W205-H234 AromaticContact NE1-ND1 3.15Å; W205-H234 PolarHBondContact NE1-ND1 3.16Å; W205-H234 VanDerWaalsContact NE1-ND1 3.15Å; A230-H234 WeakPolarHBondContact O-CB 3.39Å; A230-H234 PolarHBondContact O-N 3.5Å; I231-H234 PolarHBondContact O-N 3.3Å; L232-H234 VanDerWaalsContact C-N 3.33Å; L232-H234 PolarHBondContact O-N 3.28Å; H234-N237 PolarHBondContact O-N 3.34Å; H234-K238 VanDerWaalsContact O-CB 3.32Å; H234-K238 WeakPolarHBondContact O-CB 3.29Å; H234-K238 PolarHBondContact O-N 3.47Å |
| 235 | K | 92.9 | Very high | 93 | Very high | 8 Ų | 8 | 37.6 Ų | 37.6 | 4% | 0.035 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -63.3 | -46.5 | 179.2 | -178.9 | 56.6 | 172.2 | 178.4 | 0 | 111.2 | M180 I231 L232 Q233 K238 L239 D286 F290 | M180-K235 HydrophobicContact CB-CD 4.34Å; M180-K235 HydrophobicContact SD-CB 3.71Å; M180-K235 HydrophobicContact SD-CD 4.46Å; M180-K235 HydrophobicContact SD-CG 3.95Å; I231-K235 PolarHBondContact O-N 3.46Å; L232-K235 PolarHBondContact O-N 2.82Å; L232-K235 VanDerWaalsContact O-N 3.15Å; Q233-K235 VanDerWaalsContact C-N 3.33Å; Q233-K235 PolarHBondContact O-N 2.91Å; K235-K238 PolarHBondContact O-N 3.43Å; K235-L239 HydrophobicContact CD-CD1 4.35Å; K235-L239 HydrophobicContact CD-CG 4.42Å; K235-L239 HydrophobicContact CG-CD1 4.3Å; K235-L239 VanDerWaalsContact O-CG 3.3Å; K235-L239 WeakPolarHBondContact O-CG 3.12Å; K235-L239 PolarHBondContact O-N 3.49Å; K235-D286 IonicContact NZ-OD1 2.78Å; K235-D286 PolarHBondContact NZ-OD1 3.41Å; K235-D286 IonicContact NZ-OD2 2.84Å; K235-D286 PolarHBondContact NZ-OD2 3.31Å; K235-F290 HydrophobicContact CB-CE2 4.45Å; K235-F290 HydrophobicContact CB-CZ 4.4Å; K235-F290 HydrophobicContact CG-CD1 4.33Å; K235-F290 HydrophobicContact CG-CD2 3.95Å; K235-F290 HydrophobicContact CG-CE1 4.27Å; K235-F290 HydrophobicContact CG-CE2 3.89Å; K235-F290 HydrophobicContact CG-CG 4.16Å; K235-F290 HydrophobicContact CG-CZ 4.04Å |
| 236 | V | 95.2 | Very high | 93 | Very high | 5 Ų | 5 | 38 Ų | 38 | 3% | 0.03 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.3 | -45.9 | 176.8 | 173.2 | 0 | 0 | 0 | 0 | 111.3 | L232 Q233 K238 L239 Q240 F290 Y338 Q341 L345 | L232-V236 PolarHBondContact O-N 2.92Å; Q233-V236 PolarHBondContact O-N 3.06Å; V236-K238 VanDerWaalsContact C-N 3.28Å; V236-K238 PolarHBondContact O-N 2.9Å; V236-L239 PolarHBondContact O-N 3.39Å; V236-L239 VanDerWaalsContact O-N 3.16Å; V236-Q240 WeakPolarHBondContact O-CB 3.22Å; V236-Q240 PolarHBondContact O-N 3.25Å; V236-F290 HydrophobicContact CG2-CE1 3.82Å; V236-F290 HydrophobicContact CG2-CZ 4.24Å; V236-Y338 HydrophobicContact CG2-CD1 3.98Å; V236-Q341 HydrophobicContact CG1-CB 4.15Å; V236-L345 HydrophobicContact CG1-CD1 4.48Å |
| 237 | N | 94.1 | Very high | 93.2 | Very high | 71 Ų | 71 | 40 Ų | 40 | 38% | 0.38 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -59.8 | -39 | 177.4 | -74.9 | -15 | 0 | 0 | 0 | 112.2 | Q233 H234 Q240 T241 | Q233-N237 VanDerWaalsContact O-CB 3.31Å; Q233-N237 WeakPolarHBondContact O-CB 3.46Å; Q233-N237 VanDerWaalsContact O-CG 3.22Å; Q233-N237 PolarHBondContact O-N 3.38Å; Q233-N237 PolarHBondContact O-ND2 2.66Å; H234-N237 PolarHBondContact O-N 3.34Å; N237-Q240 PolarHBondContact O-N 3.49Å; N237-T241 WeakPolarHBondContact O-CB 3.4Å; N237-T241 PolarHBondContact O-N 2.77Å; N237-T241 PolarHBondContact O-OG1 3.25Å |
| 238 | K | 92.3 | Very high | 93.2 | Very high | 98 Ų | 98 | 43 Ų | 43 | 43% | 0.426 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -64.6 | -44.8 | 175.9 | -175 | 178 | 179.7 | 178.9 | 0 | 111.8 | H234 K235 V236 W242 | H234-K238 VanDerWaalsContact O-CB 3.32Å; H234-K238 WeakPolarHBondContact O-CB 3.29Å; H234-K238 PolarHBondContact O-N 3.47Å; K235-K238 PolarHBondContact O-N 3.43Å; V236-K238 VanDerWaalsContact C-N 3.28Å; V236-K238 PolarHBondContact O-N 2.9Å; K238-W242 WeakPolarHBondContact O-CB 3.27Å; K238-W242 PolarHBondContact O-N 3.22Å |
| 239 | L | 94.2 | Very high | 92.9 | Very high | 1 Ų | 1 | 45.1 Ų | 45.1 | 1% | 0.005 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.4 | -41.7 | 176.5 | -66.5 | 170.4 | 0 | 0 | 0 | 111.2 | K235 V236 W242 L243 L283 D286 I287 F290 L345 | K235-L239 HydrophobicContact CD-CD1 4.35Å; K235-L239 HydrophobicContact CD-CG 4.42Å; K235-L239 HydrophobicContact CG-CD1 4.3Å; K235-L239 VanDerWaalsContact O-CG 3.3Å; K235-L239 WeakPolarHBondContact O-CG 3.12Å; K235-L239 PolarHBondContact O-N 3.49Å; V236-L239 PolarHBondContact O-N 3.39Å; V236-L239 VanDerWaalsContact O-N 3.16Å; L239-W242 PolarHBondContact O-N 3.36Å; L239-L243 PolarHBondContact O-N 2.99Å; L239-L283 HydrophobicContact CB-CD1 4.35Å; L239-L283 HydrophobicContact CD2-CD1 3.72Å; L239-D286 HydrophobicContact CD2-CB 4.22Å; L239-D286 WeakPolarHBondContact CD2-OD2 3.47Å; L239-I287 HydrophobicContact CB-CG1 4.46Å; L239-I287 HydrophobicContact CD1-CG1 4.07Å; L239-I287 HydrophobicContact CD2-CG1 3.98Å; L239-I287 HydrophobicContact CG-CG1 4.39Å; L239-F290 HydrophobicContact CD1-CD1 3.97Å; L239-L345 HydrophobicContact CB-CD2 3.49Å; L239-L345 VanDerWaalsContact CB-CD2 3.49Å |
| 240 | Q | 96.1 | Very high | 92.7 | Very high | 43 Ų | 43 | 41.4 Ų | 41.4 | 20% | 0.201 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -66.6 | -41.5 | 178.7 | -176.8 | 61.8 | 74.8 | 0 | 0 | 111.8 | V236 N237 L243 N244 L345 | V236-Q240 WeakPolarHBondContact O-CB 3.22Å; V236-Q240 PolarHBondContact O-N 3.25Å; N237-Q240 PolarHBondContact O-N 3.49Å; Q240-L243 PolarHBondContact O-N 3Å; Q240-N244 PolarHBondContact NE2-OD1 3.06Å; Q240-N244 WeakPolarHBondContact O-CB 3.5Å; Q240-N244 PolarHBondContact O-N 2.82Å; Q240-N244 PolarHBondContact O-ND2 3.4Å; Q240-N244 PolarHBondContact O-OD1 3.38Å; Q240-L345 HydrophobicContact CB-CD2 4.08Å; Q240-L345 VanDerWaalsContact OE1-CD1 3.28Å |
| 241 | T | 94.4 | Very high | 92.5 | Very high | 75 Ų | 75 | 44.9 Ų | 44.9 | 46% | 0.46 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -63.3 | -44.5 | 176.5 | -55.3 | 0 | 0 | 0 | 0 | 110.4 | N237 L243 N244 D245 | N237-T241 WeakPolarHBondContact O-CB 3.4Å; N237-T241 PolarHBondContact O-N 2.77Å; N237-T241 PolarHBondContact O-OG1 3.25Å; T241-L243 VanDerWaalsContact C-N 3.33Å; T241-L243 PolarHBondContact O-N 3.11Å; T241-N244 PolarHBondContact O-N 3.28Å; T241-D245 VanDerWaalsContact O-CG 3.27Å; T241-D245 PolarHBondContact O-N 2.72Å |
| 242 | W | 94 | Very high | 92.2 | Very high | 71 Ų | 71 | 49.8 Ų | 49.8 | 27% | 0.269 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -61.5 | -41.3 | 177 | -170.9 | 7.7 | 0 | 0 | 0 | 112.1 | K238 L239 D245 V246 S279 E282 L283 | K238-W242 WeakPolarHBondContact O-CB 3.27Å; K238-W242 PolarHBondContact O-N 3.22Å; L239-W242 PolarHBondContact O-N 3.36Å; W242-D245 PolarHBondContact O-N 2.87Å; W242-V246 WeakPolarHBondContact O-CG2 3.32Å; W242-V246 PolarHBondContact O-N 2.92Å; W242-S279 WeakPolarHBondContact CZ2-O 3.33Å; W242-S279 PolarHBondContact NE1-OG 3Å; W242-E282 HydrophobicContact CH2-CB 3.8Å; W242-E282 HydrophobicContact CZ2-CB 4.12Å; W242-L283 HydrophobicContact CB-CD1 4.29Å; W242-L283 HydrophobicContact CD2-CB 4.07Å; W242-L283 HydrophobicContact CD2-CD1 3.92Å; W242-L283 HydrophobicContact CD2-CG 4.43Å; W242-L283 HydrophobicContact CE3-CB 4.03Å; W242-L283 HydrophobicContact CE3-CD1 3.53Å; W242-L283 HydrophobicContact CE3-CG 4.34Å; W242-L283 HydrophobicContact CG-CD1 4.27Å; W242-L283 HydrophobicContact CH2-CB 4.22Å; W242-L283 HydrophobicContact CZ2-CB 4.27Å; W242-L283 HydrophobicContact CZ3-CB 4.1Å; W242-L283 HydrophobicContact CZ3-CD1 4.16Å |
| 243 | L | 94.8 | Very high | 91.6 | Very high | 1 Ų | 1 | 50.4 Ų | 50.4 | 1% | 0.005 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59.9 | -48.2 | 173.3 | -176.5 | 59.3 | 0 | 0 | 0 | 111.4 | L239 Q240 T241 D245 V246 E247 L280 L283 K348 L352 | L239-L243 PolarHBondContact O-N 2.99Å; Q240-L243 PolarHBondContact O-N 3Å; T241-L243 VanDerWaalsContact C-N 3.33Å; T241-L243 PolarHBondContact O-N 3.11Å; L243-D245 PolarHBondContact O-N 3.44Å; L243-V246 PolarHBondContact O-N 3.32Å; L243-E247 VanDerWaalsContact O-CB 3.24Å; L243-E247 WeakPolarHBondContact O-CB 3.43Å; L243-E247 PolarHBondContact O-N 2.77Å; L243-L280 HydrophobicContact CD1-CD1 4.28Å; L243-L283 HydrophobicContact CB-CD2 3.89Å; L243-L283 HydrophobicContact CD1-CD2 4Å; L243-K348 HydrophobicContact CD2-CB 3.83Å; L243-K348 HydrophobicContact CD2-CD 4.18Å; L243-L352 HydrophobicContact CD1-CD2 4.24Å |
| 244 | N | 94 | Very high | 91 | Very high | 84 Ų | 84 | 47.8 Ų | 47.8 | 45% | 0.449 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -64.2 | -26.8 | -179.1 | -67.7 | -13.7 | 0 | 0 | 0 | 113.4 | Q240 T241 P248 | Q240-N244 PolarHBondContact NE2-OD1 3.06Å; Q240-N244 WeakPolarHBondContact O-CB 3.5Å; Q240-N244 PolarHBondContact O-N 2.82Å; Q240-N244 PolarHBondContact O-ND2 3.4Å; Q240-N244 PolarHBondContact O-OD1 3.38Å; T241-N244 PolarHBondContact O-N 3.28Å; N244-P248 WeakPolarHBondContact O-CD 3.3Å; N244-P248 WeakPolarHBondContact O-CG 3.42Å |
| 245 | D | 91.8 | Very high | 90.5 | Very high | 112 Ų | 112 | 53.1 Ų | 53.1 | 60% | 0.599 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -75.9 | -36.2 | 176.3 | -69.9 | -22.4 | 0 | 0 | 0 | 111.8 | T241 W242 L243 | T241-D245 VanDerWaalsContact O-CG 3.27Å; T241-D245 PolarHBondContact O-N 2.72Å; W242-D245 PolarHBondContact O-N 2.87Å; L243-D245 PolarHBondContact O-N 3.44Å |
| 246 | V | 90.7 | Very high | 89.7 | Confident | 13 Ų | 13 | 54 Ų | 54 | 8% | 0.079 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -90.1 | -35.7 | -172.7 | 172.4 | 0 | 0 | 0 | 0 | 112.1 | W242 L243 S249 I250 N276 | W242-V246 WeakPolarHBondContact O-CG2 3.32Å; W242-V246 PolarHBondContact O-N 2.92Å; L243-V246 PolarHBondContact O-N 3.32Å; V246-S249 PolarHBondContact O-N 3.38Å; V246-I250 HydrophobicContact CG1-CD1 3.38Å; V246-I250 HydrophobicContact CG1-CG1 4.12Å; V246-I250 WeakPolarHBondContact O-CG1 3.31Å; V246-I250 PolarHBondContact O-N 3.38Å; V246-N276 HydrophobicContact CG1-CB 4.46Å |
| 247 | E | 91.9 | Very high | 88.6 | Confident | 74 Ų | 74 | 54.8 Ų | 54.8 | 35% | 0.346 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -52.5 | -56.3 | 179.8 | -177.8 | 177.7 | 175.9 | 0 | 0 | 114.4 | L243 S249 I250 L251 L352 | L243-E247 VanDerWaalsContact O-CB 3.24Å; L243-E247 WeakPolarHBondContact O-CB 3.43Å; L243-E247 PolarHBondContact O-N 2.77Å; E247-S249 VanDerWaalsContact C-N 3.31Å; E247-S249 PolarHBondContact O-N 3.42Å; E247-I250 PolarHBondContact O-N 3.5Å; E247-L251 HydrophobicContact CG-CD1 4.17Å; E247-L251 WeakPolarHBondContact O-CG 3.47Å; E247-L251 PolarHBondContact O-N 3.35Å; E247-L352 HydrophobicContact CB-CD2 4.05Å; E247-L352 HydrophobicContact CG-CD2 4.23Å |
| 248 | P | 90.3 | Very high | 87.4 | Confident | 65 Ų | 65 | 55 Ų | 55 | 42% | 0.422 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.7 | -38.5 | -178 | 25.1 | -33.9 | 0 | 0 | 0 | 111.6 | N244 I250 L251 D252 | N244-P248 WeakPolarHBondContact O-CD 3.3Å; N244-P248 WeakPolarHBondContact O-CG 3.42Å; P248-I250 VanDerWaalsContact C-N 3.31Å; P248-I250 PolarHBondContact O-N 3.45Å; P248-L251 PolarHBondContact O-N 3.46Å; P248-D252 WeakPolarHBondContact O-CB 3.32Å; P248-D252 VanDerWaalsContact O-CG 3.24Å; P248-D252 PolarHBondContact O-N 2.87Å |
| 249 | S | 87.2 | Confident | 86.2 | Confident | 43 Ų | 43 | 54.3 Ų | 54.3 | 30% | 0.301 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -63.7 | -37 | 178.5 | -175.1 | 0 | 0 | 0 | 0 | 112.2 | V246 E247 T253 N276 | V246-S249 PolarHBondContact O-N 3.38Å; E247-S249 VanDerWaalsContact C-N 3.31Å; E247-S249 PolarHBondContact O-N 3.42Å; S249-T253 VanDerWaalsContact O-CB 3.32Å; S249-T253 WeakPolarHBondContact O-CB 3.24Å; S249-T253 PolarHBondContact O-N 3.15Å; S249-T253 PolarHBondContact O-OG1 3.38Å; S249-N276 PolarHBondContact OG-ND2 3.43Å |
| 250 | I | 87.8 | Confident | 84.5 | Confident | 2 Ų | 2 | 58.9 Ų | 58.9 | 1% | 0.01 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -67.2 | -52.1 | 174.7 | -71.4 | 164.1 | 0 | 0 | 0 | 110 | V246 E247 P248 D252 T253 L254 N276 L280 L352 I356 | V246-I250 HydrophobicContact CG1-CD1 3.38Å; V246-I250 HydrophobicContact CG1-CG1 4.12Å; V246-I250 WeakPolarHBondContact O-CG1 3.31Å; V246-I250 PolarHBondContact O-N 3.38Å; E247-I250 PolarHBondContact O-N 3.5Å; P248-I250 VanDerWaalsContact C-N 3.31Å; P248-I250 PolarHBondContact O-N 3.45Å; I250-D252 PolarHBondContact O-N 3.16Å; I250-T253 PolarHBondContact O-N 2.81Å; I250-T253 VanDerWaalsContact O-N 3.1Å; I250-L254 HydrophobicContact CG2-CD1 3.78Å; I250-L254 HydrophobicContact CG2-CG 4.01Å; I250-L254 WeakPolarHBondContact O-CB 3.44Å; I250-L254 VanDerWaalsContact O-CG 3.28Å; I250-L254 WeakPolarHBondContact O-CG 3.36Å; I250-L254 PolarHBondContact O-N 3Å; I250-N276 HydrophobicContact CD1-CB 4.16Å; I250-N276 HydrophobicContact CG1-CB 3.64Å; I250-L280 HydrophobicContact CD1-CD2 4.17Å; I250-L352 HydrophobicContact CB-CD1 4.16Å; I250-L352 HydrophobicContact CD1-CD1 4.43Å; I250-L352 HydrophobicContact CD1-CD2 3.73Å; I250-L352 HydrophobicContact CD1-CG 4.01Å; I250-L352 HydrophobicContact CG2-CD1 3.69Å; I250-L352 HydrophobicContact CG2-CG 4.3Å; I250-I356 HydrophobicContact CD1-CD1 3.69Å; I250-I356 HydrophobicContact CG1-CD1 4.14Å; I250-I356 HydrophobicContact CG2-CD1 3.77Å; I250-I356 HydrophobicContact CG2-CG1 3.61Å |
| 251 | L | 88.2 | Confident | 82.7 | Confident | 73 Ų | 73 | 66 Ų | 66 | 38% | 0.382 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -59.2 | -44.8 | -176.8 | -66.9 | 177.7 | 0 | 0 | 0 | 112.1 | E247 P248 T253 L254 E255 L352 L355 | E247-L251 HydrophobicContact CG-CD1 4.17Å; E247-L251 WeakPolarHBondContact O-CG 3.47Å; E247-L251 PolarHBondContact O-N 3.35Å; P248-L251 PolarHBondContact O-N 3.46Å; L251-T253 VanDerWaalsContact C-N 3.32Å; L251-T253 PolarHBondContact O-N 3.4Å; L251-L254 PolarHBondContact O-N 2.99Å; L251-E255 PolarHBondContact O-N 2.97Å; L251-L352 HydrophobicContact CD2-CD1 4.23Å; L251-L355 HydrophobicContact CD2-CD1 4.31Å |
| 252 | D | 85.1 | Confident | 80.9 | Confident | 105 Ų | 105 | 65.9 Ų | 65.9 | 56% | 0.561 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -60.9 | -41.6 | 176 | -71.2 | -13.6 | 0 | 0 | 0 | 111.8 | P248 I250 S256 | P248-D252 WeakPolarHBondContact O-CB 3.32Å; P248-D252 VanDerWaalsContact O-CG 3.24Å; P248-D252 PolarHBondContact O-N 2.87Å; I250-D252 PolarHBondContact O-N 3.16Å; D252-S256 WeakPolarHBondContact O-CB 3.5Å; D252-S256 PolarHBondContact O-N 3.05Å; D252-S256 VanDerWaalsContact O-N 3.11Å; D252-S256 PolarHBondContact O-OG 2.94Å |
| 253 | T | 82.4 | Confident | 79 | Confident | 12 Ų | 12 | 63.6 Ų | 63.6 | 7% | 0.074 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -67.7 | -42.5 | 179.5 | -56.3 | 0 | 0 | 0 | 0 | 110.7 | S249 I250 L251 S256 L257 K269 L273 | S249-T253 VanDerWaalsContact O-CB 3.32Å; S249-T253 WeakPolarHBondContact O-CB 3.24Å; S249-T253 PolarHBondContact O-N 3.15Å; S249-T253 PolarHBondContact O-OG1 3.38Å; I250-T253 PolarHBondContact O-N 2.81Å; I250-T253 VanDerWaalsContact O-N 3.1Å; L251-T253 VanDerWaalsContact C-N 3.32Å; L251-T253 PolarHBondContact O-N 3.4Å; T253-S256 PolarHBondContact O-N 3.21Å; T253-S256 PolarHBondContact O-OG 3.19Å; T253-L257 HydrophobicContact CG2-CD1 3.71Å; T253-L257 HydrophobicContact CG2-CG 4.36Å; T253-L257 WeakPolarHBondContact O-CB 3.3Å; T253-L257 VanDerWaalsContact O-CG 3.27Å; T253-L257 WeakPolarHBondContact O-CG 3.24Å; T253-L257 PolarHBondContact O-N 2.97Å; T253-K269 HydrophobicContact CG2-CB 4.21Å; T253-K269 WeakPolarHBondContact CG2-O 3.48Å; T253-L273 HydrophobicContact CG2-CB 3.9Å; T253-L273 HydrophobicContact CG2-CD1 4.34Å |
| 254 | L | 81.6 | Confident | 77 | Confident | 13 Ų | 13 | 68.4 Ų | 68.4 | 7% | 0.068 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -61.4 | -50.1 | 176.3 | -69.4 | -174.2 | 0 | 0 | 0 | 111.6 | I250 L251 S256 L257 V258 L273 L355 I356 S359 | I250-L254 HydrophobicContact CG2-CD1 3.78Å; I250-L254 HydrophobicContact CG2-CG 4.01Å; I250-L254 WeakPolarHBondContact O-CB 3.44Å; I250-L254 VanDerWaalsContact O-CG 3.28Å; I250-L254 WeakPolarHBondContact O-CG 3.36Å; I250-L254 PolarHBondContact O-N 3Å; L251-L254 PolarHBondContact O-N 2.99Å; L254-S256 VanDerWaalsContact C-N 3.26Å; L254-S256 PolarHBondContact O-N 3.39Å; L254-L257 PolarHBondContact O-N 3.37Å; L254-L257 VanDerWaalsContact O-N 3.13Å; L254-V258 WeakPolarHBondContact O-CB 3.16Å; L254-V258 VanDerWaalsContact O-CG2 3.23Å; L254-V258 WeakPolarHBondContact O-CG2 3.24Å; L254-V258 PolarHBondContact O-N 3.33Å; L254-L273 HydrophobicContact CD2-CD1 3.51Å; L254-L355 HydrophobicContact CD1-CB 4.15Å; L254-I356 HydrophobicContact CD1-CG1 4.45Å; L254-S359 WeakPolarHBondContact CD2-OG 3.5Å |
| 255 | E | 81.6 | Confident | 75.1 | Confident | 147 Ų | 147 | 68.1 Ų | 68.1 | 69% | 0.687 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -56.7 | -43 | 178.3 | -174.8 | 170.3 | -161.9 | 0 | 0 | 111.2 | L251 L257 | L251-E255 PolarHBondContact O-N 2.97Å; E255-L257 PolarHBondContact O-N 2.9Å |
| 256 | S | 76.6 | Confident | 73.6 | Confident | 27 Ų | 27 | 64.8 Ų | 64.8 | 19% | 0.189 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -70.7 | -27.3 | 179.8 | 79.3 | 0 | 0 | 0 | 0 | 114.9 | D252 T253 L254 K269 | D252-S256 WeakPolarHBondContact O-CB 3.5Å; D252-S256 PolarHBondContact O-N 3.05Å; D252-S256 VanDerWaalsContact O-N 3.11Å; D252-S256 PolarHBondContact O-OG 2.94Å; T253-S256 PolarHBondContact O-N 3.21Å; T253-S256 PolarHBondContact O-OG 3.19Å; L254-S256 VanDerWaalsContact C-N 3.26Å; L254-S256 PolarHBondContact O-N 3.39Å; S256-K269 WeakPolarHBondContact OG-CD 3.32Å |
| 257 | L | 72 | Confident | 72.4 | Confident | 20 Ų | 20 | 75.2 Ų | 75.2 | 11% | 0.105 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -89.6 | -27.3 | -178.1 | -74.1 | 172.7 | 0 | 0 | 0 | 112.6 | T253 L254 E255 D259 K269 L273 I363 | T253-L257 HydrophobicContact CG2-CD1 3.71Å; T253-L257 HydrophobicContact CG2-CG 4.36Å; T253-L257 WeakPolarHBondContact O-CB 3.3Å; T253-L257 VanDerWaalsContact O-CG 3.27Å; T253-L257 WeakPolarHBondContact O-CG 3.24Å; T253-L257 PolarHBondContact O-N 2.97Å; L254-L257 PolarHBondContact O-N 3.37Å; L254-L257 VanDerWaalsContact O-N 3.13Å; E255-L257 PolarHBondContact O-N 2.9Å; L257-D259 PolarHBondContact O-N 3.15Å; L257-K269 HydrophobicContact CD2-CB 4.07Å; L257-K269 HydrophobicContact CG-CB 4.38Å; L257-L273 HydrophobicContact CD1-CB 4.41Å; L257-L273 HydrophobicContact CD1-CD1 3.62Å; L257-I363 HydrophobicContact CB-CD1 3.9Å; L257-I363 HydrophobicContact CB-CG1 4.19Å; L257-I363 HydrophobicContact CD1-CD1 3.73Å; L257-I363 HydrophobicContact CG-CD1 4.37Å |
| 258 | V | 68.6 | Low | 71.5 | Confident | 77 Ų | 77 | 75.1 Ų | 75.1 | 47% | 0.467 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -69.7 | -24.9 | 175.2 | 170.4 | 0 | 0 | 0 | 0 | 111.2 | L254 P260 | L254-V258 WeakPolarHBondContact O-CB 3.16Å; L254-V258 VanDerWaalsContact O-CG2 3.23Å; L254-V258 WeakPolarHBondContact O-CG2 3.24Å; L254-V258 PolarHBondContact O-N 3.33Å; V258-P260 VanDerWaalsContact O-CD 3.25Å; V258-P260 WeakPolarHBondContact O-CD 3.45Å |
| 259 | D | 67.9 | Low | 70.7 | Confident | 83 Ų | 83 | 74.9 Ų | 74.9 | 44% | 0.444 | 40% | 0.404 | S | S | . | . | trans | -69.4 | 111.1 | -176.4 | -121.6 | -11 | 0 | 0 | 0 | 112 | L257 K261 I262 | L257-D259 PolarHBondContact O-N 3.15Å; D259-K261 PolarHBondContact O-N 3.36Å; D259-I262 HydrophobicContact CB-CD1 3.61Å; D259-I262 HydrophobicContact CB-CG1 3.98Å; D259-I262 PolarHBondContact O-N 3.34Å; D259-I262 VanDerWaalsContact O-N 3.1Å | ||
| 260 | P | 58.2 | Low | 70.3 | Confident | 96 Ų | 96 | 75.4 Ų | 75.4 | 62% | 0.623 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -12.3 | -167.3 | 26.7 | -35 | 0 | 0 | 0 | 113.7 | V258 | V258-P260 VanDerWaalsContact O-CD 3.25Å; V258-P260 WeakPolarHBondContact O-CD 3.45Å |
| 261 | K | 57.9 | Low | 69.9 | Low | 194 Ų | 194 | 81 Ų | 81 | 84% | 0.843 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | -12.8 | 179.3 | -66.2 | -179.3 | -179.7 | 177.4 | 0 | 113.4 | D259 | D259-K261 PolarHBondContact O-N 3.36Š|
| 262 | I | 56.3 | Low | 69.7 | Low | 71 Ų | 71 | 80.8 Ų | 80.8 | 36% | 0.364 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -116.1 | -6.7 | -165.2 | -38.8 | 176.9 | 0 | 0 | 0 | 112.1 | D259 S264 A265 | D259-I262 HydrophobicContact CB-CD1 3.61Å; D259-I262 HydrophobicContact CB-CG1 3.98Å; D259-I262 PolarHBondContact O-N 3.34Å; D259-I262 VanDerWaalsContact O-N 3.1Å; I262-S264 PolarHBondContact O-N 2.91Å; I262-S264 VanDerWaalsContact O-N 3.1Å; I262-A265 PolarHBondContact O-N 3.39Å |
| 263 | V | 54.5 | Low | 69.6 | Low | 24 Ų | 24 | 76 Ų | 76 | 15% | 0.145 | 40% | 0.401 | C | S | . | . | G | 310 helix | trans | -65.8 | -18.2 | -171.1 | 175.4 | 0 | 0 | 0 | 0 | 114.5 | A265 N366 L367 | V263-A265 PolarHBondContact O-N 3.02Å; V263-A265 VanDerWaalsContact O-N 3.1Å; V263-N366 WeakPolarHBondContact CG1-ND2 3.31Å; V263-N366 WeakPolarHBondContact CG2-ND2 3.25Å; V263-L367 HydrophobicContact CG1-CD2 4.41Å |
| 264 | S | 53.1 | Low | 69.7 | Low | 101 Ų | 101 | 79.6 Ų | 79.6 | 71% | 0.706 | 42% | 0.42 | S | S | * | . | G | 310 helix | trans | -69 | -7.4 | -177.8 | 53.9 | 0 | 0 | 0 | 0 | 115 | I262 | I262-S264 PolarHBondContact O-N 2.91Å; I262-S264 VanDerWaalsContact O-N 3.1Å |
| 265 | A | 53.1 | Low | 70 | Confident | 78 Ų | 78 | 84.8 Ų | 84.8 | 65% | 0.645 | 44% | 0.444 | S | S | * | . | G | 310 helix | trans | -142.6 | 13.6 | -163.5 | 0 | 0 | 0 | 0 | 0 | 119.3 | I262 V263 | I262-A265 PolarHBondContact O-N 3.39Å; V263-A265 PolarHBondContact O-N 3.02Å; V263-A265 VanDerWaalsContact O-N 3.1Å |
| 266 | D | 61.7 | Low | 70.3 | Confident | 42 Ų | 42 | 78.8 Ų | 78.8 | 23% | 0.225 | 42% | 0.417 | C | S | . | . | trans | -127.8 | 56.4 | -170.8 | -117.9 | -37.6 | 0 | 0 | 0 | 116.8 | S268 K269 L270 | D266-S268 PolarHBondContact O-N 3.33Å; D266-S268 VanDerWaalsContact O-N 3.16Å; D266-S268 PolarHBondContact OD1-OG 2.92Å; D266-K269 HydrophobicContact CB-CB 3.99Å; D266-K269 HydrophobicContact CB-CD 3.98Å; D266-K269 HydrophobicContact CB-CG 4.1Å; D266-K269 VanDerWaalsContact CG-CG 3.45Å; D266-K269 PolarHBondContact O-N 3.02Å; D266-K269 VanDerWaalsContact O-N 3.09Å; D266-K269 WeakPolarHBondContact OD1-CG 3.32Å; D266-K269 WeakPolarHBondContact OD2-CD 3.38Å; D266-K269 WeakPolarHBondContact OD2-CE 3.3Å; D266-K269 IonicContact OD2-NZ 2.69Å; D266-K269 PolarHBondContact OD2-NZ 3.44Å; D266-L270 PolarHBondContact O-N 2.99Å | ||
| 267 | R | 65.3 | Low | 70.9 | Confident | 232 Ų | 232 | 78.5 Ų | 78.5 | 88% | 0.875 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -54.2 | -30 | 168.5 | -141.8 | -176.9 | -171.5 | 104.6 | 0 | 112.2 | H271 | R267-H271 PolarHBondContact O-N 3.09Å |
| 268 | S | 71.7 | Confident | 71.8 | Confident | 72 Ų | 72 | 84.1 Ų | 84.1 | 50% | 0.503 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -64.8 | -47.8 | 173.6 | 22.3 | 0 | 0 | 0 | 0 | 113 | D266 H271 I272 | D266-S268 PolarHBondContact O-N 3.33Å; D266-S268 VanDerWaalsContact O-N 3.16Å; D266-S268 PolarHBondContact OD1-OG 2.92Å; S268-H271 WeakPolarHBondContact O-CB 3.48Å; S268-H271 PolarHBondContact O-N 3.05Å; S268-I272 WeakPolarHBondContact O-CG1 3.45Å; S268-I272 PolarHBondContact O-N 3.45Å |
| 269 | K | 74.8 | Confident | 73 | Confident | 61 Ų | 61 | 81.6 Ų | 81.6 | 27% | 0.265 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -69.8 | -35 | -179.6 | -72.1 | -178.5 | -172.1 | 153.2 | 0 | 112.9 | T253 S256 L257 D266 H271 I272 L273 | T253-K269 HydrophobicContact CG2-CB 4.21Å; T253-K269 WeakPolarHBondContact CG2-O 3.48Å; S256-K269 WeakPolarHBondContact OG-CD 3.32Å; L257-K269 HydrophobicContact CD2-CB 4.07Å; L257-K269 HydrophobicContact CG-CB 4.38Å; D266-K269 HydrophobicContact CB-CB 3.99Å; D266-K269 HydrophobicContact CB-CD 3.98Å; D266-K269 HydrophobicContact CB-CG 4.1Å; D266-K269 VanDerWaalsContact CG-CG 3.45Å; D266-K269 PolarHBondContact O-N 3.02Å; D266-K269 VanDerWaalsContact O-N 3.09Å; D266-K269 WeakPolarHBondContact OD1-CG 3.32Å; D266-K269 WeakPolarHBondContact OD2-CD 3.38Å; D266-K269 WeakPolarHBondContact OD2-CE 3.3Å; D266-K269 IonicContact OD2-NZ 2.69Å; D266-K269 PolarHBondContact OD2-NZ 3.44Å; K269-H271 VanDerWaalsContact C-N 3.3Å; K269-H271 PolarHBondContact O-N 3.14Å; K269-I272 PolarHBondContact O-N 2.72Å; K269-L273 WeakPolarHBondContact O-CB 3.36Å; K269-L273 PolarHBondContact O-N 3.43Å |
| 270 | L | 77.9 | Confident | 74.2 | Confident | 53 Ų | 53 | 77.7 Ų | 77.7 | 28% | 0.277 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -61.4 | -41.4 | 171.2 | -175.1 | 64.5 | 0 | 0 | 0 | 111.4 | D266 L273 L274 I363 | D266-L270 PolarHBondContact O-N 2.99Å; L270-L273 PolarHBondContact O-N 3.03Å; L270-L274 WeakPolarHBondContact O-CG 3.45Å; L270-L274 PolarHBondContact O-N 2.98Å; L270-I363 HydrophobicContact CD1-CG2 4.25Å |
| 271 | H | 80.2 | Confident | 75.9 | Confident | 120 Ų | 120 | 75 Ų | 75 | 56% | 0.556 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -64.5 | -39.9 | 175.6 | -175.3 | -75 | 0 | 0 | 0 | 112.1 | R267 S268 K269 L273 L274 Q275 | R267-H271 PolarHBondContact O-N 3.09Å; S268-H271 WeakPolarHBondContact O-CB 3.48Å; S268-H271 PolarHBondContact O-N 3.05Å; K269-H271 VanDerWaalsContact C-N 3.3Å; K269-H271 PolarHBondContact O-N 3.14Å; H271-L273 VanDerWaalsContact C-N 3.35Å; H271-L274 PolarHBondContact O-N 3.37Å; H271-Q275 WeakPolarHBondContact O-CB 3.48Å; H271-Q275 PolarHBondContact O-N 2.91Å |
| 272 | I | 83.2 | Confident | 77.6 | Confident | 68 Ų | 68 | 69.9 Ų | 69.9 | 35% | 0.349 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -62.4 | -43.2 | 174.7 | -66.9 | 163.8 | 0 | 0 | 0 | 110.5 | S268 K269 L274 Q275 N276 | S268-I272 WeakPolarHBondContact O-CG1 3.45Å; S268-I272 PolarHBondContact O-N 3.45Å; K269-I272 PolarHBondContact O-N 2.72Å; I272-L274 PolarHBondContact O-N 3.4Å; I272-Q275 PolarHBondContact O-N 3.28Å; I272-N276 WeakPolarHBondContact O-CB 3.39Å; I272-N276 VanDerWaalsContact O-CG 3.29Å; I272-N276 PolarHBondContact O-N 3.05Å |
| 273 | L | 83.6 | Confident | 79.4 | Confident | 4 Ų | 4 | 66.6 Ų | 66.6 | 2% | 0.021 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60.1 | -46.1 | 175.5 | -175.3 | 152.4 | 0 | 0 | 0 | 111.9 | T253 L254 L257 K269 L270 H271 Q275 N276 S277 I356 I363 | T253-L273 HydrophobicContact CG2-CB 3.9Å; T253-L273 HydrophobicContact CG2-CD1 4.34Å; L254-L273 HydrophobicContact CD2-CD1 3.51Å; L257-L273 HydrophobicContact CD1-CB 4.41Å; L257-L273 HydrophobicContact CD1-CD1 3.62Å; K269-L273 WeakPolarHBondContact O-CB 3.36Å; K269-L273 PolarHBondContact O-N 3.43Å; L270-L273 PolarHBondContact O-N 3.03Å; H271-L273 VanDerWaalsContact C-N 3.35Å; L273-Q275 VanDerWaalsContact C-N 3.33Å; L273-Q275 PolarHBondContact O-N 2.96Å; L273-N276 PolarHBondContact O-N 2.86Å; L273-S277 VanDerWaalsContact O-CB 3.31Å; L273-S277 WeakPolarHBondContact O-CB 3.47Å; L273-S277 PolarHBondContact O-N 3.49Å; L273-I356 HydrophobicContact CD2-CG2 4.03Å; L273-I363 HydrophobicContact CD1-CD1 4.14Å |
| 274 | L | 83.8 | Confident | 81.4 | Confident | 89 Ų | 89 | 68 Ų | 68 | 47% | 0.466 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -63.6 | -39.2 | 176.9 | -70.1 | 174.3 | 0 | 0 | 0 | 112 | L270 H271 I272 S277 K278 | L270-L274 WeakPolarHBondContact O-CG 3.45Å; L270-L274 PolarHBondContact O-N 2.98Å; H271-L274 PolarHBondContact O-N 3.37Å; I272-L274 PolarHBondContact O-N 3.4Å; L274-S277 PolarHBondContact O-N 3.33Å; L274-K278 PolarHBondContact O-N 3.5Å |
| 275 | Q | 88.1 | Confident | 83.3 | Confident | 121 Ų | 121 | 67.2 Ų | 67.2 | 57% | 0.565 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -65.3 | -43.7 | 175.9 | -179 | 173.4 | -15.8 | 0 | 0 | 111.7 | H271 I272 L273 K278 S279 | H271-Q275 WeakPolarHBondContact O-CB 3.48Å; H271-Q275 PolarHBondContact O-N 2.91Å; I272-Q275 PolarHBondContact O-N 3.28Å; L273-Q275 VanDerWaalsContact C-N 3.33Å; L273-Q275 PolarHBondContact O-N 2.96Å; Q275-K278 PolarHBondContact O-N 2.88Å; Q275-S279 PolarHBondContact O-N 3.31Å |
| 276 | N | 87.3 | Confident | 85.3 | Confident | 22 Ų | 22 | 65.3 Ų | 65.3 | 12% | 0.118 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -67.6 | -39.2 | 176.9 | -71.4 | -10.3 | 0 | 0 | 0 | 111.6 | V246 S249 I250 I272 L273 K278 S279 L280 | V246-N276 HydrophobicContact CG1-CB 4.46Å; S249-N276 PolarHBondContact OG-ND2 3.43Å; I250-N276 HydrophobicContact CD1-CB 4.16Å; I250-N276 HydrophobicContact CG1-CB 3.64Å; I272-N276 WeakPolarHBondContact O-CB 3.39Å; I272-N276 VanDerWaalsContact O-CG 3.29Å; I272-N276 PolarHBondContact O-N 3.05Å; L273-N276 PolarHBondContact O-N 2.86Å; N276-K278 VanDerWaalsContact C-N 3.34Å; N276-K278 PolarHBondContact O-N 3.01Å; N276-S279 PolarHBondContact O-N 2.64Å; N276-L280 WeakPolarHBondContact O-CB 3.44Å; N276-L280 PolarHBondContact O-N 3.04Å |
| 277 | S | 89.6 | Confident | 86.9 | Confident | 21 Ų | 21 | 63.4 Ų | 63.4 | 15% | 0.147 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -60.9 | -41.4 | 173.7 | 175.1 | 0 | 0 | 0 | 0 | 112 | L273 L274 L280 S281 | L273-S277 VanDerWaalsContact O-CB 3.31Å; L273-S277 WeakPolarHBondContact O-CB 3.47Å; L273-S277 PolarHBondContact O-N 3.49Å; L274-S277 PolarHBondContact O-N 3.33Å; S277-L280 PolarHBondContact O-N 3.35Å; S277-S281 WeakPolarHBondContact O-CB 3.42Å; S277-S281 PolarHBondContact O-N 3.07Å; S277-S281 PolarHBondContact O-OG 3.08Å |
| 278 | K | 91.7 | Very high | 88.3 | Confident | 137 Ų | 137 | 57.8 Ų | 57.8 | 60% | 0.596 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -61.5 | -48.6 | 172.3 | -172.8 | -170 | 175.9 | -159.6 | 0 | 111.2 | L274 Q275 N276 L280 S281 E282 | L274-K278 PolarHBondContact O-N 3.5Å; Q275-K278 PolarHBondContact O-N 2.88Å; N276-K278 VanDerWaalsContact C-N 3.34Å; N276-K278 PolarHBondContact O-N 3.01Å; K278-L280 VanDerWaalsContact C-N 3.29Å; K278-L280 PolarHBondContact O-N 2.91Å; K278-S281 WeakPolarHBondContact O-CB 3.36Å; K278-S281 PolarHBondContact O-N 3.15Å; K278-E282 VanDerWaalsContact CE-OE1 3.22Å; K278-E282 WeakPolarHBondContact CE-OE1 3.37Å; K278-E282 IonicContact NZ-OE1 2.68Å; K278-E282 WeakPolarHBondContact O-CG 3.29Å; K278-E282 PolarHBondContact O-N 3.13Å |
| 279 | S | 92.6 | Very high | 89.4 | Confident | 25 Ų | 25 | 56.9 Ų | 56.9 | 18% | 0.175 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60.5 | -38.9 | 177.5 | -174.2 | 0 | 0 | 0 | 0 | 112.1 | W242 Q275 N276 S281 E282 L283 | W242-S279 WeakPolarHBondContact CZ2-O 3.33Å; W242-S279 PolarHBondContact NE1-OG 3Å; Q275-S279 PolarHBondContact O-N 3.31Å; N276-S279 PolarHBondContact O-N 2.64Å; S279-S281 VanDerWaalsContact C-N 3.34Å; S279-E282 PolarHBondContact O-N 3.31Å; S279-L283 PolarHBondContact O-N 3.19Å |
| 280 | L | 93.8 | Very high | 90.3 | Very high | 1 Ų | 1 | 54 Ų | 54 | 1% | 0.005 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -66.5 | -38 | 177.3 | -169.8 | 68.3 | 0 | 0 | 0 | 111.4 | L243 I250 N276 S277 K278 L283 E284 T349 L352 K353 I356 | L243-L280 HydrophobicContact CD1-CD1 4.28Å; I250-L280 HydrophobicContact CD1-CD2 4.17Å; N276-L280 WeakPolarHBondContact O-CB 3.44Å; N276-L280 PolarHBondContact O-N 3.04Å; S277-L280 PolarHBondContact O-N 3.35Å; K278-L280 VanDerWaalsContact C-N 3.29Å; K278-L280 PolarHBondContact O-N 2.91Å; L280-L283 HydrophobicContact CD1-CD2 4.36Å; L280-L283 PolarHBondContact O-N 2.82Å; L280-E284 WeakPolarHBondContact O-CB 3.37Å; L280-E284 PolarHBondContact O-N 3.34Å; L280-T349 HydrophobicContact CD1-CG2 3.74Å; L280-T349 HydrophobicContact CG-CG2 4.04Å; L280-L352 HydrophobicContact CD1-CD2 3.9Å; L280-L352 HydrophobicContact CD2-CB 4.18Å; L280-L352 HydrophobicContact CD2-CD2 4.16Å; L280-L352 HydrophobicContact CD2-CG 3.95Å; L280-K353 HydrophobicContact CD2-CB 3.96Å; L280-I356 HydrophobicContact CD2-CD1 3.74Å |
| 281 | S | 94.4 | Very high | 91.1 | Very high | 38 Ų | 38 | 53.1 Ų | 53.1 | 27% | 0.266 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -65.8 | -39.2 | 174.1 | -61.1 | 0 | 0 | 0 | 0 | 111.8 | S277 K278 S279 E284 T285 | S277-S281 WeakPolarHBondContact O-CB 3.42Å; S277-S281 PolarHBondContact O-N 3.07Å; S277-S281 PolarHBondContact O-OG 3.08Å; K278-S281 WeakPolarHBondContact O-CB 3.36Å; K278-S281 PolarHBondContact O-N 3.15Å; S279-S281 VanDerWaalsContact C-N 3.34Å; S281-E284 PolarHBondContact O-N 2.92Å; S281-T285 WeakPolarHBondContact O-CG2 3.37Å; S281-T285 PolarHBondContact O-N 3.17Å; S281-T285 PolarHBondContact O-OG1 3.36Å |
| 282 | E | 93.7 | Very high | 91.8 | Very high | 88 Ų | 88 | 52 Ų | 52 | 41% | 0.411 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -62.8 | -45.6 | 173.4 | -69.5 | 174.9 | -170.6 | 0 | 0 | 111 | W242 K278 S279 T285 D286 | W242-E282 HydrophobicContact CH2-CB 3.8Å; W242-E282 HydrophobicContact CZ2-CB 4.12Å; K278-E282 VanDerWaalsContact CE-OE1 3.22Å; K278-E282 WeakPolarHBondContact CE-OE1 3.37Å; K278-E282 IonicContact NZ-OE1 2.68Å; K278-E282 WeakPolarHBondContact O-CG 3.29Å; K278-E282 PolarHBondContact O-N 3.13Å; S279-E282 PolarHBondContact O-N 3.31Å; E282-T285 PolarHBondContact O-N 3.25Å; E282-T285 PolarHBondContact O-OG1 3.18Å; E282-D286 PolarHBondContact O-N 3.09Å |
| 283 | L | 94.2 | Very high | 92.3 | Very high | 1 Ų | 1 | 49.7 Ų | 49.7 | 1% | 0.005 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59 | -47.2 | 174.5 | 174.4 | 63 | 0 | 0 | 0 | 112 | L239 W242 L243 S279 L280 T285 D286 I287 | L239-L283 HydrophobicContact CB-CD1 4.35Å; L239-L283 HydrophobicContact CD2-CD1 3.72Å; W242-L283 HydrophobicContact CB-CD1 4.29Å; W242-L283 HydrophobicContact CD2-CB 4.07Å; W242-L283 HydrophobicContact CD2-CD1 3.92Å; W242-L283 HydrophobicContact CD2-CG 4.43Å; W242-L283 HydrophobicContact CE3-CB 4.03Å; W242-L283 HydrophobicContact CE3-CD1 3.53Å; W242-L283 HydrophobicContact CE3-CG 4.34Å; W242-L283 HydrophobicContact CG-CD1 4.27Å; W242-L283 HydrophobicContact CH2-CB 4.22Å; W242-L283 HydrophobicContact CZ2-CB 4.27Å; W242-L283 HydrophobicContact CZ3-CB 4.1Å; W242-L283 HydrophobicContact CZ3-CD1 4.16Å; L243-L283 HydrophobicContact CB-CD2 3.89Å; L243-L283 HydrophobicContact CD1-CD2 4Å; S279-L283 PolarHBondContact O-N 3.19Å; L280-L283 HydrophobicContact CD1-CD2 4.36Å; L280-L283 PolarHBondContact O-N 2.82Å; L283-T285 VanDerWaalsContact C-N 3.3Å; L283-T285 PolarHBondContact O-N 3.06Å; L283-D286 PolarHBondContact O-N 3.25Å; L283-D286 VanDerWaalsContact O-N 3.15Å; L283-I287 HydrophobicContact CD1-CD1 3.82Å; L283-I287 HydrophobicContact CD1-CG1 4.01Å; L283-I287 HydrophobicContact CD2-CD1 4.45Å; L283-I287 HydrophobicContact CG-CD1 3.76Å; L283-I287 HydrophobicContact CG-CG1 4.38Å; L283-I287 WeakPolarHBondContact O-CG1 3.43Å; L283-I287 PolarHBondContact O-N 3.35Å |
| 284 | E | 94.8 | Very high | 92.9 | Very high | 55 Ų | 55 | 49.5 Ų | 49.5 | 26% | 0.257 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -56.2 | -44.9 | 177.1 | -175 | -173.5 | -174.7 | 0 | 0 | 111.3 | L280 S281 K288 T349 K353 | L280-E284 WeakPolarHBondContact O-CB 3.37Å; L280-E284 PolarHBondContact O-N 3.34Å; S281-E284 PolarHBondContact O-N 2.92Å; E284-K288 VanDerWaalsContact O-CB 3.27Å; E284-K288 WeakPolarHBondContact O-CB 3.33Å; E284-K288 PolarHBondContact O-N 3.39Å; E284-T349 HydrophobicContact CB-CG2 3.87Å; E284-T349 HydrophobicContact CG-CG2 4.41Å; E284-K353 WeakPolarHBondContact OE2-CD 3.35Å; E284-K353 IonicContact OE2-NZ 3.68Å; E284-K353 PolarHBondContact OE2-NZ 2.93Å |
| 285 | T | 94.6 | Very high | 93.4 | Very high | 84 Ų | 84 | 47.6 Ų | 47.6 | 52% | 0.515 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -65.3 | -39.5 | 177.8 | 59.8 | 0 | 0 | 0 | 0 | 112.5 | S281 E282 L283 K288 V289 | S281-T285 WeakPolarHBondContact O-CG2 3.37Å; S281-T285 PolarHBondContact O-N 3.17Å; S281-T285 PolarHBondContact O-OG1 3.36Å; E282-T285 PolarHBondContact O-N 3.25Å; E282-T285 PolarHBondContact O-OG1 3.18Å; L283-T285 VanDerWaalsContact C-N 3.3Å; L283-T285 PolarHBondContact O-N 3.06Å; T285-K288 PolarHBondContact O-N 2.96Å; T285-V289 VanDerWaalsContact O-CG2 3.29Å; T285-V289 WeakPolarHBondContact O-CG2 2.98Å; T285-V289 PolarHBondContact O-N 3.28Å |
| 286 | D | 93.6 | Very high | 93.7 | Very high | 38 Ų | 38 | 47.8 Ų | 47.8 | 20% | 0.203 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -68.5 | -41.6 | 178.6 | -167.8 | 24.8 | 0 | 0 | 0 | 111.6 | K235 L239 E282 L283 F290 | K235-D286 IonicContact NZ-OD1 2.78Å; K235-D286 PolarHBondContact NZ-OD1 3.41Å; K235-D286 IonicContact NZ-OD2 2.84Å; K235-D286 PolarHBondContact NZ-OD2 3.31Å; L239-D286 HydrophobicContact CD2-CB 4.22Å; L239-D286 WeakPolarHBondContact CD2-OD2 3.47Å; E282-D286 PolarHBondContact O-N 3.09Å; L283-D286 PolarHBondContact O-N 3.25Å; L283-D286 VanDerWaalsContact O-N 3.15Å; D286-F290 WeakPolarHBondContact O-CB 3.17Å; D286-F290 PolarHBondContact O-N 2.95Å |
| 287 | I | 95.4 | Very high | 94 | Very high | 2 Ų | 2 | 46.9 Ų | 46.9 | 1% | 0.01 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.4 | -46.6 | 172.6 | -63.9 | 164.9 | 0 | 0 | 0 | 110 | L239 L283 F290 K291 A342 L345 A346 T349 | L239-I287 HydrophobicContact CB-CG1 4.46Å; L239-I287 HydrophobicContact CD1-CG1 4.07Å; L239-I287 HydrophobicContact CD2-CG1 3.98Å; L239-I287 HydrophobicContact CG-CG1 4.39Å; L283-I287 HydrophobicContact CD1-CD1 3.82Å; L283-I287 HydrophobicContact CD1-CG1 4.01Å; L283-I287 HydrophobicContact CD2-CD1 4.45Å; L283-I287 HydrophobicContact CG-CD1 3.76Å; L283-I287 HydrophobicContact CG-CG1 4.38Å; L283-I287 WeakPolarHBondContact O-CG1 3.43Å; L283-I287 PolarHBondContact O-N 3.35Å; I287-F290 PolarHBondContact O-N 3.24Å; I287-K291 VanDerWaalsContact O-CB 3.3Å; I287-K291 WeakPolarHBondContact O-CB 3.48Å; I287-K291 PolarHBondContact O-N 3.16Å; I287-A342 WeakPolarHBondContact CG2-O 3.39Å; I287-L345 HydrophobicContact CD1-CB 4.12Å; I287-A346 HydrophobicContact CG2-CB 3.72Å; I287-T349 WeakPolarHBondContact CD1-OG1 3.47Å |
| 288 | K | 95.2 | Very high | 94.2 | Very high | 114 Ų | 114 | 46.5 Ų | 46.5 | 50% | 0.496 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -59.9 | -49 | -179.7 | 180 | 177.8 | 173.7 | 178.8 | 0 | 111.9 | E284 T285 F290 K291 E292 | E284-K288 VanDerWaalsContact O-CB 3.27Å; E284-K288 WeakPolarHBondContact O-CB 3.33Å; E284-K288 PolarHBondContact O-N 3.39Å; T285-K288 PolarHBondContact O-N 2.96Å; K288-F290 VanDerWaalsContact C-N 3.34Å; K288-F290 PolarHBondContact O-N 2.99Å; K288-K291 PolarHBondContact O-N 3.25Å; K288-E292 WeakPolarHBondContact CE-OE1 3.24Å; K288-E292 HydrophobicContact CG-CG 4.42Å; K288-E292 IonicContact NZ-OE1 2.77Å; K288-E292 WeakPolarHBondContact O-CB 3.42Å; K288-E292 WeakPolarHBondContact O-CG 3.45Å; K288-E292 PolarHBondContact O-N 2.85Å |
| 289 | V | 94.7 | Very high | 94.2 | Very high | 52 Ų | 52 | 45.9 Ų | 45.9 | 32% | 0.315 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -64.8 | -40.5 | 179.6 | 176.2 | 0 | 0 | 0 | 0 | 110.9 | T285 S293 | T285-V289 VanDerWaalsContact O-CG2 3.29Å; T285-V289 WeakPolarHBondContact O-CG2 2.98Å; T285-V289 PolarHBondContact O-N 3.28Å; V289-S293 WeakPolarHBondContact O-CB 3.31Å; V289-S293 PolarHBondContact O-N 3.35Å; V289-S293 PolarHBondContact O-OG 2.69Å |
| 290 | F | 94.7 | Very high | 94.2 | Very high | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.2 | -48.7 | 174.8 | 175.2 | -124.4 | 0 | 0 | 0 | 111.3 | T167 M180 L232 K235 V236 L239 D286 I287 K288 S293 L294 A342 | T167-F290 HydrophobicContact CG2-CB 4.29Å; T167-F290 HydrophobicContact CG2-CD2 3.97Å; M180-F290 HydrophobicContact CE-CD2 4.42Å; M180-F290 HydrophobicContact CE-CE2 3.9Å; L232-F290 HydrophobicContact CD2-CE2 3.65Å; L232-F290 HydrophobicContact CD2-CZ 3.8Å; K235-F290 HydrophobicContact CB-CE2 4.45Å; K235-F290 HydrophobicContact CB-CZ 4.4Å; K235-F290 HydrophobicContact CG-CD1 4.33Å; K235-F290 HydrophobicContact CG-CD2 3.95Å; K235-F290 HydrophobicContact CG-CE1 4.27Å; K235-F290 HydrophobicContact CG-CE2 3.89Å; K235-F290 HydrophobicContact CG-CG 4.16Å; K235-F290 HydrophobicContact CG-CZ 4.04Å; V236-F290 HydrophobicContact CG2-CE1 3.82Å; V236-F290 HydrophobicContact CG2-CZ 4.24Å; L239-F290 HydrophobicContact CD1-CD1 3.97Å; D286-F290 WeakPolarHBondContact O-CB 3.17Å; D286-F290 PolarHBondContact O-N 2.95Å; I287-F290 PolarHBondContact O-N 3.24Å; K288-F290 VanDerWaalsContact C-N 3.34Å; K288-F290 PolarHBondContact O-N 2.99Å; F290-S293 PolarHBondContact O-N 3.25Å; F290-S293 PolarHBondContact O-OG 2.87Å; F290-L294 HydrophobicContact CE1-CD1 3.98Å; F290-L294 HydrophobicContact CE2-CD1 3.96Å; F290-L294 HydrophobicContact CE2-CD2 4.32Å; F290-L294 HydrophobicContact CE2-CG 4.12Å; F290-L294 HydrophobicContact CZ-CD1 3.66Å; F290-L294 HydrophobicContact CZ-CG 4.33Å; F290-L294 PolarHBondContact O-N 3Å; F290-L294 VanDerWaalsContact O-N 3.13Å; F290-A342 HydrophobicContact CD1-CB 3.84Å; F290-A342 HydrophobicContact CE1-CB 3.87Å |
| 291 | K | 94.8 | Very high | 94 | Very high | 35 Ų | 35 | 53.8 Ų | 53.8 | 15% | 0.152 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -59.6 | -48.9 | 177.6 | -173.7 | -179.7 | 72.9 | 162.6 | 0 | 112.7 | I287 K288 S293 L294 L295 Y339 E343 | I287-K291 VanDerWaalsContact O-CB 3.3Å; I287-K291 WeakPolarHBondContact O-CB 3.48Å; I287-K291 PolarHBondContact O-N 3.16Å; K288-K291 PolarHBondContact O-N 3.25Å; K291-S293 PolarHBondContact O-N 3.49Å; K291-L294 PolarHBondContact O-N 2.83Å; K291-L294 VanDerWaalsContact O-N 3.15Å; K291-L295 HydrophobicContact CG-CD1 4.3Å; K291-L295 PolarHBondContact O-N 3.38Å; K291-Y339 HydrophobicContact CD-CD2 4.34Å; K291-Y339 HydrophobicContact CD-CE2 3.59Å; K291-Y339 HydrophobicContact CG-CD2 3.64Å; K291-Y339 HydrophobicContact CG-CE2 3.24Å; K291-E343 WeakPolarHBondContact CD-OE2 3.17Å; K291-E343 WeakPolarHBondContact CE-OE2 3.37Å; K291-E343 IonicContact NZ-OE1 3.66Å; K291-E343 IonicContact NZ-OE2 2.62Å; K291-E343 PolarHBondContact NZ-OE2 2.81Å |
| 292 | E | 94.8 | Very high | 93.8 | Very high | 98 Ų | 98 | 54.5 Ų | 54.5 | 46% | 0.458 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -60.1 | -34.6 | 177.7 | -74.7 | 175.7 | 176.3 | 0 | 0 | 111.7 | K288 K296 | K288-E292 WeakPolarHBondContact CE-OE1 3.24Å; K288-E292 HydrophobicContact CG-CG 4.42Å; K288-E292 IonicContact NZ-OE1 2.77Å; K288-E292 WeakPolarHBondContact O-CB 3.42Å; K288-E292 WeakPolarHBondContact O-CG 3.45Å; K288-E292 PolarHBondContact O-N 2.85Å; E292-K296 WeakPolarHBondContact O-CB 3.43Å; E292-K296 PolarHBondContact O-N 3.31Å |
| 293 | S | 93.7 | Very high | 93.6 | Very high | 18 Ų | 18 | 51.5 Ų | 51.5 | 13% | 0.126 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -69 | -34.8 | 176.4 | 76.1 | 0 | 0 | 0 | 0 | 113.5 | V289 F290 K291 | V289-S293 WeakPolarHBondContact O-CB 3.31Å; V289-S293 PolarHBondContact O-N 3.35Å; V289-S293 PolarHBondContact O-OG 2.69Å; F290-S293 PolarHBondContact O-N 3.25Å; F290-S293 PolarHBondContact O-OG 2.87Å; K291-S293 PolarHBondContact O-N 3.49Å |
| 294 | L | 94.8 | Very high | 93.4 | Very high | 1 Ų | 1 | 51.7 Ų | 51.7 | 1% | 0.005 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -73.1 | -45.3 | 174 | -66.4 | 179.8 | 0 | 0 | 0 | 111.4 | L232 F290 K291 K296 I297 L298 L335 | L232-L294 HydrophobicContact CD2-CD2 3.95Å; F290-L294 HydrophobicContact CE1-CD1 3.98Å; F290-L294 HydrophobicContact CE2-CD1 3.96Å; F290-L294 HydrophobicContact CE2-CD2 4.32Å; F290-L294 HydrophobicContact CE2-CG 4.12Å; F290-L294 HydrophobicContact CZ-CD1 3.66Å; F290-L294 HydrophobicContact CZ-CG 4.33Å; F290-L294 PolarHBondContact O-N 3Å; F290-L294 VanDerWaalsContact O-N 3.13Å; K291-L294 PolarHBondContact O-N 2.83Å; K291-L294 VanDerWaalsContact O-N 3.15Å; L294-K296 VanDerWaalsContact C-N 3.3Å; L294-K296 PolarHBondContact O-N 3.04Å; L294-I297 PolarHBondContact O-N 3.14Å; L294-L298 PolarHBondContact O-N 3.26Å; L294-L335 HydrophobicContact CD2-CD2 4.01Å |
| 295 | L | 94.8 | Very high | 93 | Very high | 48 Ų | 48 | 52.5 Ų | 52.5 | 25% | 0.251 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -56 | -45.6 | 177.5 | -82.5 | 172.9 | 0 | 0 | 0 | 112.2 | K291 I297 L298 D299 Y339 | K291-L295 HydrophobicContact CG-CD1 4.3Å; K291-L295 PolarHBondContact O-N 3.38Å; L295-I297 PolarHBondContact O-N 2.92Å; L295-I297 VanDerWaalsContact O-N 3.09Å; L295-L298 PolarHBondContact O-N 3.47Å; L295-L298 VanDerWaalsContact O-N 3.08Å; L295-D299 WeakPolarHBondContact O-CB 3.36Å; L295-D299 PolarHBondContact O-N 2.97Å; L295-Y339 HydrophobicContact CD1-CE2 3.58Å; L295-Y339 HydrophobicContact CD2-CD2 3.92Å; L295-Y339 HydrophobicContact CD2-CE1 4.34Å; L295-Y339 HydrophobicContact CD2-CE2 3.33Å; L295-Y339 HydrophobicContact CG-CD2 3.78Å; L295-Y339 HydrophobicContact CG-CE2 3.22Å |
| 296 | K | 93.9 | Very high | 92.7 | Very high | 126 Ų | 126 | 52 Ų | 52 | 55% | 0.548 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -54.5 | -33.9 | 178.4 | -178.4 | 176.7 | 177.6 | -179.7 | 0 | 112.9 | E292 L294 | E292-K296 WeakPolarHBondContact O-CB 3.43Å; E292-K296 PolarHBondContact O-N 3.31Å; L294-K296 VanDerWaalsContact C-N 3.3Å; L294-K296 PolarHBondContact O-N 3.04Å |
| 297 | I | 93.6 | Very high | 92.5 | Very high | 2 Ų | 2 | 50.3 Ų | 50.3 | 1% | 0.01 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -81.1 | -43.1 | 179.4 | -67.8 | 166.2 | 0 | 0 | 0 | 110.3 | L169 L294 L295 D299 E300 M303 I304 L307 L335 | L169-I297 HydrophobicContact CB-CD1 3.56Å; L169-I297 HydrophobicContact CD2-CD1 3.26Å; L169-I297 HydrophobicContact CG-CD1 3.32Å; L294-I297 PolarHBondContact O-N 3.14Å; L295-I297 PolarHBondContact O-N 2.92Å; L295-I297 VanDerWaalsContact O-N 3.09Å; I297-D299 PolarHBondContact O-N 2.98Å; I297-E300 CarbonylContact O-C 3.6Å; I297-E300 PolarHBondContact O-N 2.81Å; I297-E300 VanDerWaalsContact O-O 3.12Å; I297-M303 HydrophobicContact CG1-CE 4.05Å; I297-M303 HydrophobicContact CG2-CB 4.27Å; I297-I304 HydrophobicContact CG2-CG1 4.15Å; I297-I304 WeakPolarHBondContact O-CG1 3.4Å; I297-L307 HydrophobicContact CG2-CD1 3.53Å; I297-L335 HydrophobicContact CG2-CD1 3.71Å |
| 298 | L | 93.8 | Very high | 92.1 | Very high | 13 Ų | 13 | 50.3 Ų | 50.3 | 7% | 0.068 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.1 | -28.2 | 176.6 | -70.9 | 170.9 | 0 | 0 | 0 | 113.2 | K4 L294 L295 E332 L335 E336 Y339 | K4-L298 PolarHBondContact NZ-O 3.49Å; L294-L298 PolarHBondContact O-N 3.26Å; L295-L298 PolarHBondContact O-N 3.47Å; L295-L298 VanDerWaalsContact O-N 3.08Å; L298-E332 HydrophobicContact CD2-CG 3.88Å; L298-L335 HydrophobicContact CD2-CB 3.7Å; L298-L335 HydrophobicContact CD2-CD1 4.42Å; L298-L335 HydrophobicContact CG-CB 4.22Å; L298-E336 HydrophobicContact CD1-CG 4.2Å; L298-E336 HydrophobicContact CD2-CG 3.83Å; L298-Y339 HydrophobicContact CD1-CG 4.22Å |
| 299 | D | 93.1 | Very high | 91.5 | Very high | 125 Ų | 125 | 44.9 Ų | 44.9 | 67% | 0.668 | 23% | 0.231 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -75.4 | -25.4 | 178.4 | -74.2 | -27 | 0 | 0 | 0 | 113 | L295 I297 | L295-D299 WeakPolarHBondContact O-CB 3.36Å; L295-D299 PolarHBondContact O-N 2.97Å; I297-D299 PolarHBondContact O-N 2.98Å |
| 300 | E | 92.8 | Very high | 90.5 | Very high | 96 Ų | 96 | 44.8 Ų | 44.8 | 45% | 0.449 | 23% | 0.231 | S | C | . | . | trans | -116.5 | 98.1 | -175.4 | -68 | -179.8 | -151.3 | 0 | 0 | 110.4 | I297 A302 M303 I304 | I297-E300 CarbonylContact O-C 3.6Å; I297-E300 PolarHBondContact O-N 2.81Å; I297-E300 VanDerWaalsContact O-O 3.12Å; E300-A302 PolarHBondContact O-N 3.33Å; E300-M303 HydrophobicContact CB-CB 4.06Å; E300-M303 HydrophobicContact CB-CG 3.69Å; E300-M303 HydrophobicContact CG-CG 4.48Å; E300-M303 WeakPolarHBondContact O-CA 3.39Å; E300-M303 VanDerWaalsContact O-CB 3.32Å; E300-M303 WeakPolarHBondContact O-CB 3.36Å; E300-M303 PolarHBondContact O-N 3.46Å; E300-M303 VanDerWaalsContact OE2-CG 3.3Å; E300-M303 WeakPolarHBondContact OE2-CG 3.47Å; E300-I304 PolarHBondContact O-N 2.86Å | ||
| 301 | D | 88.8 | Confident | 89.2 | Confident | 95 Ų | 95 | 47.1 Ų | 47.1 | 51% | 0.508 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -54.7 | -34.1 | -179.1 | -56.1 | -33.3 | 0 | 0 | 0 | 112.1 | K4 M303 I304 E305 | K4-D301 IonicContact NZ-OD1 2.66Å; K4-D301 PolarHBondContact NZ-OD1 2.99Å; D301-M303 VanDerWaalsContact C-N 3.26Å; D301-M303 PolarHBondContact O-N 2.8Å; D301-I304 WeakPolarHBondContact O-CB 3.49Å; D301-I304 PolarHBondContact O-N 3.44Å; D301-I304 VanDerWaalsContact O-N 3.11Å; D301-E305 WeakPolarHBondContact O-CG 3.32Å; D301-E305 PolarHBondContact O-N 3.43Å |
| 302 | A | 89.5 | Confident | 87.4 | Confident | 54 Ų | 54 | 52.3 Ų | 52.3 | 45% | 0.446 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -62.1 | -28.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114 | E300 Q306 | E300-A302 PolarHBondContact O-N 3.33Å; A302-Q306 VanDerWaalsContact O-CG 3.25Å; A302-Q306 WeakPolarHBondContact O-CG 3.42Å; A302-Q306 PolarHBondContact O-N 2.92Å; A302-Q306 PolarHBondContact O-NE2 2.97Å |
| 303 | M | 89.3 | Confident | 85.6 | Confident | 25 Ų | 25 | 51 Ų | 51 | 12% | 0.123 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -75.3 | -37.7 | 174.1 | -70.3 | -77.2 | -65.2 | 0 | 0 | 110.8 | I297 E300 D301 Q306 L307 | I297-M303 HydrophobicContact CG1-CE 4.05Å; I297-M303 HydrophobicContact CG2-CB 4.27Å; E300-M303 HydrophobicContact CB-CB 4.06Å; E300-M303 HydrophobicContact CB-CG 3.69Å; E300-M303 HydrophobicContact CG-CG 4.48Å; E300-M303 WeakPolarHBondContact O-CA 3.39Å; E300-M303 VanDerWaalsContact O-CB 3.32Å; E300-M303 WeakPolarHBondContact O-CB 3.36Å; E300-M303 PolarHBondContact O-N 3.46Å; E300-M303 VanDerWaalsContact OE2-CG 3.3Å; E300-M303 WeakPolarHBondContact OE2-CG 3.47Å; D301-M303 VanDerWaalsContact C-N 3.26Å; D301-M303 PolarHBondContact O-N 2.8Å; M303-Q306 PolarHBondContact O-N 3.36Å; M303-L307 WeakPolarHBondContact O-CG 3.49Å; M303-L307 PolarHBondContact O-N 2.89Å |
| 304 | I | 90.4 | Very high | 83.8 | Confident | 4 Ų | 4 | 53.3 Ų | 53.3 | 2% | 0.021 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62 | -46.2 | 174.7 | -55.3 | 177.5 | 0 | 0 | 0 | 109.8 | I297 E300 D301 Q306 L307 C308 M331 E332 | I297-I304 HydrophobicContact CG2-CG1 4.15Å; I297-I304 WeakPolarHBondContact O-CG1 3.4Å; E300-I304 PolarHBondContact O-N 2.86Å; D301-I304 WeakPolarHBondContact O-CB 3.49Å; D301-I304 PolarHBondContact O-N 3.44Å; D301-I304 VanDerWaalsContact O-N 3.11Å; I304-Q306 PolarHBondContact O-N 3.21Å; I304-L307 WeakPolarHBondContact O-CB 3.35Å; I304-L307 PolarHBondContact O-N 3.49Å; I304-C308 PolarHBondContact O-N 3.23Å; I304-M331 HydrophobicContact CG2-CB 4.03Å; I304-M331 HydrophobicContact CG2-CG 3.95Å; I304-E332 HydrophobicContact CD1-CB 4.13Å; I304-E332 HydrophobicContact CD1-CG 4.02Å |
| 305 | E | 87.6 | Confident | 81.9 | Confident | 73 Ų | 73 | 57.4 Ų | 57.4 | 34% | 0.341 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -59.7 | -32.3 | 176.5 | -65.4 | -164.1 | 127.2 | 0 | 0 | 113.4 | D301 L307 C308 K311 W312 | D301-E305 WeakPolarHBondContact O-CG 3.32Å; D301-E305 PolarHBondContact O-N 3.43Å; E305-L307 VanDerWaalsContact C-N 3.32Å; E305-C308 PolarHBondContact O-N 2.87Å; E305-K311 IonicContact OE1-NZ 3.26Å; E305-K311 PolarHBondContact OE1-NZ 3.01Å; E305-W312 PolarHBondContact O-NE1 2.8Å |
| 306 | Q | 88 | Confident | 79.9 | Confident | 74 Ų | 74 | 64.7 Ų | 64.7 | 35% | 0.346 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -76.6 | -18 | 177.2 | -72.7 | 171.2 | 35.1 | 0 | 0 | 113.4 | T171 A302 M303 I304 | T171-Q306 HydrophobicContact CG2-CB 3.82Å; T171-Q306 WeakPolarHBondContact CG2-O 3.44Å; T171-Q306 PolarHBondContact OG1-OE1 3.44Å; A302-Q306 VanDerWaalsContact O-CG 3.25Å; A302-Q306 WeakPolarHBondContact O-CG 3.42Å; A302-Q306 PolarHBondContact O-N 2.92Å; A302-Q306 PolarHBondContact O-NE2 2.97Å; M303-Q306 PolarHBondContact O-N 3.36Å; I304-Q306 PolarHBondContact O-N 3.21Å |
| 307 | L | 88.5 | Confident | 78 | Confident | 1 Ų | 1 | 63 Ų | 63 | 1% | 0.005 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -78.7 | -26.5 | 173.1 | -67.7 | 171.3 | 0 | 0 | 0 | 111.5 | L169 T171 I176 I297 M303 I304 E305 L309 M331 L335 | L169-L307 HydrophobicContact CD1-CD2 4.43Å; L169-L307 HydrophobicContact CG-CD2 4.46Å; T171-L307 HydrophobicContact CG2-CD2 3.44Å; T171-L307 VanDerWaalsContact CG2-CD2 3.44Å; T171-L307 HydrophobicContact CG2-CG 3.89Å; I176-L307 HydrophobicContact CB-CD2 4.37Å; I176-L307 HydrophobicContact CD1-CB 4.24Å; I176-L307 HydrophobicContact CD1-CD2 3.72Å; I176-L307 WeakPolarHBondContact CD1-O 3.34Å; I176-L307 HydrophobicContact CG1-CD2 3.94Å; I176-L307 HydrophobicContact CG2-CD2 3.55Å; I297-L307 HydrophobicContact CG2-CD1 3.53Å; M303-L307 WeakPolarHBondContact O-CG 3.49Å; M303-L307 PolarHBondContact O-N 2.89Å; I304-L307 WeakPolarHBondContact O-CB 3.35Å; I304-L307 PolarHBondContact O-N 3.49Å; E305-L307 VanDerWaalsContact C-N 3.32Å; L307-L309 VanDerWaalsContact C-N 3.29Å; L307-L309 PolarHBondContact O-N 3.3Å; L307-M331 HydrophobicContact CB-CE 4.23Å; L307-M331 HydrophobicContact CB-CG 4.27Å; L307-M331 HydrophobicContact CB-SD 4.43Å; L307-M331 HydrophobicContact CD1-CG 4.46Å; L307-L335 HydrophobicContact CD1-CD1 3.82Å |
| 308 | C | 86.9 | Confident | 75.9 | Confident | 2 Ų | 2 | 65.4 Ų | 65.4 | 1% | 0.014 | 33% | 0.327 | C | S | . | . | trans | -78.1 | 74.2 | 175.7 | -60.9 | 0 | 0 | 0 | 0 | 110.9 | I304 E305 T310 K311 | I304-C308 PolarHBondContact O-N 3.23Å; E305-C308 PolarHBondContact O-N 2.87Å; C308-T310 PolarHBondContact O-N 3.31Å; C308-K311 HydrophobicContact CB-CB 4.32Å; C308-K311 WeakPolarHBondContact O-CB 3.35Å; C308-K311 PolarHBondContact O-N 3.01Å | ||
| 309 | L | 82.8 | Confident | 73.9 | Confident | 0 Ų | 0 | 72.1 Ų | 72.1 | 0% | 0 | 36% | 0.358 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.4 | -35.2 | -175.8 | -59.4 | -174.6 | 0 | 0 | 0 | 113 | N174 I176 L187 Q189 E224 L307 K311 W312 | N174-L309 WeakPolarHBondContact O-CD2 3.47Å; I176-L309 HydrophobicContact CD1-CD1 4.43Å; I176-L309 HydrophobicContact CD1-CG 4.3Å; I176-L309 HydrophobicContact CG1-CD1 4.15Å; I176-L309 HydrophobicContact CG1-CD2 4.12Å; I176-L309 HydrophobicContact CG1-CG 4.17Å; L187-L309 HydrophobicContact CD2-CD1 3.65Å; Q189-L309 HydrophobicContact CB-CB 4.45Å; E224-L309 PolarHBondContact OE1-N 2.96Å; L307-L309 VanDerWaalsContact C-N 3.29Å; L307-L309 PolarHBondContact O-N 3.3Å; L309-K311 VanDerWaalsContact C-N 3.25Å; L309-K311 PolarHBondContact O-N 3.45Å; L309-W312 PolarHBondContact O-N 3.36Å; L309-W312 VanDerWaalsContact O-N 3.17Å |
| 310 | T | 74.2 | Confident | 71.8 | Confident | 50 Ų | 50 | 73.8 Ų | 73.8 | 31% | 0.307 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.1 | -31.6 | -179.1 | -56.1 | 0 | 0 | 0 | 0 | 112.6 | P222 E224 C308 W312 T313 D314 | P222-T310 WeakPolarHBondContact CB-OG1 3.27Å; E224-T310 VanDerWaalsContact CD-OG1 3.23Å; E224-T310 VanDerWaalsContact OE1-CB 3.24Å; E224-T310 WeakPolarHBondContact OE1-CB 3.19Å; E224-T310 PolarHBondContact OE1-N 3.32Å; E224-T310 PolarHBondContact OE1-OG1 3.5Å; E224-T310 PolarHBondContact OE2-OG1 3.38Å; E224-T310 VanDerWaalsContact OE2-OG1 3.08Å; C308-T310 PolarHBondContact O-N 3.31Å; T310-W312 PolarHBondContact O-N 2.84Å; T310-T313 PolarHBondContact O-N 3.18Å; T310-D314 PolarHBondContact O-N 3.36Å |
| 311 | K | 67 | Low | 69.7 | Low | 49 Ų | 49 | 70.6 Ų | 70.6 | 21% | 0.213 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -58.8 | -30.6 | 177.5 | -176.5 | 176.5 | -179.3 | 175.9 | 0 | 112.5 | E305 C308 L309 F318 | E305-K311 IonicContact OE1-NZ 3.26Å; E305-K311 PolarHBondContact OE1-NZ 3.01Å; C308-K311 HydrophobicContact CB-CB 4.32Å; C308-K311 WeakPolarHBondContact O-CB 3.35Å; C308-K311 PolarHBondContact O-N 3.01Å; L309-K311 VanDerWaalsContact C-N 3.25Å; L309-K311 PolarHBondContact O-N 3.45Å; K311-F318 HydrophobicContact CB-CD2 4.48Å; K311-F318 HydrophobicContact CB-CE2 4.36Å; K311-F318 HydrophobicContact CD-CD2 4.48Å; K311-F318 HydrophobicContact CD-CE2 3.79Å; K311-F318 HydrophobicContact CD-CZ 3.96Å; K311-F318 HydrophobicContact CG-CD2 3.92Å; K311-F318 HydrophobicContact CG-CE2 3.72Å; K311-F318 HydrophobicContact CG-CZ 4.26Å |
| 312 | W | 56.8 | Low | 67.8 | Low | 145 Ų | 145 | 72.2 Ų | 72.2 | 55% | 0.549 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -91.1 | -12 | -173.3 | -61.6 | 96.5 | 0 | 0 | 0 | 113.8 | E305 L309 T310 | E305-W312 PolarHBondContact O-NE1 2.8Å; L309-W312 PolarHBondContact O-N 3.36Å; L309-W312 VanDerWaalsContact O-N 3.17Å; T310-W312 PolarHBondContact O-N 2.84Å |
| 313 | T | 57.2 | Low | 66 | Low | 71 Ų | 71 | 77.6 Ų | 77.6 | 44% | 0.436 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -102.8 | -35.8 | -176.1 | -53.6 | 0 | 0 | 0 | 0 | 113.1 | Q189 T310 | Q189-T313 VanDerWaalsContact OE1-CG2 3.28Å; Q189-T313 PolarHBondContact OE1-OG1 2.96Å; T310-T313 PolarHBondContact O-N 3.18Å |
| 314 | D | 56.8 | Low | 64.1 | Low | 66 Ų | 66 | 79.5 Ų | 79.5 | 35% | 0.353 | 41% | 0.405 | S | S | . | . | trans | -132 | 92.2 | 175.3 | -160.5 | -11.6 | 0 | 0 | 0 | 112.7 | T310 R316 I317 | T310-D314 PolarHBondContact O-N 3.36Å; D314-R316 PolarHBondContact O-N 2.93Å; D314-R316 VanDerWaalsContact O-N 3.16Å; D314-R316 WeakPolarHBondContact OD1-CB 3.48Å; D314-R316 PolarHBondContact OD1-N 2.68Å; D314-R316 VanDerWaalsContact OD1-N 3.14Å; D314-I317 HydrophobicContact CB-CD1 3.91Å; D314-I317 HydrophobicContact CB-CG1 4.17Å | ||
| 315 | P | 55.1 | Low | 62.5 | Low | 87 Ų | 87 | 83.7 Ų | 83.7 | 57% | 0.565 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -63.6 | -17.2 | 177.7 | -19.3 | 30.6 | 0 | 0 | 0 | 113.9 | F318 | P315-F318 VanDerWaalsContact O-CB 3.3Å; P315-F318 WeakPolarHBondContact O-CB 3.48Å; P315-F318 PolarHBondContact O-N 2.95Å |
| 316 | R | 52.8 | Low | 62 | Low | 200 Ų | 200 | 83.9 Ų | 83.9 | 76% | 0.755 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -80.3 | -30.4 | -173.1 | -55.1 | -180 | -163.4 | -173.1 | 5.2 | 112.3 | D314 F318 | D314-R316 PolarHBondContact O-N 2.93Å; D314-R316 VanDerWaalsContact O-N 3.16Å; D314-R316 WeakPolarHBondContact OD1-CB 3.48Å; D314-R316 PolarHBondContact OD1-N 2.68Å; D314-R316 VanDerWaalsContact OD1-N 3.14Å; R316-F318 PolarHBondContact O-N 3.23Å |
| 317 | I | 53.6 | Low | 61.6 | Low | 90 Ų | 90 | 82.6 Ų | 82.6 | 46% | 0.462 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -65.6 | -27.3 | 170 | -58.4 | 175.7 | 0 | 0 | 0 | 109.9 | D314 E320 S321 | D314-I317 HydrophobicContact CB-CD1 3.91Å; D314-I317 HydrophobicContact CB-CG1 4.17Å; I317-E320 PolarHBondContact O-N 2.92Å; I317-S321 PolarHBondContact O-N 2.9Å; I317-S321 PolarHBondContact O-OG 2.78Å |
| 318 | F | 49.1 | Very low | 61.5 | Low | 53 Ų | 53 | 83.2 Ų | 83.2 | 23% | 0.232 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -76.3 | -29.7 | -177 | -149.4 | -96 | 0 | 0 | 0 | 113.8 | K311 P315 R316 E320 S321 | K311-F318 HydrophobicContact CB-CD2 4.48Å; K311-F318 HydrophobicContact CB-CE2 4.36Å; K311-F318 HydrophobicContact CD-CD2 4.48Å; K311-F318 HydrophobicContact CD-CE2 3.79Å; K311-F318 HydrophobicContact CD-CZ 3.96Å; K311-F318 HydrophobicContact CG-CD2 3.92Å; K311-F318 HydrophobicContact CG-CE2 3.72Å; K311-F318 HydrophobicContact CG-CZ 4.26Å; P315-F318 VanDerWaalsContact O-CB 3.3Å; P315-F318 WeakPolarHBondContact O-CB 3.48Å; P315-F318 PolarHBondContact O-N 2.95Å; R316-F318 PolarHBondContact O-N 3.23Å; F318-E320 VanDerWaalsContact C-N 3.34Å; F318-S321 VanDerWaalsContact CA-OG 3.27Å; F318-S321 WeakPolarHBondContact CA-OG 3.27Å; F318-S321 PolarHBondContact O-N 2.86Å; F318-S321 PolarHBondContact O-OG 2.69Å |
| 319 | E | 50.8 | Low | 61.5 | Low | 155 Ų | 155 | 86.5 Ų | 86.5 | 72% | 0.724 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -70 | -29.8 | 174.3 | -85.4 | -176.5 | 154.1 | 0 | 0 | 112.4 | ||
| 320 | E | 50.3 | Low | 61.7 | Low | 159 Ų | 159 | 89.2 Ų | 89.2 | 74% | 0.743 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -78 | -28.5 | 174.8 | -76.6 | -174.6 | 156.9 | 0 | 0 | 113 | I317 F318 N322 | I317-E320 PolarHBondContact O-N 2.92Å; F318-E320 VanDerWaalsContact C-N 3.34Å; E320-N322 VanDerWaalsContact C-N 3.29Å; E320-N322 PolarHBondContact O-N 2.94Å |
| 321 | S | 49 | Very low | 62.5 | Low | 29 Ų | 29 | 86.8 Ų | 86.8 | 20% | 0.203 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -75.7 | -9.6 | 177.7 | 49.5 | 0 | 0 | 0 | 0 | 115 | I317 F318 L323 G324 | I317-S321 PolarHBondContact O-N 2.9Å; I317-S321 PolarHBondContact O-OG 2.78Å; F318-S321 VanDerWaalsContact CA-OG 3.27Å; F318-S321 WeakPolarHBondContact CA-OG 3.27Å; F318-S321 PolarHBondContact O-N 2.86Å; F318-S321 PolarHBondContact O-OG 2.69Å; S321-L323 PolarHBondContact O-N 3.32Å; S321-G324 PolarHBondContact O-N 3.39Å; S321-G324 VanDerWaalsContact O-N 3.14Å |
| 322 | N | 47.8 | Very low | 63.7 | Low | 129 Ų | 129 | 86 Ų | 86 | 69% | 0.69 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.9 | -4.7 | 168.4 | -80.5 | -30.3 | 0 | 0 | 0 | 113.5 | E320 | E320-N322 VanDerWaalsContact C-N 3.29Å; E320-N322 PolarHBondContact O-N 2.94Å |
| 323 | L | 51.6 | Low | 65.5 | Low | 168 Ų | 168 | 82.4 Ų | 82.4 | 88% | 0.88 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.7 | 7 | 176.4 | -88.6 | 156.4 | 0 | 0 | 0 | 115.6 | S321 | S321-L323 PolarHBondContact O-N 3.32Š|
| 324 | G | 49.4 | Very low | 67.2 | Low | 65 Ų | 65 | 80 Ų | 80 | 67% | 0.67 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 174 | -12.8 | 163.1 | 0 | 0 | 0 | 0 | 0 | 122.4 | S321 | S321-G324 PolarHBondContact O-N 3.39Å; S321-G324 VanDerWaalsContact O-N 3.14Å |
| 325 | I | 58.4 | Low | 69 | Low | 92 Ų | 92 | 76.9 Ų | 76.9 | 47% | 0.472 | 40% | 0.397 | S | S | . | . | trans | -144.4 | 113.7 | -177.1 | -55.9 | 178.6 | 0 | 0 | 0 | 109.8 | H327 E330 | I325-H327 PolarHBondContact O-N 3.35Å; I325-E330 HydrophobicContact CG2-CG 3.6Å; I325-E330 WeakPolarHBondContact CG2-OE1 2.83Å | ||
| 326 | D | 77.1 | Confident | 71 | Confident | 77 Ų | 77 | 74.5 Ų | 74.5 | 41% | 0.412 | 38% | 0.378 | S | S | . | . | trans | -79.5 | 112.1 | 170 | -176.4 | 6.1 | 0 | 0 | 0 | 109.1 | C328 E329 E330 | D326-C328 PolarHBondContact O-N 2.85Å; D326-C328 VanDerWaalsContact O-N 3.14Å; D326-C328 WeakPolarHBondContact OD1-CB 3.3Å; D326-C328 PolarHBondContact OD1-N 3.09Å; D326-E329 HydrophobicContact CB-CB 4.02Å; D326-E329 WeakPolarHBondContact O-CA 3.35Å; D326-E329 WeakPolarHBondContact O-CB 2.97Å; D326-E329 PolarHBondContact O-N 3.18Å; D326-E330 PolarHBondContact O-N 3.35Å; D326-E330 VanDerWaalsContact O-N 3.09Å | ||
| 327 | H | 79.6 | Confident | 73 | Confident | 47 Ų | 47 | 68.9 Ų | 68.9 | 22% | 0.218 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -57.3 | -26.8 | 176.7 | -66.1 | -54.2 | 0 | 0 | 0 | 112.8 | F225 I325 E330 M331 | F225-H327 HydrophobicContact CZ-CB 4.24Å; F225-H327 WeakPolarHBondContact CZ-O 3.32Å; I325-H327 PolarHBondContact O-N 3.35Å; H327-E330 IonicContact ND1-OE2 3.88Å; H327-M331 WeakPolarHBondContact O-CB 3.07Å; H327-M331 PolarHBondContact O-N 3.19Å |
| 328 | C | 84.8 | Confident | 75.1 | Confident | 14 Ų | 14 | 65 Ų | 65 | 10% | 0.095 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -67.7 | -40.1 | 172.8 | -65 | 0 | 0 | 0 | 0 | 111.6 | D326 M331 E332 | D326-C328 PolarHBondContact O-N 2.85Å; D326-C328 VanDerWaalsContact O-N 3.14Å; D326-C328 WeakPolarHBondContact OD1-CB 3.3Å; D326-C328 PolarHBondContact OD1-N 3.09Å; C328-M331 PolarHBondContact O-N 3.41Å; C328-E332 WeakPolarHBondContact O-CB 3.49Å; C328-E332 PolarHBondContact O-N 3.03Å |
| 329 | E | 87.5 | Confident | 77.4 | Confident | 70 Ų | 70 | 64.5 Ų | 64.5 | 33% | 0.327 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -66 | -41.1 | 176.1 | -173.2 | 170.4 | -158.3 | 0 | 0 | 111 | R7 D326 M331 E332 L333 | R7-E329 IonicContact CZ-OE1 3.3Å; R7-E329 VanDerWaalsContact CZ-OE1 3.3Å; R7-E329 IonicContact NH1-OE1 2.68Å; R7-E329 PolarHBondContact NH1-OE1 2.88Å; R7-E329 IonicContact NH2-OE1 2.95Å; R7-E329 PolarHBondContact NH2-OE1 3.46Å; D326-E329 HydrophobicContact CB-CB 4.02Å; D326-E329 WeakPolarHBondContact O-CA 3.35Å; D326-E329 WeakPolarHBondContact O-CB 2.97Å; D326-E329 PolarHBondContact O-N 3.18Å; E329-M331 VanDerWaalsContact C-N 3.34Å; E329-M331 PolarHBondContact O-N 2.84Å; E329-E332 PolarHBondContact O-N 3.35Å; E329-L333 HydrophobicContact CG-CD1 4.37Å; E329-L333 WeakPolarHBondContact O-CB 3.39Å; E329-L333 VanDerWaalsContact O-CG 3.27Å; E329-L333 WeakPolarHBondContact O-CG 3.44Å; E329-L333 PolarHBondContact O-N 3.01Å |
| 330 | E | 87.9 | Confident | 79.6 | Confident | 57 Ų | 57 | 60.7 Ų | 60.7 | 27% | 0.266 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62.3 | -40 | 173.9 | -69.1 | -170.2 | 144 | 0 | 0 | 112.6 | L221 F225 I325 D326 H327 L333 L334 | L221-E330 VanDerWaalsContact CD2-OE2 3.31Å; L221-E330 WeakPolarHBondContact CD2-OE2 2.87Å; F225-E330 HydrophobicContact CE1-CB 4.12Å; I325-E330 HydrophobicContact CG2-CG 3.6Å; I325-E330 WeakPolarHBondContact CG2-OE1 2.83Å; D326-E330 PolarHBondContact O-N 3.35Å; D326-E330 VanDerWaalsContact O-N 3.09Å; H327-E330 IonicContact ND1-OE2 3.88Å; E330-L333 PolarHBondContact O-N 2.66Å; E330-L334 WeakPolarHBondContact O-CB 3.48Å; E330-L334 PolarHBondContact O-N 3.1Å |
| 331 | M | 90.3 | Very high | 81.8 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -67.1 | -41.8 | 177.5 | -178.1 | 59.5 | 75.7 | 0 | 0 | 110.9 | F225 L228 I304 L307 H327 C328 E329 L334 L335 | F225-M331 HydrophobicContact CD1-CE 3.71Å; F225-M331 HydrophobicContact CD1-SD 4.39Å; F225-M331 HydrophobicContact CD2-CE 3.97Å; F225-M331 HydrophobicContact CE1-CB 3.65Å; F225-M331 HydrophobicContact CE1-CE 3.62Å; F225-M331 HydrophobicContact CE1-CG 4.48Å; F225-M331 HydrophobicContact CE1-SD 4.29Å; F225-M331 HydrophobicContact CE2-CE 3.86Å; F225-M331 HydrophobicContact CG-CE 3.89Å; F225-M331 HydrophobicContact CZ-CB 3.99Å; F225-M331 HydrophobicContact CZ-CE 3.69Å; L228-M331 HydrophobicContact CD2-CE 4.05Å; L228-M331 HydrophobicContact CD2-SD 3.54Å; L228-M331 VanDerWaalsContact CD2-SD 3.54Å; I304-M331 HydrophobicContact CG2-CB 4.03Å; I304-M331 HydrophobicContact CG2-CG 3.95Å; L307-M331 HydrophobicContact CB-CE 4.23Å; L307-M331 HydrophobicContact CB-CG 4.27Å; L307-M331 HydrophobicContact CB-SD 4.43Å; L307-M331 HydrophobicContact CD1-CG 4.46Å; H327-M331 WeakPolarHBondContact O-CB 3.07Å; H327-M331 PolarHBondContact O-N 3.19Å; C328-M331 PolarHBondContact O-N 3.41Å; E329-M331 VanDerWaalsContact C-N 3.34Å; E329-M331 PolarHBondContact O-N 2.84Å; M331-L334 PolarHBondContact O-N 3.2Å; M331-L335 HydrophobicContact CG-CD1 4.2Å; M331-L335 VanDerWaalsContact O-CG 3.3Å; M331-L335 WeakPolarHBondContact O-CG 3.28Å; M331-L335 PolarHBondContact O-N 3.04Å; M331-L335 HydrophobicContact SD-CD1 4.43Å; M331-L335 HydrophobicContact SD-CG 4.35Å |
| 332 | E | 92.7 | Very high | 84 | Confident | 32 Ų | 32 | 54.6 Ų | 54.6 | 15% | 0.15 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -58.9 | -49.8 | 174.3 | -170.5 | 172.9 | -157.6 | 0 | 0 | 110.5 | K4 L298 I304 C328 E329 L334 L335 E336 | K4-E332 WeakPolarHBondContact CE-OE1 3.35Å; K4-E332 IonicContact NZ-OE1 2.86Å; K4-E332 PolarHBondContact NZ-OE1 3.37Å; L298-E332 HydrophobicContact CD2-CG 3.88Å; I304-E332 HydrophobicContact CD1-CB 4.13Å; I304-E332 HydrophobicContact CD1-CG 4.02Å; C328-E332 WeakPolarHBondContact O-CB 3.49Å; C328-E332 PolarHBondContact O-N 3.03Å; E329-E332 PolarHBondContact O-N 3.35Å; E332-L334 VanDerWaalsContact C-N 3.34Å; E332-L334 PolarHBondContact O-N 3.43Å; E332-L335 PolarHBondContact O-N 3.21Å; E332-E336 HydrophobicContact CG-CG 4.37Å; E332-E336 WeakPolarHBondContact O-CB 3.49Å; E332-E336 WeakPolarHBondContact O-CG 3.4Å; E332-E336 PolarHBondContact O-N 2.94Å |
| 333 | L | 93.3 | Very high | 86.4 | Confident | 69 Ų | 69 | 50.4 Ų | 50.4 | 36% | 0.361 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -59.7 | -40.6 | 178.4 | -71.5 | 170.9 | 0 | 0 | 0 | 112.9 | E329 E330 N337 | E329-L333 HydrophobicContact CG-CD1 4.37Å; E329-L333 WeakPolarHBondContact O-CB 3.39Å; E329-L333 VanDerWaalsContact O-CG 3.27Å; E329-L333 WeakPolarHBondContact O-CG 3.44Å; E329-L333 PolarHBondContact O-N 3.01Å; E330-L333 PolarHBondContact O-N 2.66Å; L333-N337 WeakPolarHBondContact O-CB 3.43Å; L333-N337 PolarHBondContact O-N 3.02Å |
| 334 | L | 93.6 | Very high | 88.5 | Confident | 22 Ų | 22 | 46.5 Ų | 46.5 | 12% | 0.115 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.3 | -49.1 | 175.4 | -178.5 | 159.3 | 0 | 0 | 0 | 110.7 | F225 L228 E229 L232 E330 M331 E332 N337 Y338 | F225-L334 HydrophobicContact CD1-CD1 4.33Å; L228-L334 HydrophobicContact CD2-CD2 4.46Å; E229-L334 HydrophobicContact CB-CD1 4.1Å; L232-L334 HydrophobicContact CD1-CD2 3.82Å; E330-L334 WeakPolarHBondContact O-CB 3.48Å; E330-L334 PolarHBondContact O-N 3.1Å; M331-L334 PolarHBondContact O-N 3.2Å; E332-L334 VanDerWaalsContact C-N 3.34Å; E332-L334 PolarHBondContact O-N 3.43Å; L334-N337 PolarHBondContact O-N 3.34Å; L334-Y338 HydrophobicContact CD2-CD2 3.93Å; L334-Y338 HydrophobicContact CD2-CE2 4.01Å; L334-Y338 HydrophobicContact CG-CD2 4.45Å; L334-Y338 HydrophobicContact CG-CE2 4.25Å; L334-Y338 VanDerWaalsContact O-CD2 3.24Å; L334-Y338 WeakPolarHBondContact O-CD2 3.46Å; L334-Y338 PolarHBondContact O-N 3.47Å |
| 335 | L | 95.1 | Very high | 90.7 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.5 | -40.4 | 179.5 | -69.5 | 174.7 | 0 | 0 | 0 | 112 | L228 L232 L294 I297 L298 L307 M331 E332 N337 Y338 Y339 | L228-L335 HydrophobicContact CD2-CD2 4.15Å; L232-L335 HydrophobicContact CD1-CD2 3.85Å; L294-L335 HydrophobicContact CD2-CD2 4.01Å; I297-L335 HydrophobicContact CG2-CD1 3.71Å; L298-L335 HydrophobicContact CD2-CB 3.7Å; L298-L335 HydrophobicContact CD2-CD1 4.42Å; L298-L335 HydrophobicContact CG-CB 4.22Å; L307-L335 HydrophobicContact CD1-CD1 3.82Å; M331-L335 HydrophobicContact CG-CD1 4.2Å; M331-L335 VanDerWaalsContact O-CG 3.3Å; M331-L335 WeakPolarHBondContact O-CG 3.28Å; M331-L335 PolarHBondContact O-N 3.04Å; M331-L335 HydrophobicContact SD-CD1 4.43Å; M331-L335 HydrophobicContact SD-CG 4.35Å; E332-L335 PolarHBondContact O-N 3.21Å; L335-N337 PolarHBondContact O-N 2.75Å; L335-Y338 PolarHBondContact O-N 3.47Å; L335-Y339 WeakPolarHBondContact O-CB 3.32Å; L335-Y339 PolarHBondContact O-N 3.31Å |
| 336 | E | 95.8 | Very high | 92.5 | Very high | 36 Ų | 36 | 39.8 Ų | 39.8 | 17% | 0.168 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60.2 | -43.2 | 175.4 | -77.9 | -173.3 | 161.8 | 0 | 0 | 111.6 | L298 E332 Y338 Y339 M340 | L298-E336 HydrophobicContact CD1-CG 4.2Å; L298-E336 HydrophobicContact CD2-CG 3.83Å; E332-E336 HydrophobicContact CG-CG 4.37Å; E332-E336 WeakPolarHBondContact O-CB 3.49Å; E332-E336 WeakPolarHBondContact O-CG 3.4Å; E332-E336 PolarHBondContact O-N 2.94Å; E336-Y338 PolarHBondContact O-N 3.06Å; E336-Y339 WeakPolarHBondContact O-CB 3.42Å; E336-Y339 PolarHBondContact O-N 2.88Å; E336-M340 WeakPolarHBondContact O-CG 3.46Å; E336-M340 PolarHBondContact O-N 3.5Å |
| 337 | N | 96.4 | Very high | 93.5 | Very high | 83 Ų | 83 | 39.3 Ų | 39.3 | 44% | 0.444 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -58.4 | -48.6 | 177 | 179.8 | 19.4 | 0 | 0 | 0 | 111.7 | L333 L334 L335 Y339 M340 Q341 | L333-N337 WeakPolarHBondContact O-CB 3.43Å; L333-N337 PolarHBondContact O-N 3.02Å; L334-N337 PolarHBondContact O-N 3.34Å; L335-N337 PolarHBondContact O-N 2.75Å; N337-Y339 VanDerWaalsContact C-N 3.34Å; N337-Y339 PolarHBondContact O-N 3.5Å; N337-M340 PolarHBondContact O-N 2.96Å; N337-Q341 WeakPolarHBondContact O-CG 3.35Å; N337-Q341 PolarHBondContact O-N 3.44Å; N337-Q341 PolarHBondContact OD1-NE2 3.47Å |
| 338 | Y | 96.5 | Very high | 94.2 | Very high | 9 Ų | 9 | 41.8 Ų | 41.8 | 4% | 0.035 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -70.3 | -30.4 | 177.9 | -72.5 | -68.5 | 0 | 0 | 0 | 113.1 | E229 L232 Q233 V236 L334 L335 E336 A342 | E229-Y338 HydrophobicContact CG-CE2 3.97Å; E229-Y338 WeakPolarHBondContact CG-OH 3.44Å; E229-Y338 PolarHBondContact O-OH 3.45Å; L232-Y338 HydrophobicContact CB-CD1 3.95Å; L232-Y338 HydrophobicContact CB-CD2 3.74Å; L232-Y338 HydrophobicContact CB-CE1 4.2Å; L232-Y338 HydrophobicContact CB-CE2 4Å; L232-Y338 HydrophobicContact CB-CG 3.73Å; L232-Y338 HydrophobicContact CD1-CD2 3.69Å; L232-Y338 HydrophobicContact CD1-CE2 4.34Å; L232-Y338 HydrophobicContact CD1-CG 4.17Å; L232-Y338 HydrophobicContact CG-CD2 4.37Å; Q233-Y338 HydrophobicContact CB-CE1 4Å; V236-Y338 HydrophobicContact CG2-CD1 3.98Å; L334-Y338 HydrophobicContact CD2-CD2 3.93Å; L334-Y338 HydrophobicContact CD2-CE2 4.01Å; L334-Y338 HydrophobicContact CG-CD2 4.45Å; L334-Y338 HydrophobicContact CG-CE2 4.25Å; L334-Y338 VanDerWaalsContact O-CD2 3.24Å; L334-Y338 WeakPolarHBondContact O-CD2 3.46Å; L334-Y338 PolarHBondContact O-N 3.47Å; L335-Y338 PolarHBondContact O-N 3.47Å; E336-Y338 PolarHBondContact O-N 3.06Å; Y338-A342 WeakPolarHBondContact O-CB 3.39Å; Y338-A342 PolarHBondContact O-N 3.06Å |
| 339 | Y | 96.8 | Very high | 94.7 | Very high | 41 Ų | 41 | 41.1 Ų | 41.1 | 16% | 0.161 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.3 | -46.4 | 170.4 | 169.4 | -95.9 | 0 | 0 | 0 | 111.4 | K291 L295 L298 L335 E336 N337 A342 E343 | K291-Y339 HydrophobicContact CD-CD2 4.34Å; K291-Y339 HydrophobicContact CD-CE2 3.59Å; K291-Y339 HydrophobicContact CG-CD2 3.64Å; K291-Y339 HydrophobicContact CG-CE2 3.24Å; L295-Y339 HydrophobicContact CD1-CE2 3.58Å; L295-Y339 HydrophobicContact CD2-CD2 3.92Å; L295-Y339 HydrophobicContact CD2-CE1 4.34Å; L295-Y339 HydrophobicContact CD2-CE2 3.33Å; L295-Y339 HydrophobicContact CG-CD2 3.78Å; L295-Y339 HydrophobicContact CG-CE2 3.22Å; L298-Y339 HydrophobicContact CD1-CG 4.22Å; L335-Y339 WeakPolarHBondContact O-CB 3.32Å; L335-Y339 PolarHBondContact O-N 3.31Å; E336-Y339 WeakPolarHBondContact O-CB 3.42Å; E336-Y339 PolarHBondContact O-N 2.88Å; N337-Y339 VanDerWaalsContact C-N 3.34Å; N337-Y339 PolarHBondContact O-N 3.5Å; Y339-A342 WeakPolarHBondContact O-CB 3.38Å; Y339-A342 PolarHBondContact O-N 3.36Å; Y339-E343 PolarHBondContact O-N 3.15Å |
| 340 | M | 97.1 | Very high | 95.1 | Very high | 75 Ų | 75 | 43.3 Ų | 43.3 | 37% | 0.369 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -62.8 | -43.3 | 177.8 | -71.3 | -54.5 | -57.9 | 0 | 0 | 111.6 | L8 E336 N337 A342 E343 D344 | L8-M340 HydrophobicContact CD2-SD 4.25Å; E336-M340 WeakPolarHBondContact O-CG 3.46Å; E336-M340 PolarHBondContact O-N 3.5Å; N337-M340 PolarHBondContact O-N 2.96Å; M340-A342 VanDerWaalsContact C-N 3.34Å; M340-A342 PolarHBondContact O-N 2.93Å; M340-E343 PolarHBondContact O-N 3.19Å; M340-D344 PolarHBondContact O-N 2.62Å |
| 341 | Q | 97.1 | Very high | 95.4 | Very high | 61 Ų | 61 | 47.2 Ų | 47.2 | 29% | 0.285 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -60.5 | -42.7 | 173.7 | -70.6 | 177.7 | 55.9 | 0 | 0 | 112 | V236 N337 E343 D344 L345 | V236-Q341 HydrophobicContact CG1-CB 4.15Å; N337-Q341 WeakPolarHBondContact O-CG 3.35Å; N337-Q341 PolarHBondContact O-N 3.44Å; N337-Q341 PolarHBondContact OD1-NE2 3.47Å; Q341-E343 VanDerWaalsContact C-N 3.32Å; Q341-E343 PolarHBondContact O-N 2.95Å; Q341-D344 PolarHBondContact O-N 3.44Å; Q341-L345 WeakPolarHBondContact O-CD1 3.42Å; Q341-L345 PolarHBondContact O-N 3.41Å |
| 342 | A | 96 | Very high | 95.5 | Very high | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.7 | -37.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | I287 F290 Y338 Y339 M340 L345 A346 | I287-A342 WeakPolarHBondContact CG2-O 3.39Å; F290-A342 HydrophobicContact CD1-CB 3.84Å; F290-A342 HydrophobicContact CE1-CB 3.87Å; Y338-A342 WeakPolarHBondContact O-CB 3.39Å; Y338-A342 PolarHBondContact O-N 3.06Å; Y339-A342 WeakPolarHBondContact O-CB 3.38Å; Y339-A342 PolarHBondContact O-N 3.36Å; M340-A342 VanDerWaalsContact C-N 3.34Å; M340-A342 PolarHBondContact O-N 2.93Å; A342-L345 PolarHBondContact O-N 3.22Å; A342-A346 WeakPolarHBondContact O-CB 3.42Å; A342-A346 PolarHBondContact O-N 3.46Å |
| 343 | E | 96.5 | Very high | 95.4 | Very high | 41 Ų | 41 | 48.6 Ų | 48.6 | 19% | 0.192 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -67.2 | -40.5 | 176.1 | -173.7 | 64.9 | 177.1 | 0 | 0 | 112 | K291 Y339 M340 Q341 L345 A346 N347 | K291-E343 WeakPolarHBondContact CD-OE2 3.17Å; K291-E343 WeakPolarHBondContact CE-OE2 3.37Å; K291-E343 IonicContact NZ-OE1 3.66Å; K291-E343 IonicContact NZ-OE2 2.62Å; K291-E343 PolarHBondContact NZ-OE2 2.81Å; Y339-E343 PolarHBondContact O-N 3.15Å; M340-E343 PolarHBondContact O-N 3.19Å; Q341-E343 VanDerWaalsContact C-N 3.32Å; Q341-E343 PolarHBondContact O-N 2.95Å; E343-L345 VanDerWaalsContact C-N 3.34Å; E343-L345 PolarHBondContact O-N 3.11Å; E343-A346 WeakPolarHBondContact O-CB 3.27Å; E343-A346 PolarHBondContact O-N 3.39Å; E343-A346 VanDerWaalsContact O-N 3.15Å; E343-N347 VanDerWaalsContact O-CG 3.23Å; E343-N347 PolarHBondContact O-N 3.1Å; E343-N347 PolarHBondContact O-ND2 2.68Å |
| 344 | D | 96.8 | Very high | 95.3 | Very high | 85 Ų | 85 | 46.7 Ų | 46.7 | 46% | 0.455 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.2 | -43.3 | 173.9 | -75 | -18.5 | 0 | 0 | 0 | 111.6 | M340 Q341 A346 N347 K348 | M340-D344 PolarHBondContact O-N 2.62Å; Q341-D344 PolarHBondContact O-N 3.44Å; D344-A346 VanDerWaalsContact C-N 3.34Å; D344-A346 PolarHBondContact O-N 3.49Å; D344-N347 PolarHBondContact O-N 3.1Å; D344-K348 WeakPolarHBondContact O-CG 3.47Å; D344-K348 PolarHBondContact O-N 3.06Å |
| 345 | L | 96.1 | Very high | 95.1 | Very high | 6 Ų | 6 | 49.1 Ų | 49.1 | 3% | 0.031 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62 | -41.1 | 172.8 | -92.8 | 75.2 | 0 | 0 | 0 | 111.9 | V236 L239 Q240 I287 Q341 A342 E343 N347 K348 T349 | V236-L345 HydrophobicContact CG1-CD1 4.48Å; L239-L345 HydrophobicContact CB-CD2 3.49Å; L239-L345 VanDerWaalsContact CB-CD2 3.49Å; Q240-L345 HydrophobicContact CB-CD2 4.08Å; Q240-L345 VanDerWaalsContact OE1-CD1 3.28Å; I287-L345 HydrophobicContact CD1-CB 4.12Å; Q341-L345 WeakPolarHBondContact O-CD1 3.42Å; Q341-L345 PolarHBondContact O-N 3.41Å; A342-L345 PolarHBondContact O-N 3.22Å; E343-L345 VanDerWaalsContact C-N 3.34Å; E343-L345 PolarHBondContact O-N 3.11Å; L345-N347 VanDerWaalsContact C-N 3.3Å; L345-N347 PolarHBondContact O-N 3.13Å; L345-K348 PolarHBondContact O-N 3.45Å; L345-T349 WeakPolarHBondContact O-CB 3.23Å; L345-T349 PolarHBondContact O-N 3.39Å; L345-T349 PolarHBondContact O-OG1 3.31Å |
| 346 | A | 96.6 | Very high | 94.8 | Very high | 11 Ų | 11 | 49.1 Ų | 49.1 | 9% | 0.091 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62.2 | -39.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | I287 A342 E343 D344 T349 R350 | I287-A346 HydrophobicContact CG2-CB 3.72Å; A342-A346 WeakPolarHBondContact O-CB 3.42Å; A342-A346 PolarHBondContact O-N 3.46Å; E343-A346 WeakPolarHBondContact O-CB 3.27Å; E343-A346 PolarHBondContact O-N 3.39Å; E343-A346 VanDerWaalsContact O-N 3.15Å; D344-A346 VanDerWaalsContact C-N 3.34Å; D344-A346 PolarHBondContact O-N 3.49Å; A346-T349 PolarHBondContact O-N 2.96Å; A346-R350 WeakPolarHBondContact O-CB 3.43Å; A346-R350 PolarHBondContact O-N 2.75Å |
| 347 | N | 96.3 | Very high | 94.4 | Very high | 66 Ų | 66 | 51.4 Ų | 51.4 | 35% | 0.353 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -66.7 | -46.9 | 178.9 | -70.6 | -28.1 | 0 | 0 | 0 | 111.8 | E343 D344 L345 T349 R350 E351 | E343-N347 VanDerWaalsContact O-CG 3.23Å; E343-N347 PolarHBondContact O-N 3.1Å; E343-N347 PolarHBondContact O-ND2 2.68Å; D344-N347 PolarHBondContact O-N 3.1Å; L345-N347 VanDerWaalsContact C-N 3.3Å; L345-N347 PolarHBondContact O-N 3.13Å; N347-T349 VanDerWaalsContact C-N 3.33Å; N347-T349 PolarHBondContact O-N 2.91Å; N347-R350 PolarHBondContact O-N 3.08Å; N347-R350 PolarHBondContact OD1-NH1 3.43Å; N347-E351 PolarHBondContact O-N 3.13Å |
| 348 | K | 95.6 | Very high | 93.9 | Very high | 99 Ų | 99 | 52.6 Ų | 52.6 | 43% | 0.43 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -59.4 | -43.7 | 174.1 | -67.9 | 174.7 | -175.4 | 175.2 | 0 | 112.1 | L243 D344 L345 R350 E351 L352 | L243-K348 HydrophobicContact CD2-CB 3.83Å; L243-K348 HydrophobicContact CD2-CD 4.18Å; D344-K348 WeakPolarHBondContact O-CG 3.47Å; D344-K348 PolarHBondContact O-N 3.06Å; L345-K348 PolarHBondContact O-N 3.45Å; K348-R350 VanDerWaalsContact C-N 3.32Å; K348-R350 PolarHBondContact O-N 3.12Å; K348-E351 PolarHBondContact O-N 2.82Å; K348-L352 PolarHBondContact O-N 3.29Å |
| 349 | T | 95.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61 | -42.1 | 177.2 | -57.9 | 0 | 0 | 0 | 0 | 111.3 | L280 E284 I287 L345 A346 N347 L352 K353 | L280-T349 HydrophobicContact CD1-CG2 3.74Å; L280-T349 HydrophobicContact CG-CG2 4.04Å; E284-T349 HydrophobicContact CB-CG2 3.87Å; E284-T349 HydrophobicContact CG-CG2 4.41Å; I287-T349 WeakPolarHBondContact CD1-OG1 3.47Å; L345-T349 WeakPolarHBondContact O-CB 3.23Å; L345-T349 PolarHBondContact O-N 3.39Å; L345-T349 PolarHBondContact O-OG1 3.31Å; A346-T349 PolarHBondContact O-N 2.96Å; N347-T349 VanDerWaalsContact C-N 3.33Å; N347-T349 PolarHBondContact O-N 2.91Å; T349-L352 PolarHBondContact O-N 3.3Å; T349-K353 WeakPolarHBondContact O-CB 3.42Å; T349-K353 PolarHBondContact O-N 3.4Å |
| 350 | R | 94.8 | Very high | 92.5 | Very high | 117 Ų | 117 | 55.6 Ų | 55.6 | 44% | 0.442 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -67.7 | -40.5 | 178 | -172.6 | -178.7 | -58.8 | 103.7 | 3.3 | 112.6 | A346 N347 K348 K353 G354 | A346-R350 WeakPolarHBondContact O-CB 3.43Å; A346-R350 PolarHBondContact O-N 2.75Å; N347-R350 PolarHBondContact O-N 3.08Å; N347-R350 PolarHBondContact OD1-NH1 3.43Å; K348-R350 VanDerWaalsContact C-N 3.32Å; K348-R350 PolarHBondContact O-N 3.12Å; R350-K353 PolarHBondContact O-N 3.01Å; R350-G354 PolarHBondContact O-N 3.45Å |
| 351 | E | 93.6 | Very high | 91.8 | Very high | 138 Ų | 138 | 54.9 Ų | 54.9 | 65% | 0.645 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -59.8 | -49.4 | 174.9 | -178.2 | 174.9 | -169.8 | 0 | 0 | 110.7 | N347 K348 K353 G354 L355 | N347-E351 PolarHBondContact O-N 3.13Å; K348-E351 PolarHBondContact O-N 2.82Å; E351-K353 VanDerWaalsContact C-N 3.29Å; E351-K353 PolarHBondContact O-N 3.13Å; E351-G354 PolarHBondContact O-N 3.37Å; E351-G354 VanDerWaalsContact O-N 3.13Å; E351-L355 WeakPolarHBondContact O-CG 3.25Å; E351-L355 PolarHBondContact O-N 3.3Å |
| 352 | L | 92.8 | Very high | 90.8 | Very high | 9 Ų | 9 | 55.5 Ų | 55.5 | 5% | 0.047 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.7 | -37.3 | 178.2 | -173.8 | 59.2 | 0 | 0 | 0 | 112.7 | L243 E247 I250 L251 L280 K348 T349 L355 I356 | L243-L352 HydrophobicContact CD1-CD2 4.24Å; E247-L352 HydrophobicContact CB-CD2 4.05Å; E247-L352 HydrophobicContact CG-CD2 4.23Å; I250-L352 HydrophobicContact CB-CD1 4.16Å; I250-L352 HydrophobicContact CD1-CD1 4.43Å; I250-L352 HydrophobicContact CD1-CD2 3.73Å; I250-L352 HydrophobicContact CD1-CG 4.01Å; I250-L352 HydrophobicContact CG2-CD1 3.69Å; I250-L352 HydrophobicContact CG2-CG 4.3Å; L251-L352 HydrophobicContact CD2-CD1 4.23Å; L280-L352 HydrophobicContact CD1-CD2 3.9Å; L280-L352 HydrophobicContact CD2-CB 4.18Å; L280-L352 HydrophobicContact CD2-CD2 4.16Å; L280-L352 HydrophobicContact CD2-CG 3.95Å; K348-L352 PolarHBondContact O-N 3.29Å; T349-L352 PolarHBondContact O-N 3.3Å; L352-L355 PolarHBondContact O-N 2.96Å; L352-I356 PolarHBondContact O-N 3.31Å; L352-I356 VanDerWaalsContact O-N 3.12Å |
| 353 | K | 91.8 | Very high | 89.9 | Confident | 52 Ų | 52 | 56.3 Ų | 56.3 | 23% | 0.226 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.8 | -42.3 | 174.4 | -167.4 | 177.1 | -170.2 | 174.6 | 0 | 111.9 | L280 E284 T349 R350 E351 L355 I356 D357 | L280-K353 HydrophobicContact CD2-CB 3.96Å; E284-K353 WeakPolarHBondContact OE2-CD 3.35Å; E284-K353 IonicContact OE2-NZ 3.68Å; E284-K353 PolarHBondContact OE2-NZ 2.93Å; T349-K353 WeakPolarHBondContact O-CB 3.42Å; T349-K353 PolarHBondContact O-N 3.4Å; R350-K353 PolarHBondContact O-N 3.01Å; E351-K353 VanDerWaalsContact C-N 3.29Å; E351-K353 PolarHBondContact O-N 3.13Å; K353-L355 VanDerWaalsContact C-N 3.3Å; K353-L355 PolarHBondContact O-N 3.48Å; K353-I356 WeakPolarHBondContact O-CB 3.47Å; K353-I356 PolarHBondContact O-N 3.29Å; K353-I356 VanDerWaalsContact O-N 3.13Å; K353-D357 PolarHBondContact O-N 3.33Å |
| 354 | G | 90.3 | Very high | 89 | Confident | 29 Ų | 29 | 60.3 Ų | 60.3 | 30% | 0.299 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -58.1 | -41.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | R350 E351 I356 D357 D358 | R350-G354 PolarHBondContact O-N 3.45Å; E351-G354 PolarHBondContact O-N 3.37Å; E351-G354 VanDerWaalsContact O-N 3.13Å; G354-I356 VanDerWaalsContact C-N 3.33Å; G354-I356 PolarHBondContact O-N 2.91Å; G354-D357 PolarHBondContact O-N 3.49Å; G354-D358 WeakPolarHBondContact O-CB 3.45Å; G354-D358 PolarHBondContact O-N 3.46Å |
| 355 | L | 89.1 | Confident | 88.2 | Confident | 73 Ų | 73 | 60 Ų | 60 | 38% | 0.382 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.9 | -37.2 | 175.1 | -66.2 | 175.6 | 0 | 0 | 0 | 112.9 | L251 L254 E351 L352 K353 S359 | L251-L355 HydrophobicContact CD2-CD1 4.31Å; L254-L355 HydrophobicContact CD1-CB 4.15Å; E351-L355 WeakPolarHBondContact O-CG 3.25Å; E351-L355 PolarHBondContact O-N 3.3Å; L352-L355 PolarHBondContact O-N 2.96Å; K353-L355 VanDerWaalsContact C-N 3.3Å; K353-L355 PolarHBondContact O-N 3.48Å; L355-S359 VanDerWaalsContact O-CB 3.3Å; L355-S359 WeakPolarHBondContact O-CB 3.3Å; L355-S359 PolarHBondContact O-N 3.01Å; L355-S359 VanDerWaalsContact O-N 3.08Å; L355-S359 PolarHBondContact O-OG 2.89Å |
| 356 | I | 88.8 | Confident | 87.3 | Confident | 0 Ų | 0 | 61.4 Ų | 61.4 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -65.3 | -50.1 | 174 | -71.3 | 163.9 | 0 | 0 | 0 | 110.5 | I250 L254 L273 L280 L352 K353 G354 D358 S359 E360 | I250-I356 HydrophobicContact CD1-CD1 3.69Å; I250-I356 HydrophobicContact CG1-CD1 4.14Å; I250-I356 HydrophobicContact CG2-CD1 3.77Å; I250-I356 HydrophobicContact CG2-CG1 3.61Å; L254-I356 HydrophobicContact CD1-CG1 4.45Å; L273-I356 HydrophobicContact CD2-CG2 4.03Å; L280-I356 HydrophobicContact CD2-CD1 3.74Å; L352-I356 PolarHBondContact O-N 3.31Å; L352-I356 VanDerWaalsContact O-N 3.12Å; K353-I356 WeakPolarHBondContact O-CB 3.47Å; K353-I356 PolarHBondContact O-N 3.29Å; K353-I356 VanDerWaalsContact O-N 3.13Å; G354-I356 VanDerWaalsContact C-N 3.33Å; G354-I356 PolarHBondContact O-N 2.91Å; I356-D358 VanDerWaalsContact C-N 3.32Å; I356-D358 PolarHBondContact O-N 2.88Å; I356-S359 CarbonylContact O-C 3.58Å; I356-S359 PolarHBondContact O-N 3.18Å; I356-S359 VanDerWaalsContact O-N 3.12Å; I356-E360 WeakPolarHBondContact O-CB 3.47Å; I356-E360 PolarHBondContact O-N 3.43Å |
| 357 | D | 87.6 | Confident | 86.5 | Confident | 84 Ų | 84 | 64.6 Ų | 64.6 | 45% | 0.449 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -60.4 | -43.5 | -177.9 | -68.1 | -15.1 | 0 | 0 | 0 | 111 | K353 G354 S359 E360 S361 | K353-D357 PolarHBondContact O-N 3.33Å; G354-D357 PolarHBondContact O-N 3.49Å; D357-S359 VanDerWaalsContact C-N 3.34Å; D357-S359 PolarHBondContact O-N 3.49Å; D357-E360 PolarHBondContact O-N 3.46Å; D357-S361 PolarHBondContact O-N 3.42Å |
| 358 | D | 85.7 | Confident | 85.7 | Confident | 109 Ų | 109 | 64.4 Ų | 64.4 | 58% | 0.583 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -59.5 | -45.3 | 174.7 | -77.7 | -16.2 | 0 | 0 | 0 | 111 | G354 I356 S361 V362 | G354-D358 WeakPolarHBondContact O-CB 3.45Å; G354-D358 PolarHBondContact O-N 3.46Å; I356-D358 VanDerWaalsContact C-N 3.32Å; I356-D358 PolarHBondContact O-N 2.88Å; D358-S361 PolarHBondContact O-N 3.19Å; D358-S361 PolarHBondContact O-OG 2.77Å; D358-V362 PolarHBondContact O-N 3.45Å |
| 359 | S | 82.3 | Confident | 85 | Confident | 17 Ų | 17 | 61.6 Ų | 61.6 | 12% | 0.119 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -73 | -34.7 | -178.7 | -58.4 | 0 | 0 | 0 | 0 | 113.3 | L254 L355 I356 D357 S361 V362 I363 | L254-S359 WeakPolarHBondContact CD2-OG 3.5Å; L355-S359 VanDerWaalsContact O-CB 3.3Å; L355-S359 WeakPolarHBondContact O-CB 3.3Å; L355-S359 PolarHBondContact O-N 3.01Å; L355-S359 VanDerWaalsContact O-N 3.08Å; L355-S359 PolarHBondContact O-OG 2.89Å; I356-S359 CarbonylContact O-C 3.58Å; I356-S359 PolarHBondContact O-N 3.18Å; I356-S359 VanDerWaalsContact O-N 3.12Å; D357-S359 VanDerWaalsContact C-N 3.34Å; D357-S359 PolarHBondContact O-N 3.49Å; S359-S361 VanDerWaalsContact C-N 3.28Å; S359-S361 PolarHBondContact O-N 3.44Å; S359-V362 PolarHBondContact O-N 3.32Å; S359-I363 WeakPolarHBondContact O-CD1 3.48Å; S359-I363 VanDerWaalsContact O-CG1 3.25Å; S359-I363 WeakPolarHBondContact O-CG1 3.28Å; S359-I363 PolarHBondContact O-N 3.12Å |
| 360 | E | 82.6 | Confident | 84.1 | Confident | 95 Ų | 95 | 64.9 Ų | 64.9 | 44% | 0.444 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -58.9 | -43.4 | 174.6 | -178 | 177.2 | 176 | 0 | 0 | 110.3 | I356 D357 V362 I363 F364 | I356-E360 WeakPolarHBondContact O-CB 3.47Å; I356-E360 PolarHBondContact O-N 3.43Å; D357-E360 PolarHBondContact O-N 3.46Å; E360-V362 VanDerWaalsContact C-N 3.33Å; E360-V362 PolarHBondContact O-N 3.21Å; E360-I363 PolarHBondContact O-N 3.42Å; E360-F364 WeakPolarHBondContact O-CB 3.41Å; E360-F364 PolarHBondContact O-N 2.93Å |
| 361 | S | 80.8 | Confident | 83.6 | Confident | 60 Ų | 60 | 67 Ų | 67 | 42% | 0.42 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -60.7 | -41.7 | 176.5 | 81.7 | 0 | 0 | 0 | 0 | 112.1 | D357 D358 S359 F364 I365 | D357-S361 PolarHBondContact O-N 3.42Å; D358-S361 PolarHBondContact O-N 3.19Å; D358-S361 PolarHBondContact O-OG 2.77Å; S359-S361 VanDerWaalsContact C-N 3.28Å; S359-S361 PolarHBondContact O-N 3.44Å; S361-F364 PolarHBondContact O-N 2.94Å; S361-I365 WeakPolarHBondContact O-CB 3.37Å; S361-I365 WeakPolarHBondContact O-CD1 3.42Å; S361-I365 WeakPolarHBondContact O-CG1 3.43Å; S361-I365 PolarHBondContact O-N 3.28Å |
| 362 | V | 76.6 | Confident | 83.1 | Confident | 74 Ų | 74 | 65.1 Ų | 65.1 | 45% | 0.448 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -66.7 | -44.5 | 177.7 | 174.6 | 0 | 0 | 0 | 0 | 111.2 | D358 S359 E360 F364 I365 N366 | D358-V362 PolarHBondContact O-N 3.45Å; S359-V362 PolarHBondContact O-N 3.32Å; E360-V362 VanDerWaalsContact C-N 3.33Å; E360-V362 PolarHBondContact O-N 3.21Å; V362-F364 VanDerWaalsContact C-N 3.34Å; V362-F364 PolarHBondContact O-N 3.33Å; V362-I365 PolarHBondContact O-N 3.41Å; V362-N366 WeakPolarHBondContact O-CB 3.21Å; V362-N366 PolarHBondContact O-N 3.1Å |
| 363 | I | 77.2 | Confident | 82.7 | Confident | 17 Ų | 17 | 68.1 Ų | 68.1 | 9% | 0.087 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -61.1 | -45.7 | 177.5 | -68.1 | 159.8 | 0 | 0 | 0 | 110.1 | L257 L270 L273 S359 E360 I365 N366 L367 | L257-I363 HydrophobicContact CB-CD1 3.9Å; L257-I363 HydrophobicContact CB-CG1 4.19Å; L257-I363 HydrophobicContact CD1-CD1 3.73Å; L257-I363 HydrophobicContact CG-CD1 4.37Å; L270-I363 HydrophobicContact CD1-CG2 4.25Å; L273-I363 HydrophobicContact CD1-CD1 4.14Å; S359-I363 WeakPolarHBondContact O-CD1 3.48Å; S359-I363 VanDerWaalsContact O-CG1 3.25Å; S359-I363 WeakPolarHBondContact O-CG1 3.28Å; S359-I363 PolarHBondContact O-N 3.12Å; E360-I363 PolarHBondContact O-N 3.42Å; I363-I365 PolarHBondContact O-N 2.93Å; I363-N366 PolarHBondContact O-N 3.32Å; I363-L367 HydrophobicContact CG2-CD1 4.03Å; I363-L367 HydrophobicContact CG2-CG 4.36Å; I363-L367 WeakPolarHBondContact O-CG 3.04Å; I363-L367 PolarHBondContact O-N 2.98Å |
| 364 | F | 78.8 | Confident | 82.2 | Confident | 126 Ų | 126 | 71.5 Ų | 71.5 | 55% | 0.553 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -60.2 | -47.6 | 179.3 | -174.9 | -96.3 | 0 | 0 | 0 | 111.5 | E360 S361 V362 N366 L367 D368 | E360-F364 WeakPolarHBondContact O-CB 3.41Å; E360-F364 PolarHBondContact O-N 2.93Å; S361-F364 PolarHBondContact O-N 2.94Å; V362-F364 VanDerWaalsContact C-N 3.34Å; V362-F364 PolarHBondContact O-N 3.33Å; F364-N366 VanDerWaalsContact C-N 3.28Å; F364-N366 PolarHBondContact O-N 3.32Å; F364-L367 PolarHBondContact O-N 3.47Å; F364-D368 WeakPolarHBondContact CE1-OD2 3.47Å; F364-D368 PolarHBondContact O-N 2.81Å |
| 365 | I | 80.1 | Confident | 82.1 | Confident | 79 Ų | 79 | 74.9 Ų | 74.9 | 41% | 0.405 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -58 | -41 | 175.9 | -73.6 | 167.4 | 0 | 0 | 0 | 111.4 | S361 V362 I363 S369 F445 | S361-I365 WeakPolarHBondContact O-CB 3.37Å; S361-I365 WeakPolarHBondContact O-CD1 3.42Å; S361-I365 WeakPolarHBondContact O-CG1 3.43Å; S361-I365 PolarHBondContact O-N 3.28Å; V362-I365 PolarHBondContact O-N 3.41Å; I363-I365 PolarHBondContact O-N 2.93Å; I365-S369 PolarHBondContact O-N 3.38Å; I365-F445 HydrophobicContact CG2-CE1 3.61Å; I365-F445 HydrophobicContact CG2-CZ 3.3Å |
| 366 | N | 76.8 | Confident | 81.9 | Confident | 35 Ų | 35 | 74.6 Ų | 74.6 | 19% | 0.187 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -72.1 | -38.5 | -179.3 | -163.3 | 16 | 0 | 0 | 0 | 112.7 | V263 V362 I363 F364 D368 S369 H370 | V263-N366 WeakPolarHBondContact CG1-ND2 3.31Å; V263-N366 WeakPolarHBondContact CG2-ND2 3.25Å; V362-N366 WeakPolarHBondContact O-CB 3.21Å; V362-N366 PolarHBondContact O-N 3.1Å; I363-N366 PolarHBondContact O-N 3.32Å; F364-N366 VanDerWaalsContact C-N 3.28Å; F364-N366 PolarHBondContact O-N 3.32Å; N366-D368 VanDerWaalsContact C-N 3.32Å; N366-D368 PolarHBondContact O-N 2.8Å; N366-S369 WeakPolarHBondContact O-CB 3.42Å; N366-S369 PolarHBondContact O-N 3.21Å; N366-H370 PolarHBondContact O-N 2.89Å |
| 367 | L | 79.1 | Confident | 81.8 | Confident | 78 Ų | 78 | 79 Ų | 79 | 41% | 0.408 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.1 | -41 | 173.9 | -73.6 | 175.4 | 0 | 0 | 0 | 111.7 | V263 I363 F364 H370 R371 | V263-L367 HydrophobicContact CG1-CD2 4.41Å; I363-L367 HydrophobicContact CG2-CD1 4.03Å; I363-L367 HydrophobicContact CG2-CG 4.36Å; I363-L367 WeakPolarHBondContact O-CG 3.04Å; I363-L367 PolarHBondContact O-N 2.98Å; F364-L367 PolarHBondContact O-N 3.47Å; L367-H370 PolarHBondContact O-N 3.23Å; L367-R371 PolarHBondContact O-N 2.86Å |
| 368 | D | 80.4 | Confident | 81.9 | Confident | 61 Ų | 61 | 79.4 Ų | 79.4 | 33% | 0.326 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.8 | -39.8 | 174 | -86.5 | -14.4 | 0 | 0 | 0 | 111.8 | F364 N366 H370 R371 N372 | F364-D368 WeakPolarHBondContact CE1-OD2 3.47Å; F364-D368 PolarHBondContact O-N 2.81Å; N366-D368 VanDerWaalsContact C-N 3.32Å; N366-D368 PolarHBondContact O-N 2.8Å; D368-H370 PolarHBondContact O-N 3.4Å; D368-R371 PolarHBondContact O-N 3.38Å; D368-N372 WeakPolarHBondContact O-CB 3.45Å; D368-N372 PolarHBondContact O-N 3.35Å; D368-N372 PolarHBondContact O-ND2 2.92Å; D368-N372 VanDerWaalsContact O-ND2 3.08Å |
| 369 | S | 80.1 | Confident | 82.2 | Confident | 41 Ų | 41 | 77.6 Ų | 77.6 | 29% | 0.287 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -58.2 | -47.1 | 172.3 | -175.5 | 0 | 0 | 0 | 0 | 111.8 | I365 N366 R371 N372 V373 | I365-S369 PolarHBondContact O-N 3.38Å; N366-S369 WeakPolarHBondContact O-CB 3.42Å; N366-S369 PolarHBondContact O-N 3.21Å; S369-R371 PolarHBondContact O-N 2.91Å; S369-N372 WeakPolarHBondContact O-CB 3.45Å; S369-N372 PolarHBondContact O-N 3.18Å; S369-N372 VanDerWaalsContact O-N 3.16Å; S369-V373 WeakPolarHBondContact O-CG2 3.47Å; S369-V373 PolarHBondContact O-N 3.25Å |
| 370 | H | 77.6 | Confident | 82.5 | Confident | 68 Ų | 68 | 79.7 Ų | 79.7 | 32% | 0.315 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -60.3 | -43.8 | 176.1 | -91.8 | -73.6 | 0 | 0 | 0 | 112.5 | N366 L367 D368 N372 V373 M374 | N366-H370 PolarHBondContact O-N 2.89Å; L367-H370 PolarHBondContact O-N 3.23Å; D368-H370 PolarHBondContact O-N 3.4Å; H370-N372 VanDerWaalsContact C-N 3.31Å; H370-N372 PolarHBondContact O-N 2.89Å; H370-V373 PolarHBondContact O-N 3.48Å; H370-M374 WeakPolarHBondContact O-CG 3.48Å; H370-M374 PolarHBondContact O-N 3.45Å |
| 371 | R | 83 | Confident | 82.9 | Confident | 161 Ų | 161 | 80.4 Ų | 80.4 | 61% | 0.608 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -60.3 | -42.1 | 174.2 | -176.5 | -178.4 | 177.4 | 178.7 | -0.6 | 111.7 | L367 D368 S369 M374 M375 | L367-R371 PolarHBondContact O-N 2.86Å; D368-R371 PolarHBondContact O-N 3.38Å; S369-R371 PolarHBondContact O-N 2.91Å; R371-M374 PolarHBondContact O-N 3.34Å; R371-M375 WeakPolarHBondContact O-CB 3.4Å; R371-M375 PolarHBondContact O-N 3.18Å |
| 372 | N | 82.9 | Confident | 83.5 | Confident | 99 Ų | 99 | 81.3 Ų | 81.3 | 53% | 0.529 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65.6 | -37.9 | 178.1 | -70.9 | -28.1 | 0 | 0 | 0 | 112.1 | D368 S369 H370 R376 | D368-N372 WeakPolarHBondContact O-CB 3.45Å; D368-N372 PolarHBondContact O-N 3.35Å; D368-N372 PolarHBondContact O-ND2 2.92Å; D368-N372 VanDerWaalsContact O-ND2 3.08Å; S369-N372 WeakPolarHBondContact O-CB 3.45Å; S369-N372 PolarHBondContact O-N 3.18Å; S369-N372 VanDerWaalsContact O-N 3.16Å; H370-N372 VanDerWaalsContact C-N 3.31Å; H370-N372 PolarHBondContact O-N 2.89Å; N372-R376 WeakPolarHBondContact O-CB 3.39Å; N372-R376 PolarHBondContact O-N 3.43Å |
| 373 | V | 84.7 | Confident | 84.2 | Confident | 72 Ų | 72 | 79.9 Ų | 79.9 | 44% | 0.436 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -65.2 | -46.9 | 173.2 | 172.1 | 0 | 0 | 0 | 0 | 111 | S369 H370 M375 R376 L377 | S369-V373 WeakPolarHBondContact O-CG2 3.47Å; S369-V373 PolarHBondContact O-N 3.25Å; H370-V373 PolarHBondContact O-N 3.48Å; V373-M375 VanDerWaalsContact C-N 3.34Å; V373-M375 PolarHBondContact O-N 3.28Å; V373-R376 WeakPolarHBondContact O-CB 3.45Å; V373-R376 PolarHBondContact O-N 2.91Å; V373-L377 HydrophobicContact CG1-CD1 4.19Å; V373-L377 HydrophobicContact CG1-CG 4.47Å; V373-L377 WeakPolarHBondContact O-CG 3.41Å; V373-L377 PolarHBondContact O-N 3.29Å |
| 374 | M | 82.4 | Confident | 85 | Confident | 123 Ų | 123 | 79 Ų | 79 | 61% | 0.606 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -60 | -43.7 | 177.3 | -73.6 | -172.3 | -74.7 | 0 | 0 | 112 | H370 R371 R376 L377 N378 | H370-M374 WeakPolarHBondContact O-CG 3.48Å; H370-M374 PolarHBondContact O-N 3.45Å; R371-M374 PolarHBondContact O-N 3.34Å; M374-R376 VanDerWaalsContact C-N 3.33Å; M374-R376 PolarHBondContact O-N 2.95Å; M374-L377 PolarHBondContact O-N 2.88Å; M374-N378 WeakPolarHBondContact O-CB 3.35Å; M374-N378 PolarHBondContact O-N 2.93Å |
| 375 | M | 87.1 | Confident | 85.7 | Confident | 101 Ų | 101 | 76.3 Ų | 76.3 | 50% | 0.498 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -60.7 | -42.9 | 175.7 | -172.8 | 66.1 | 75.8 | 0 | 0 | 111.5 | R371 V373 N378 L379 | R371-M375 WeakPolarHBondContact O-CB 3.4Å; R371-M375 PolarHBondContact O-N 3.18Å; V373-M375 VanDerWaalsContact C-N 3.34Å; V373-M375 PolarHBondContact O-N 3.28Å; M375-N378 PolarHBondContact O-N 3.48Å; M375-L379 WeakPolarHBondContact O-CG 3.19Å; M375-L379 PolarHBondContact O-N 3Å |
| 376 | R | 84.6 | Confident | 86.4 | Confident | 67 Ų | 67 | 78.5 Ų | 78.5 | 25% | 0.253 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -61.5 | -45.1 | 176.1 | -176.2 | -177.2 | -64.7 | -97.3 | 2.9 | 111.6 | N372 V373 M374 L379 Q380 | N372-R376 WeakPolarHBondContact O-CB 3.39Å; N372-R376 PolarHBondContact O-N 3.43Å; V373-R376 WeakPolarHBondContact O-CB 3.45Å; V373-R376 PolarHBondContact O-N 2.91Å; M374-R376 VanDerWaalsContact C-N 3.33Å; M374-R376 PolarHBondContact O-N 2.95Å; R376-L379 PolarHBondContact O-N 2.97Å; R376-Q380 VanDerWaalsContact O-CG 3.3Å; R376-Q380 WeakPolarHBondContact O-CG 3.46Å; R376-Q380 PolarHBondContact O-N 3.39Å |
| 377 | L | 88.4 | Confident | 87.2 | Confident | 92 Ų | 92 | 76.8 Ų | 76.8 | 48% | 0.482 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62.9 | -42.3 | 177.3 | -71 | 174.8 | 0 | 0 | 0 | 111.7 | V373 M374 L379 Q380 L381 | V373-L377 HydrophobicContact CG1-CD1 4.19Å; V373-L377 HydrophobicContact CG1-CG 4.47Å; V373-L377 WeakPolarHBondContact O-CG 3.41Å; V373-L377 PolarHBondContact O-N 3.29Å; M374-L377 PolarHBondContact O-N 2.88Å; L377-L379 PolarHBondContact O-N 3.45Å; L377-Q380 PolarHBondContact O-N 3.16Å; L377-L381 WeakPolarHBondContact O-CG 3.35Å; L377-L381 PolarHBondContact O-N 3.03Å |
| 378 | N | 89.4 | Confident | 87.9 | Confident | 93 Ų | 93 | 78.5 Ų | 78.5 | 50% | 0.497 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -61.3 | -44.3 | 176.6 | -173.5 | 33.2 | 0 | 0 | 0 | 112.1 | M374 M375 Q380 L381 T382 | M374-N378 WeakPolarHBondContact O-CB 3.35Å; M374-N378 PolarHBondContact O-N 2.93Å; M375-N378 PolarHBondContact O-N 3.48Å; N378-Q380 PolarHBondContact O-N 3.21Å; N378-L381 PolarHBondContact O-N 3.37Å; N378-T382 WeakPolarHBondContact O-CB 3.4Å; N378-T382 PolarHBondContact O-N 3.03Å; N378-T382 PolarHBondContact O-OG1 2.89Å |
| 379 | L | 90.4 | Very high | 88.6 | Confident | 71 Ų | 71 | 79.8 Ų | 79.8 | 37% | 0.372 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.2 | -43.7 | 174.9 | -74 | 173.5 | 0 | 0 | 0 | 111.8 | M375 R376 L377 T382 M383 | M375-L379 WeakPolarHBondContact O-CG 3.19Å; M375-L379 PolarHBondContact O-N 3Å; R376-L379 PolarHBondContact O-N 2.97Å; L377-L379 PolarHBondContact O-N 3.45Å; L379-T382 PolarHBondContact O-N 3.03Å; L379-M383 VanDerWaalsContact O-CG 3.29Å; L379-M383 WeakPolarHBondContact O-CG 3.39Å; L379-M383 PolarHBondContact O-N 3.25Å |
| 380 | Q | 89.9 | Confident | 89.3 | Confident | 61 Ų | 61 | 81.6 Ų | 81.6 | 29% | 0.285 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 177.5 | -71.7 | 177.9 | -14.6 | 0 | 0 | 112.2 | R376 L377 N378 T382 G384 L432 L435 | R376-Q380 VanDerWaalsContact O-CG 3.3Å; R376-Q380 WeakPolarHBondContact O-CG 3.46Å; R376-Q380 PolarHBondContact O-N 3.39Å; L377-Q380 PolarHBondContact O-N 3.16Å; N378-Q380 PolarHBondContact O-N 3.21Å; Q380-T382 VanDerWaalsContact C-N 3.35Å; Q380-G384 PolarHBondContact O-N 3.06Å; Q380-L432 HydrophobicContact CB-CD2 4.12Å; Q380-L432 HydrophobicContact CG-CD2 3.67Å; Q380-L435 HydrophobicContact CG-CD2 4.31Å |
| 381 | L | 91.4 | Very high | 90 | Very high | 109 Ų | 109 | 79.6 Ų | 79.6 | 57% | 0.571 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -64.5 | -37.2 | 175.3 | -74.1 | 172.7 | 0 | 0 | 0 | 112.5 | L377 N378 G384 S385 | L377-L381 WeakPolarHBondContact O-CG 3.35Å; L377-L381 PolarHBondContact O-N 3.03Å; N378-L381 PolarHBondContact O-N 3.37Å; L381-G384 PolarHBondContact O-N 2.69Å; L381-S385 WeakPolarHBondContact O-CB 3.45Å; L381-S385 PolarHBondContact O-N 3.37Å; L381-S385 PolarHBondContact O-OG 3.39Å |
| 382 | T | 92.9 | Very high | 90.5 | Very high | 80 Ų | 80 | 73 Ų | 73 | 49% | 0.491 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -68.8 | -48.9 | 178.8 | -57.2 | 0 | 0 | 0 | 0 | 111.5 | N378 L379 Q380 G384 S385 F386 | N378-T382 WeakPolarHBondContact O-CB 3.4Å; N378-T382 PolarHBondContact O-N 3.03Å; N378-T382 PolarHBondContact O-OG1 2.89Å; L379-T382 PolarHBondContact O-N 3.03Å; Q380-T382 VanDerWaalsContact C-N 3.35Å; T382-G384 PolarHBondContact O-N 3.08Å; T382-S385 PolarHBondContact O-N 3.02Å; T382-F386 WeakPolarHBondContact O-CB 3.49Å; T382-F386 PolarHBondContact O-N 3.05Å |
| 383 | M | 91.6 | Very high | 90.9 | Very high | 43 Ų | 43 | 73.4 Ų | 73.4 | 21% | 0.212 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -54.5 | -36.2 | 172.5 | -72 | 177.3 | 178.9 | 0 | 0 | 111.5 | L379 S387 L431 L435 | L379-M383 VanDerWaalsContact O-CG 3.29Å; L379-M383 WeakPolarHBondContact O-CG 3.39Å; L379-M383 PolarHBondContact O-N 3.25Å; M383-S387 PolarHBondContact O-N 3.41Å; M383-S387 VanDerWaalsContact O-N 3.11Å; M383-L431 HydrophobicContact CB-CB 4.38Å; M383-L431 HydrophobicContact CB-CD1 4.29Å; M383-L431 HydrophobicContact SD-CB 4.29Å; M383-L435 HydrophobicContact CE-CB 4.16Å; M383-L435 HydrophobicContact CE-CD1 3.75Å; M383-L435 HydrophobicContact CE-CD2 3.84Å; M383-L435 HydrophobicContact CE-CG 4.12Å; M383-L435 HydrophobicContact SD-CB 4.3Å; M383-L435 HydrophobicContact SD-CD2 3.94Å |
| 384 | G | 92.7 | Very high | 91.2 | Very high | 0 Ų | 0 | 72.5 Ų | 72.5 | 0% | 0 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -71 | -48.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | Q380 L381 T382 F386 S387 L388 W428 | Q380-G384 PolarHBondContact O-N 3.06Å; L381-G384 PolarHBondContact O-N 2.69Å; T382-G384 PolarHBondContact O-N 3.08Å; G384-F386 PolarHBondContact O-N 2.98Å; G384-S387 WeakPolarHBondContact O-CB 3.42Å; G384-S387 PolarHBondContact O-N 2.86Å; G384-S387 VanDerWaalsContact O-N 3.13Å; G384-L388 PolarHBondContact O-N 2.93Å; G384-W428 VanDerWaalsContact C-CE3 3.5Å; G384-W428 VanDerWaalsContact CA-CD2 3.47Å; G384-W428 WeakPolarHBondContact O-CZ3 3.24Å |
| 385 | S | 94.1 | Very high | 91.4 | Very high | 69 Ų | 69 | 68 Ų | 68 | 48% | 0.483 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -59.1 | -40 | 172.7 | -57.2 | 0 | 0 | 0 | 0 | 110.4 | L381 T382 S387 L388 T389 | L381-S385 WeakPolarHBondContact O-CB 3.45Å; L381-S385 PolarHBondContact O-N 3.37Å; L381-S385 PolarHBondContact O-OG 3.39Å; T382-S385 PolarHBondContact O-N 3.02Å; S385-S387 PolarHBondContact O-N 3.22Å; S385-L388 PolarHBondContact O-N 3.24Å; S385-T389 WeakPolarHBondContact O-CB 3.29Å; S385-T389 PolarHBondContact O-N 3.31Å; S385-T389 PolarHBondContact O-OG1 3.18Å |
| 386 | F | 94.7 | Very high | 91.6 | Very high | 124 Ų | 124 | 67.6 Ų | 67.6 | 54% | 0.544 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -58 | -45.4 | 173.4 | 176.2 | -103.6 | 0 | 0 | 0 | 112.5 | T382 G384 L388 T389 L390 L431 | T382-F386 WeakPolarHBondContact O-CB 3.49Å; T382-F386 PolarHBondContact O-N 3.05Å; G384-F386 PolarHBondContact O-N 2.98Å; F386-L388 VanDerWaalsContact C-N 3.35Å; F386-L388 PolarHBondContact O-N 3.44Å; F386-T389 PolarHBondContact O-N 2.83Å; F386-L390 PolarHBondContact O-N 3.3Å; F386-L431 HydrophobicContact CD1-CD1 4.19Å |
| 387 | S | 94.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 66.7 Ų | 66.7 | 0% | 0 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -63.9 | -38.3 | 176.3 | -164.9 | 0 | 0 | 0 | 0 | 112.6 | M383 G384 S385 S424 I427 W428 | M383-S387 PolarHBondContact O-N 3.41Å; M383-S387 VanDerWaalsContact O-N 3.11Å; G384-S387 WeakPolarHBondContact O-CB 3.42Å; G384-S387 PolarHBondContact O-N 2.86Å; G384-S387 VanDerWaalsContact O-N 3.13Å; S385-S387 PolarHBondContact O-N 3.22Å; S387-S424 VanDerWaalsContact C-OG 3.27Å; S387-S424 PolarHBondContact O-OG 2.93Å; S387-S424 PolarHBondContact OG-O 2.79Å; S387-S424 PolarHBondContact OG-OG 3.37Å; S387-I427 WeakPolarHBondContact OG-CB 3.43Å; S387-W428 PolarHBondContact OG-N 3.41Å |
| 388 | L | 93.9 | Very high | 91.4 | Very high | 114 Ų | 114 | 67.9 Ų | 67.9 | 60% | 0.597 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -69 | -42.7 | 177.2 | -174.8 | 63.5 | 0 | 0 | 0 | 111.4 | G384 S385 F386 G392 S424 | G384-L388 PolarHBondContact O-N 2.93Å; S385-L388 PolarHBondContact O-N 3.24Å; F386-L388 VanDerWaalsContact C-N 3.35Å; F386-L388 PolarHBondContact O-N 3.44Å; L388-G392 WeakPolarHBondContact O-CA 3.46Å; L388-G392 PolarHBondContact O-N 3.22Å; L388-S424 PolarHBondContact N-OG 3.24Å |
| 389 | T | 95.2 | Very high | 91.1 | Very high | 87 Ų | 87 | 66.6 Ų | 66.6 | 53% | 0.534 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -62.7 | -45.3 | 178.3 | -58.6 | 0 | 0 | 0 | 0 | 111.5 | S385 F386 F391 G392 L393 | S385-T389 WeakPolarHBondContact O-CB 3.29Å; S385-T389 PolarHBondContact O-N 3.31Å; S385-T389 PolarHBondContact O-OG1 3.18Å; F386-T389 PolarHBondContact O-N 2.83Å; T389-F391 PolarHBondContact O-N 2.96Å; T389-G392 PolarHBondContact O-N 2.81Å; T389-L393 WeakPolarHBondContact O-CG 3.43Å; T389-L393 PolarHBondContact O-N 3.37Å |
| 390 | L | 94 | Very high | 90.9 | Very high | 79 Ų | 79 | 68 Ų | 68 | 41% | 0.414 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -58.2 | -46.7 | -177 | -178.2 | 64.8 | 0 | 0 | 0 | 112.8 | F386 I427 | F386-L390 PolarHBondContact O-N 3.3Å; L390-I427 HydrophobicContact CD2-CD1 3.94Å |
| 391 | F | 92.8 | Very high | 90.3 | Very high | 26 Ų | 26 | 73.3 Ų | 73.3 | 11% | 0.114 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -83.5 | -26.1 | 177.1 | -71.6 | -82.8 | 0 | 0 | 0 | 112.8 | T389 L393 I394 F419 M420 G423 S424 I427 | T389-F391 PolarHBondContact O-N 2.96Å; F391-L393 PolarHBondContact O-N 2.99Å; F391-I394 HydrophobicContact CD1-CD1 4.02Å; F391-I394 WeakPolarHBondContact O-CB 3.43Å; F391-I394 PolarHBondContact O-N 3.48Å; F391-I394 VanDerWaalsContact O-N 3.13Å; F391-F419 HydrophobicContact CE1-CE1 4.26Å; F391-M420 WeakPolarHBondContact O-CE 3.4Å; F391-G423 WeakPolarHBondContact CE2-O 3.48Å; F391-G423 VanDerWaalsContact CZ-CA 3.4Å; F391-S424 VanDerWaalsContact CD2-N 3.29Å; F391-S424 VanDerWaalsContact CE2-N 3.33Å; F391-I427 HydrophobicContact CD2-CD1 4.48Å; F391-I427 HydrophobicContact CE2-CB 4.15Å; F391-I427 HydrophobicContact CE2-CD1 3.29Å; F391-I427 HydrophobicContact CE2-CG1 3.7Å; F391-I427 HydrophobicContact CZ-CD1 3.55Å; F391-I427 HydrophobicContact CZ-CG1 4.06Å |
| 392 | G | 92.5 | Very high | 89.5 | Confident | 24 Ų | 24 | 73.2 Ų | 73.2 | 25% | 0.247 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -60 | -33.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L388 T389 I394 G395 V396 | L388-G392 WeakPolarHBondContact O-CA 3.46Å; L388-G392 PolarHBondContact O-N 3.22Å; T389-G392 PolarHBondContact O-N 2.81Å; G392-I394 PolarHBondContact O-N 2.92Å; G392-G395 WeakPolarHBondContact O-CA 3.35Å; G392-G395 PolarHBondContact O-N 3.32Å; G392-V396 WeakPolarHBondContact O-CG2 3.35Å; G392-V396 PolarHBondContact O-N 3.01Å |
| 393 | L | 92.8 | Very high | 88.3 | Confident | 107 Ų | 107 | 76.1 Ų | 76.1 | 56% | 0.56 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -56.3 | -33.2 | 174.1 | -72.1 | 174.5 | 0 | 0 | 0 | 113.1 | T389 F391 V396 A397 | T389-L393 WeakPolarHBondContact O-CG 3.43Å; T389-L393 PolarHBondContact O-N 3.37Å; F391-L393 PolarHBondContact O-N 2.99Å; L393-V396 PolarHBondContact O-N 2.92Å; L393-A397 WeakPolarHBondContact O-CB 3.49Å; L393-A397 PolarHBondContact O-N 2.87Å |
| 394 | I | 89 | Confident | 87.1 | Confident | 52 Ų | 52 | 76.7 Ų | 76.7 | 27% | 0.267 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -65.7 | -45.1 | 176.2 | -57.8 | 174.1 | 0 | 0 | 0 | 109.7 | F391 G392 A397 F398 V416 F419 M420 | F391-I394 HydrophobicContact CD1-CD1 4.02Å; F391-I394 WeakPolarHBondContact O-CB 3.43Å; F391-I394 PolarHBondContact O-N 3.48Å; F391-I394 VanDerWaalsContact O-N 3.13Å; G392-I394 PolarHBondContact O-N 2.92Å; I394-A397 PolarHBondContact O-N 3.08Å; I394-F398 HydrophobicContact CG2-CD2 3.78Å; I394-F398 HydrophobicContact CG2-CE2 3.62Å; I394-F398 WeakPolarHBondContact O-CD2 3.37Å; I394-F398 PolarHBondContact O-N 3.44Å; I394-F398 VanDerWaalsContact O-N 3.08Å; I394-V416 HydrophobicContact CG2-CG1 4.35Å; I394-F419 HydrophobicContact CD1-CE1 4.16Å; I394-M420 HydrophobicContact CB-CG 4.26Å; I394-M420 HydrophobicContact CB-SD 4.36Å; I394-M420 HydrophobicContact CG2-CG 4.35Å; I394-M420 HydrophobicContact CG2-SD 4.39Å |
| 395 | G | 88 | Confident | 85.9 | Confident | 28 Ų | 28 | 81.7 Ų | 81.7 | 29% | 0.289 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.5 | -37.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | G392 A397 G399 | G392-G395 WeakPolarHBondContact O-CA 3.35Å; G392-G395 PolarHBondContact O-N 3.32Å; G395-A397 VanDerWaalsContact C-N 3.35Å; G395-G399 PolarHBondContact O-N 3.4Å |
| 396 | V | 90.4 | Very high | 84.5 | Confident | 94 Ų | 94 | 85.2 Ų | 85.2 | 57% | 0.57 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -62.2 | -44.8 | 172.7 | 173.4 | 0 | 0 | 0 | 0 | 110.3 | G392 L393 G399 M400 | G392-V396 WeakPolarHBondContact O-CG2 3.35Å; G392-V396 PolarHBondContact O-N 3.01Å; L393-V396 PolarHBondContact O-N 2.92Å; V396-G399 PolarHBondContact O-N 3.48Å; V396-M400 VanDerWaalsContact O-CG 3.28Å; V396-M400 WeakPolarHBondContact O-CG 3.47Å; V396-M400 PolarHBondContact O-N 2.99Å |
| 397 | A | 86.6 | Confident | 83.2 | Confident | 48 Ų | 48 | 85.4 Ų | 85.4 | 40% | 0.397 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63 | -44.5 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | L393 I394 G395 G399 M400 | L393-A397 WeakPolarHBondContact O-CB 3.49Å; L393-A397 PolarHBondContact O-N 2.87Å; I394-A397 PolarHBondContact O-N 3.08Å; G395-A397 VanDerWaalsContact C-N 3.35Å; A397-G399 VanDerWaalsContact C-N 3.32Å; A397-M400 HydrophobicContact CB-CE 4.31Å; A397-M400 WeakPolarHBondContact O-CB 3.31Å; A397-M400 PolarHBondContact O-N 3.4Å |
| 398 | F | 83.4 | Confident | 82.1 | Confident | 116 Ų | 116 | 93 Ų | 93 | 51% | 0.509 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -76.5 | -17.2 | 174.9 | -70.3 | -66 | 0 | 0 | 0 | 113.7 | I394 M400 T404 V416 | I394-F398 HydrophobicContact CG2-CD2 3.78Å; I394-F398 HydrophobicContact CG2-CE2 3.62Å; I394-F398 WeakPolarHBondContact O-CD2 3.37Å; I394-F398 PolarHBondContact O-N 3.44Å; I394-F398 VanDerWaalsContact O-N 3.08Å; F398-M400 VanDerWaalsContact C-N 3.3Å; F398-T404 HydrophobicContact CE1-CG2 4.34Å; F398-V416 HydrophobicContact CD2-CG1 3.97Å; F398-V416 HydrophobicContact CE2-CG1 4.17Å |
| 399 | G | 83.1 | Confident | 81.3 | Confident | 66 Ų | 66 | 92.5 Ų | 92.5 | 68% | 0.68 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.5 | -6.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | G395 V396 A397 | G395-G399 PolarHBondContact O-N 3.4Å; V396-G399 PolarHBondContact O-N 3.48Å; A397-G399 VanDerWaalsContact C-N 3.32Å |
| 400 | M | 84.6 | Confident | 80.5 | Confident | 100 Ų | 100 | 93.4 Ų | 93.4 | 49% | 0.493 | 54% | 0.544 | S | S | . | . | S | Bend | trans | -74.4 | 141.8 | 172.8 | -58.7 | -167.1 | -69.9 | 0 | 0 | 110.1 | V396 A397 F398 L402 | V396-M400 VanDerWaalsContact O-CG 3.28Å; V396-M400 WeakPolarHBondContact O-CG 3.47Å; V396-M400 PolarHBondContact O-N 2.99Å; A397-M400 HydrophobicContact CB-CE 4.31Å; A397-M400 WeakPolarHBondContact O-CB 3.31Å; A397-M400 PolarHBondContact O-N 3.4Å; F398-M400 VanDerWaalsContact C-N 3.3Å; M400-L402 HydrophobicContact CB-CD1 4.34Å; M400-L402 HydrophobicContact CB-CG 4.29Å; M400-L402 HydrophobicContact CE-CD1 3.96Å; M400-L402 PolarHBondContact O-N 2.81Å |
| 401 | N | 78.3 | Confident | 80 | Confident | 174 Ų | 174 | 99.4 Ų | 99.4 | 93% | 0.93 | 56% | 0.561 | S | S | * | * | S | Bend | trans | -75.1 | 61.7 | 178.7 | -171.8 | 31.5 | 0 | 0 | 0 | 111.9 | ||
| 402 | L | 75.2 | Confident | 79.6 | Confident | 106 Ų | 106 | 98.9 Ų | 98.9 | 56% | 0.555 | 56% | 0.561 | S | S | * | * | trans | -119.4 | 128.5 | 177.1 | -63.6 | 175.6 | 0 | 0 | 0 | 108.5 | M400 T404 | M400-L402 HydrophobicContact CB-CD1 4.34Å; M400-L402 HydrophobicContact CB-CG 4.29Å; M400-L402 HydrophobicContact CE-CD1 3.96Å; M400-L402 PolarHBondContact O-N 2.81Å; L402-T404 PolarHBondContact O-N 3.13Å; L402-T404 PolarHBondContact O-OG1 3.49Å | ||
| 403 | T | 67.3 | Low | 79.2 | Confident | 142 Ų | 142 | 104.3 Ų | 104.3 | 87% | 0.871 | 58% | 0.579 | S | S | * | * | trans | -62.2 | 108.4 | -178.3 | 52.8 | 0 | 0 | 0 | 0 | 110.5 | E407 | T403-E407 WeakPolarHBondContact CA-OE1 3.34Š| ||
| 404 | T | 65.9 | Low | 78.9 | Confident | 54 Ų | 54 | 108.1 Ų | 108.1 | 33% | 0.331 | 59% | 0.585 | S | S | . | * | trans | -114 | 134.8 | -179.3 | -49.8 | 0 | 0 | 0 | 0 | 109 | F398 L402 F406 E407 | F398-T404 HydrophobicContact CE1-CG2 4.34Å; L402-T404 PolarHBondContact O-N 3.13Å; L402-T404 PolarHBondContact O-OG1 3.49Å; T404-F406 PolarHBondContact O-N 2.98Å; T404-E407 PolarHBondContact N-OE1 3.13Å; T404-E407 WeakPolarHBondContact O-CG 3.2Å; T404-E407 PolarHBondContact O-N 3.29Å | ||
| 405 | A | 67.3 | Low | 78.9 | Confident | 105 Ų | 105 | 111.9 Ų | 111.9 | 87% | 0.868 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | 13.6 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 406 | F | 65.1 | Low | 79 | Confident | 143 Ų | 143 | 112.8 Ų | 112.8 | 63% | 0.627 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.4 | 7.3 | -177.7 | -90.1 | -85.3 | 0 | 0 | 0 | 113.2 | T404 A412 | T404-F406 PolarHBondContact O-N 2.98Å; F406-A412 HydrophobicContact CD1-CB 4.27Å |
| 407 | E | 67 | Low | 78.9 | Confident | 128 Ų | 128 | 110.1 Ų | 110.1 | 60% | 0.598 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | -28.8 | -174.1 | -73.3 | 167.4 | -153.8 | 0 | 0 | 114.1 | T403 T404 D409 | T403-E407 WeakPolarHBondContact CA-OE1 3.34Å; T404-E407 PolarHBondContact N-OE1 3.13Å; T404-E407 WeakPolarHBondContact O-CG 3.2Å; T404-E407 PolarHBondContact O-N 3.29Å; E407-D409 VanDerWaalsContact C-N 3.35Å; E407-D409 PolarHBondContact O-N 2.69Å |
| 408 | D | 71.3 | Confident | 79.2 | Confident | 159 Ų | 159 | 109.7 Ų | 109.7 | 85% | 0.85 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | -13.6 | -172.5 | -66.4 | -45.8 | 0 | 0 | 0 | 114.1 | P410 | D408-P410 WeakPolarHBondContact O-CD 3.45Š|
| 409 | D | 78.2 | Confident | 79.6 | Confident | 104 Ų | 104 | 110.2 Ų | 110.2 | 56% | 0.556 | 59% | 0.592 | S | S | * | * | trans | -95.9 | 113.5 | -174 | -90.3 | -35.1 | 0 | 0 | 0 | 113 | E407 R411 A412 | E407-D409 VanDerWaalsContact C-N 3.35Å; E407-D409 PolarHBondContact O-N 2.69Å; D409-R411 PolarHBondContact O-N 3.11Å; D409-A412 HydrophobicContact CB-CB 4.05Å; D409-A412 WeakPolarHBondContact O-CB 3.43Å; D409-A412 PolarHBondContact O-N 3.04Å | ||
| 410 | P | 78.3 | Confident | 80.1 | Confident | 107 Ų | 107 | 108.9 Ų | 108.9 | 70% | 0.695 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65.3 | -14.7 | 179.6 | 25.6 | -34 | 0 | 0 | 0 | 113.6 | D408 | D408-P410 WeakPolarHBondContact O-CD 3.45Å |
| 411 | R | 83.9 | Confident | 80.5 | Confident | 205 Ų | 205 | 111.7 Ų | 111.7 | 77% | 0.774 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -85.8 | -24.5 | 176.9 | -64.4 | -177.5 | -179.9 | -177.2 | 1 | 113.2 | D409 F413 W414 L415 | D409-R411 PolarHBondContact O-N 3.11Å; R411-F413 PolarHBondContact O-N 3.02Å; R411-W414 PolarHBondContact O-N 3.4Å; R411-L415 PolarHBondContact O-N 2.99Å; R411-L415 VanDerWaalsContact O-N 3.14Å |
| 412 | A | 83.4 | Confident | 81.3 | Confident | 15 Ų | 15 | 108.9 Ų | 108.9 | 12% | 0.124 | 56% | 0.563 | C | S | . | * | H | α-helix | trans | -64.8 | -41 | -175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | F406 D409 W414 L415 V416 | F406-A412 HydrophobicContact CD1-CB 4.27Å; D409-A412 HydrophobicContact CB-CB 4.05Å; D409-A412 WeakPolarHBondContact O-CB 3.43Å; D409-A412 PolarHBondContact O-N 3.04Å; A412-W414 PolarHBondContact O-N 3.44Å; A412-L415 PolarHBondContact O-N 2.79Å; A412-V416 WeakPolarHBondContact O-CG2 3.44Å; A412-V416 PolarHBondContact O-N 3.37Å |
| 413 | F | 83.6 | Confident | 82.2 | Confident | 138 Ų | 138 | 104.3 Ų | 104.3 | 61% | 0.605 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -56.7 | -48.5 | 176.3 | 176.9 | -98.2 | 0 | 0 | 0 | 113 | R411 T417 | R411-F413 PolarHBondContact O-N 3.02Å; F413-T417 VanDerWaalsContact O-CB 3.3Å; F413-T417 WeakPolarHBondContact O-CB 3.43Å; F413-T417 PolarHBondContact O-N 3.07Å; F413-T417 PolarHBondContact O-OG1 2.99Å |
| 414 | W | 87.9 | Confident | 83.6 | Confident | 186 Ų | 186 | 98.2 Ų | 98.2 | 71% | 0.705 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -68.2 | -35.3 | 179.8 | -75.2 | 105.4 | 0 | 0 | 0 | 112.5 | R411 A412 G418 | R411-W414 PolarHBondContact O-N 3.4Å; A412-W414 PolarHBondContact O-N 3.44Å; W414-G418 PolarHBondContact O-N 3.48Å |
| 415 | L | 89.1 | Confident | 84.9 | Confident | 131 Ų | 131 | 97.7 Ų | 97.7 | 69% | 0.686 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.8 | -47.5 | 175.3 | -80.3 | 178 | 0 | 0 | 0 | 112.3 | R411 A412 G418 F419 | R411-L415 PolarHBondContact O-N 2.99Å; R411-L415 VanDerWaalsContact O-N 3.14Å; A412-L415 PolarHBondContact O-N 2.79Å; L415-G418 PolarHBondContact O-N 3.48Å; L415-F419 WeakPolarHBondContact O-CB 3.3Å; L415-F419 PolarHBondContact O-N 2.93Å |
| 416 | V | 88.8 | Confident | 86.2 | Confident | 47 Ų | 47 | 97.6 Ų | 97.6 | 29% | 0.285 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65 | -45 | 179.3 | 174.8 | 0 | 0 | 0 | 0 | 110.6 | I394 F398 A412 G418 F419 M420 | I394-V416 HydrophobicContact CG2-CG1 4.35Å; F398-V416 HydrophobicContact CD2-CG1 3.97Å; F398-V416 HydrophobicContact CE2-CG1 4.17Å; A412-V416 WeakPolarHBondContact O-CG2 3.44Å; A412-V416 PolarHBondContact O-N 3.37Å; V416-G418 PolarHBondContact O-N 3.42Å; V416-F419 PolarHBondContact O-N 2.99Å; V416-M420 HydrophobicContact CG1-CG 4.5Å; V416-M420 HydrophobicContact CG1-SD 4.01Å; V416-M420 VanDerWaalsContact O-CG 3.31Å; V416-M420 WeakPolarHBondContact O-CG 3.42Å; V416-M420 PolarHBondContact O-N 3.49Å |
| 417 | T | 89.4 | Confident | 87.6 | Confident | 38 Ų | 38 | 93.3 Ų | 93.3 | 23% | 0.233 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -61.3 | -45.9 | 176.8 | -56.8 | 0 | 0 | 0 | 0 | 111.3 | F413 F419 M420 F421 | F413-T417 VanDerWaalsContact O-CB 3.3Å; F413-T417 WeakPolarHBondContact O-CB 3.43Å; F413-T417 PolarHBondContact O-N 3.07Å; F413-T417 PolarHBondContact O-OG1 2.99Å; T417-F419 PolarHBondContact O-N 3.31Å; T417-M420 PolarHBondContact O-N 2.96Å; T417-F421 HydrophobicContact CG2-CD2 3.92Å; T417-F421 HydrophobicContact CG2-CE2 4.02Å; T417-F421 WeakPolarHBondContact O-CD2 3.27Å; T417-F421 PolarHBondContact O-N 3.49Å; T417-F421 VanDerWaalsContact O-N 3.07Å |
| 418 | G | 92.6 | Very high | 88.9 | Confident | 40 Ų | 40 | 91.5 Ų | 91.5 | 41% | 0.412 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.1 | -43.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | W414 L415 V416 L422 | W414-G418 PolarHBondContact O-N 3.48Å; L415-G418 PolarHBondContact O-N 3.48Å; V416-G418 PolarHBondContact O-N 3.42Å; G418-L422 WeakPolarHBondContact O-CB 3.29Å; G418-L422 PolarHBondContact O-N 2.9Å |
| 419 | F | 91.5 | Very high | 89.9 | Confident | 127 Ų | 127 | 93.3 Ų | 93.3 | 56% | 0.557 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -63.2 | -42.3 | 176.7 | 179.3 | -100.6 | 0 | 0 | 0 | 112.3 | F391 I394 L415 V416 T417 G423 | F391-F419 HydrophobicContact CE1-CE1 4.26Å; I394-F419 HydrophobicContact CD1-CE1 4.16Å; L415-F419 WeakPolarHBondContact O-CB 3.3Å; L415-F419 PolarHBondContact O-N 2.93Å; V416-F419 PolarHBondContact O-N 2.99Å; T417-F419 PolarHBondContact O-N 3.31Å; F419-G423 WeakPolarHBondContact O-CA 3.47Å; F419-G423 PolarHBondContact O-N 3.07Å |
| 420 | M | 93.6 | Very high | 90.5 | Very high | 37 Ų | 37 | 98.1 Ų | 98.1 | 18% | 0.182 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -62.6 | -49.9 | 177.7 | -74.2 | 171.5 | 62 | 0 | 0 | 112.3 | F391 I394 V416 T417 S424 | F391-M420 WeakPolarHBondContact O-CE 3.4Å; I394-M420 HydrophobicContact CB-CG 4.26Å; I394-M420 HydrophobicContact CB-SD 4.36Å; I394-M420 HydrophobicContact CG2-CG 4.35Å; I394-M420 HydrophobicContact CG2-SD 4.39Å; V416-M420 HydrophobicContact CG1-CG 4.5Å; V416-M420 HydrophobicContact CG1-SD 4.01Å; V416-M420 VanDerWaalsContact O-CG 3.31Å; V416-M420 WeakPolarHBondContact O-CG 3.42Å; V416-M420 PolarHBondContact O-N 3.49Å; T417-M420 PolarHBondContact O-N 2.96Å; M420-S424 VanDerWaalsContact O-CB 3.27Å; M420-S424 WeakPolarHBondContact O-CB 3.3Å; M420-S424 PolarHBondContact O-N 3.35Å |
| 421 | F | 93.5 | Very high | 91.1 | Very high | 160 Ų | 160 | 95.4 Ų | 95.4 | 70% | 0.702 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -65 | -44.1 | 179.5 | -89.7 | -82.1 | 0 | 0 | 0 | 112 | T417 G425 | T417-F421 HydrophobicContact CG2-CD2 3.92Å; T417-F421 HydrophobicContact CG2-CE2 4.02Å; T417-F421 WeakPolarHBondContact O-CD2 3.27Å; T417-F421 PolarHBondContact O-N 3.49Å; T417-F421 VanDerWaalsContact O-N 3.07Å; F421-G425 PolarHBondContact O-N 2.78Å |
| 422 | L | 94.8 | Very high | 91.4 | Very high | 114 Ų | 114 | 88.4 Ų | 88.4 | 60% | 0.597 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -66.4 | -46.3 | 179.6 | -175.5 | 63.6 | 0 | 0 | 0 | 111.4 | G418 S424 G425 L426 | G418-L422 WeakPolarHBondContact O-CB 3.29Å; G418-L422 PolarHBondContact O-N 2.9Å; L422-S424 PolarHBondContact O-N 2.96Å; L422-G425 PolarHBondContact O-N 2.83Å; L422-L426 HydrophobicContact CD1-CD1 4.32Å; L422-L426 HydrophobicContact CD1-CG 4.37Å; L422-L426 HydrophobicContact CG-CD1 4.04Å; L422-L426 HydrophobicContact CG-CG 4.48Å; L422-L426 WeakPolarHBondContact O-CB 3.49Å; L422-L426 VanDerWaalsContact O-CG 3.24Å; L422-L426 WeakPolarHBondContact O-CG 3.15Å; L422-L426 PolarHBondContact O-N 3.37Å |
| 423 | G | 94.1 | Very high | 91.5 | Very high | 10 Ų | 10 | 90.3 Ų | 90.3 | 10% | 0.103 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -58.3 | -48.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | F391 F419 G425 L426 I427 | F391-G423 WeakPolarHBondContact CE2-O 3.48Å; F391-G423 VanDerWaalsContact CZ-CA 3.4Å; F419-G423 WeakPolarHBondContact O-CA 3.47Å; F419-G423 PolarHBondContact O-N 3.07Å; G423-G425 PolarHBondContact O-N 3.3Å; G423-L426 PolarHBondContact O-N 3.47Å; G423-I427 WeakPolarHBondContact O-CG1 3.3Å; G423-I427 PolarHBondContact O-N 2.96Å |
| 424 | S | 95.3 | Very high | 91.7 | Very high | 15 Ų | 15 | 89.8 Ų | 89.8 | 11% | 0.105 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -63.3 | -41.8 | 179.2 | -168.3 | 0 | 0 | 0 | 0 | 112.2 | S387 L388 F391 M420 L422 W428 | S387-S424 VanDerWaalsContact C-OG 3.27Å; S387-S424 PolarHBondContact O-OG 2.93Å; S387-S424 PolarHBondContact OG-O 2.79Å; S387-S424 PolarHBondContact OG-OG 3.37Å; L388-S424 PolarHBondContact N-OG 3.24Å; F391-S424 VanDerWaalsContact CD2-N 3.29Å; F391-S424 VanDerWaalsContact CE2-N 3.33Å; M420-S424 VanDerWaalsContact O-CB 3.27Å; M420-S424 WeakPolarHBondContact O-CB 3.3Å; M420-S424 PolarHBondContact O-N 3.35Å; L422-S424 PolarHBondContact O-N 2.96Å; S424-W428 VanDerWaalsContact O-CB 3.3Å; S424-W428 WeakPolarHBondContact O-CB 3.18Å; S424-W428 PolarHBondContact O-N 3.22Å |
| 425 | G | 94.4 | Very high | 91.4 | Very high | 42 Ų | 42 | 81.8 Ų | 81.8 | 43% | 0.433 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -64 | -40.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | F421 L422 G423 R429 | F421-G425 PolarHBondContact O-N 2.78Å; L422-G425 PolarHBondContact O-N 2.83Å; G423-G425 PolarHBondContact O-N 3.3Å; G425-R429 VanDerWaalsContact O-CB 3.29Å; G425-R429 WeakPolarHBondContact O-CB 3.32Å; G425-R429 PolarHBondContact O-N 2.99Å |
| 426 | L | 94.5 | Very high | 90.8 | Very high | 104 Ų | 104 | 78 Ų | 78 | 55% | 0.545 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -67.7 | -43.5 | 178.7 | -72.6 | 174.4 | 0 | 0 | 0 | 112.2 | L422 G423 R429 R430 | L422-L426 HydrophobicContact CD1-CD1 4.32Å; L422-L426 HydrophobicContact CD1-CG 4.37Å; L422-L426 HydrophobicContact CG-CD1 4.04Å; L422-L426 HydrophobicContact CG-CG 4.48Å; L422-L426 WeakPolarHBondContact O-CB 3.49Å; L422-L426 VanDerWaalsContact O-CG 3.24Å; L422-L426 WeakPolarHBondContact O-CG 3.15Å; L422-L426 PolarHBondContact O-N 3.37Å; G423-L426 PolarHBondContact O-N 3.47Å; L426-R429 PolarHBondContact O-N 3.49Å; L426-R430 WeakPolarHBondContact O-CB 3.47Å; L426-R430 PolarHBondContact O-N 3.41Å |
| 427 | I | 93.9 | Very high | 90.2 | Very high | 53 Ų | 53 | 85.5 Ų | 85.5 | 27% | 0.272 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -66.3 | -44.8 | 176.9 | -67.5 | -165.4 | 0 | 0 | 0 | 110.6 | S387 L390 F391 G423 R429 R430 L431 | S387-I427 WeakPolarHBondContact OG-CB 3.43Å; L390-I427 HydrophobicContact CD2-CD1 3.94Å; F391-I427 HydrophobicContact CD2-CD1 4.48Å; F391-I427 HydrophobicContact CE2-CB 4.15Å; F391-I427 HydrophobicContact CE2-CD1 3.29Å; F391-I427 HydrophobicContact CE2-CG1 3.7Å; F391-I427 HydrophobicContact CZ-CD1 3.55Å; F391-I427 HydrophobicContact CZ-CG1 4.06Å; G423-I427 WeakPolarHBondContact O-CG1 3.3Å; G423-I427 PolarHBondContact O-N 2.96Å; I427-R429 VanDerWaalsContact C-N 3.34Å; I427-R429 PolarHBondContact O-N 3.39Å; I427-R430 PolarHBondContact O-N 3.42Å; I427-L431 HydrophobicContact CG2-CD1 3.9Å; I427-L431 HydrophobicContact CG2-CG 4.31Å; I427-L431 VanDerWaalsContact O-CG 3.32Å; I427-L431 WeakPolarHBondContact O-CG 3.35Å; I427-L431 PolarHBondContact O-N 2.97Å |
| 428 | W | 94.4 | Very high | 89.1 | Confident | 90 Ų | 90 | 90 Ų | 90 | 34% | 0.341 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -55.5 | -50.3 | 174.2 | -176.7 | -58.3 | 0 | 0 | 0 | 110.9 | G384 S387 S424 R430 L431 L432 | G384-W428 VanDerWaalsContact C-CE3 3.5Å; G384-W428 VanDerWaalsContact CA-CD2 3.47Å; G384-W428 WeakPolarHBondContact O-CZ3 3.24Å; S387-W428 PolarHBondContact OG-N 3.41Å; S424-W428 VanDerWaalsContact O-CB 3.3Å; S424-W428 WeakPolarHBondContact O-CB 3.18Å; S424-W428 PolarHBondContact O-N 3.22Å; W428-R430 VanDerWaalsContact C-N 3.32Å; W428-R430 PolarHBondContact O-N 2.91Å; W428-L431 PolarHBondContact O-N 2.97Å; W428-L432 VanDerWaalsContact CD1-CD1 3.43Å; W428-L432 PolarHBondContact O-N 2.91Å |
| 429 | R | 92.3 | Very high | 87.6 | Confident | 196 Ų | 196 | 91.2 Ų | 91.2 | 74% | 0.74 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -61.6 | -39.4 | -179.8 | -175.2 | 174.7 | 177.8 | 148.3 | -0.4 | 112.1 | G425 L426 I427 S433 | G425-R429 VanDerWaalsContact O-CB 3.29Å; G425-R429 WeakPolarHBondContact O-CB 3.32Å; G425-R429 PolarHBondContact O-N 2.99Å; L426-R429 PolarHBondContact O-N 3.49Å; I427-R429 VanDerWaalsContact C-N 3.34Å; I427-R429 PolarHBondContact O-N 3.39Å; R429-S433 WeakPolarHBondContact O-CB 3.42Å; R429-S433 PolarHBondContact O-N 3.17Å |
| 430 | R | 91.7 | Very high | 85.2 | Confident | 205 Ų | 205 | 93.2 Ų | 93.2 | 77% | 0.774 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -65.3 | -43 | 176.7 | -171.2 | 172.5 | -177.7 | 148.6 | -0.5 | 111.6 | L426 I427 W428 S433 F434 | L426-R430 WeakPolarHBondContact O-CB 3.47Å; L426-R430 PolarHBondContact O-N 3.41Å; I427-R430 PolarHBondContact O-N 3.42Å; W428-R430 VanDerWaalsContact C-N 3.32Å; W428-R430 PolarHBondContact O-N 2.91Å; R430-S433 PolarHBondContact O-N 3.01Å; R430-F434 WeakPolarHBondContact O-CB 3.36Å; R430-F434 PolarHBondContact O-N 2.93Å |
| 431 | L | 90.6 | Very high | 83 | Confident | 50 Ų | 50 | 95.8 Ų | 95.8 | 26% | 0.262 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64 | -43.9 | 176.4 | -69.9 | 171.9 | 0 | 0 | 0 | 111.9 | M383 F386 I427 W428 S433 F434 L435 | M383-L431 HydrophobicContact CB-CB 4.38Å; M383-L431 HydrophobicContact CB-CD1 4.29Å; M383-L431 HydrophobicContact SD-CB 4.29Å; F386-L431 HydrophobicContact CD1-CD1 4.19Å; I427-L431 HydrophobicContact CG2-CD1 3.9Å; I427-L431 HydrophobicContact CG2-CG 4.31Å; I427-L431 VanDerWaalsContact O-CG 3.32Å; I427-L431 WeakPolarHBondContact O-CG 3.35Å; I427-L431 PolarHBondContact O-N 2.97Å; W428-L431 PolarHBondContact O-N 2.97Å; L431-S433 PolarHBondContact O-N 3.31Å; L431-F434 PolarHBondContact O-N 3.39Å; L431-L435 PolarHBondContact O-N 3.25Å |
| 432 | L | 88.9 | Confident | 80.7 | Confident | 59 Ų | 59 | 92.2 Ų | 92.2 | 31% | 0.309 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62 | -43.4 | 174.5 | -75.5 | -173.6 | 0 | 0 | 0 | 112.5 | Q380 W428 F434 L435 G436 | Q380-L432 HydrophobicContact CB-CD2 4.12Å; Q380-L432 HydrophobicContact CG-CD2 3.67Å; W428-L432 VanDerWaalsContact CD1-CD1 3.43Å; W428-L432 PolarHBondContact O-N 2.91Å; L432-F434 VanDerWaalsContact C-N 3.29Å; L432-F434 PolarHBondContact O-N 3.32Å; L432-L435 PolarHBondContact O-N 3.45Å; L432-G436 PolarHBondContact O-N 2.85Å |
| 433 | S | 87.4 | Confident | 78.1 | Confident | 54 Ų | 54 | 92 Ų | 92 | 38% | 0.378 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65.5 | -34.2 | 178.4 | -178.6 | 0 | 0 | 0 | 0 | 112.2 | R429 R430 L431 R437 | R429-S433 WeakPolarHBondContact O-CB 3.42Å; R429-S433 PolarHBondContact O-N 3.17Å; R430-S433 PolarHBondContact O-N 3.01Å; L431-S433 PolarHBondContact O-N 3.31Å; S433-R437 WeakPolarHBondContact O-CG 3.41Å; S433-R437 PolarHBondContact O-N 2.99Å |
| 434 | F | 86.1 | Confident | 75.5 | Confident | 127 Ų | 127 | 100.2 Ų | 100.2 | 56% | 0.557 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.9 | -44.8 | 175.2 | -178.2 | -101.7 | 0 | 0 | 0 | 110.9 | R430 L431 L432 G436 R437 H438 | R430-F434 WeakPolarHBondContact O-CB 3.36Å; R430-F434 PolarHBondContact O-N 2.93Å; L431-F434 PolarHBondContact O-N 3.39Å; L432-F434 VanDerWaalsContact C-N 3.29Å; L432-F434 PolarHBondContact O-N 3.32Å; F434-G436 PolarHBondContact O-N 2.88Å; F434-R437 PolarHBondContact O-N 3.48Å; F434-H438 AromaticContact CE1-CD2 3.95Å; F434-H438 AromaticContact CE2-CD2 3.57Å; F434-H438 AromaticContact CE2-NE2 3.5Å; F434-H438 AromaticContact CZ-CD2 3.53Å; F434-H438 AromaticContact CZ-NE2 3.63Å; F434-H438 PolarHBondContact O-N 3.28Å |
| 435 | L | 81.9 | Confident | 72.8 | Confident | 18 Ų | 18 | 105.9 Ų | 105.9 | 9% | 0.094 | 53% | 0.531 | C | S | . | . | H | α-helix | trans | -64.4 | -40.3 | 177.5 | -169.7 | 69.2 | 0 | 0 | 0 | 112.3 | Q380 M383 L431 L432 R437 H438 L439 | Q380-L435 HydrophobicContact CG-CD2 4.31Å; M383-L435 HydrophobicContact CE-CB 4.16Å; M383-L435 HydrophobicContact CE-CD1 3.75Å; M383-L435 HydrophobicContact CE-CD2 3.84Å; M383-L435 HydrophobicContact CE-CG 4.12Å; M383-L435 HydrophobicContact SD-CB 4.3Å; M383-L435 HydrophobicContact SD-CD2 3.94Å; L431-L435 PolarHBondContact O-N 3.25Å; L432-L435 PolarHBondContact O-N 3.45Å; L435-R437 PolarHBondContact O-N 3.31Å; L435-H438 PolarHBondContact O-N 3.27Å; L435-L439 HydrophobicContact CD1-CD1 3.66Å; L435-L439 HydrophobicContact CG-CD1 4.36Å; L435-L439 PolarHBondContact O-N 3.31Å |
| 436 | G | 76.9 | Confident | 69.9 | Low | 52 Ų | 52 | 108.6 Ų | 108.6 | 54% | 0.536 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.6 | -22.8 | 178 | 0 | 0 | 0 | 0 | 0 | 114.4 | L432 F434 | L432-G436 PolarHBondContact O-N 2.85Å; F434-G436 PolarHBondContact O-N 2.88Å |
| 437 | R | 75.8 | Confident | 67.3 | Low | 204 Ų | 204 | 109.4 Ų | 109.4 | 77% | 0.77 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -84.1 | -30.2 | 174.8 | -73.5 | 178.2 | 178.7 | 160.2 | 0.1 | 113.1 | S433 F434 L435 | S433-R437 WeakPolarHBondContact O-CG 3.41Å; S433-R437 PolarHBondContact O-N 2.99Å; F434-R437 PolarHBondContact O-N 3.48Å; L435-R437 PolarHBondContact O-N 3.31Å |
| 438 | H | 66.1 | Low | 64.8 | Low | 134 Ų | 134 | 113.2 Ų | 113.2 | 62% | 0.62 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -95.4 | -26.4 | -177.5 | -80.9 | -72.6 | 0 | 0 | 0 | 114.2 | F434 L435 H440 | F434-H438 AromaticContact CE1-CD2 3.95Å; F434-H438 AromaticContact CE2-CD2 3.57Å; F434-H438 AromaticContact CE2-NE2 3.5Å; F434-H438 AromaticContact CZ-CD2 3.53Å; F434-H438 AromaticContact CZ-NE2 3.63Å; F434-H438 PolarHBondContact O-N 3.28Å; L435-H438 PolarHBondContact O-N 3.27Å; H438-H440 PolarHBondContact O-N 3.5Å |
| 439 | L | 61.3 | Low | 62.6 | Low | 65 Ų | 65 | 119 Ų | 119 | 34% | 0.34 | 60% | 0.597 | S | S | . | * | S | Bend | trans | -93.4 | 93.8 | 166.7 | -93.2 | 71.8 | 0 | 0 | 0 | 108.5 | L435 | L435-L439 HydrophobicContact CD1-CD1 3.66Å; L435-L439 HydrophobicContact CG-CD1 4.36Å; L435-L439 PolarHBondContact O-N 3.31Å |
| 440 | H | 42.4 | Very low | 60 | Low | 168 Ų | 168 | 119.8 Ų | 119.8 | 78% | 0.778 | 61% | 0.605 | S | S | * | * | P | Polyproline II helix | trans | -46.5 | 137.1 | 162.1 | -145.9 | -118.3 | 0 | 0 | 0 | 108.5 | H438 | H438-H440 PolarHBondContact O-N 3.5Š|
| 441 | P | 47.3 | Very low | 57.3 | Low | 91 Ų | 91 | 121.1 Ų | 121.1 | 59% | 0.591 | 61% | 0.61 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 138.1 | 176.1 | 24.1 | -31.4 | 0 | 0 | 0 | 108 | S443 | P441-S443 PolarHBondContact O-N 3.24Å; P441-S443 VanDerWaalsContact O-N 3.17Å |
| 442 | P | 44.9 | Very low | 54.6 | Low | 85 Ų | 85 | 125 Ų | 125 | 55% | 0.552 | 63% | 0.632 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 130 | 164 | 25.3 | -30.7 | 0 | 0 | 0 | 105.9 | M444 | P442-M444 PolarHBondContact O-N 2.97Š|
| 443 | S | 39.6 | Very low | 52.1 | Low | 109 Ų | 109 | 128.5 Ų | 128.5 | 76% | 0.762 | 66% | 0.655 | S | S | * | * | trans | -43.8 | 107.2 | 175.1 | 45.5 | 0 | 0 | 0 | 0 | 109 | P441 F445 | P441-S443 PolarHBondContact O-N 3.24Å; P441-S443 VanDerWaalsContact O-N 3.17Å; S443-F445 PolarHBondContact O-N 3.34Å | ||
| 444 | M | 39.9 | Very low | 49.4 | Very low | 184 Ų | 184 | 135.3 Ų | 135.3 | 91% | 0.906 | 68% | 0.678 | S | S | * | * | trans | -58.1 | 122.9 | 167.1 | -163.6 | 178.2 | -69.3 | 0 | 0 | 105.7 | P442 | P442-M444 PolarHBondContact O-N 2.97Š| ||
| 445 | F | 39.1 | Very low | 47 | Very low | 134 Ų | 134 | 134.5 Ų | 134.5 | 59% | 0.588 | 69% | 0.685 | S | S | * | * | trans | -45.6 | 145.9 | -172.2 | -71.8 | -85 | 0 | 0 | 0 | 113.4 | I365 S443 S447 | I365-F445 HydrophobicContact CG2-CE1 3.61Å; I365-F445 HydrophobicContact CG2-CZ 3.3Å; S443-F445 PolarHBondContact O-N 3.34Å; F445-S447 PolarHBondContact O-N 3.14Å | ||
| 446 | P | 32.7 | Very low | 44.7 | Very low | 98 Ų | 98 | 142.4 Ų | 142.4 | 64% | 0.636 | 72% | 0.722 | S | S | * | * | trans | -62.6 | 132.2 | 163.2 | 29.2 | -30.6 | 0 | 0 | 0 | 108 | I448 | P446-I448 HydrophobicContact CB-CD1 4.04Å; P446-I448 HydrophobicContact CB-CG1 4.14Å; P446-I448 HydrophobicContact CG-CD1 4.38Å; P446-I448 PolarHBondContact O-N 3.27Å | ||
| 447 | S | 39.4 | Very low | 42.6 | Very low | 122 Ų | 122 | 147.5 Ų | 147.5 | 85% | 0.853 | 74% | 0.737 | S | S | * | * | trans | -69.7 | 48.6 | 176.4 | 49.1 | 0 | 0 | 0 | 0 | 112.7 | F445 W449 | F445-S447 PolarHBondContact O-N 3.14Å; S447-W449 PolarHBondContact O-N 2.89Å | ||
| 448 | I | 42.8 | Very low | 40.9 | Very low | 133 Ų | 133 | 144.1 Ų | 144.1 | 68% | 0.682 | 74% | 0.739 | S | S | * | * | trans | -100.3 | 82 | 176.6 | -56.2 | 169 | 0 | 0 | 0 | 106.7 | P446 | P446-I448 HydrophobicContact CB-CD1 4.04Å; P446-I448 HydrophobicContact CB-CG1 4.14Å; P446-I448 HydrophobicContact CG-CD1 4.38Å; P446-I448 PolarHBondContact O-N 3.27Å | ||
| 449 | W | 46.9 | Very low | 39.4 | Very low | 212 Ų | 212 | 147 Ų | 147 | 80% | 0.803 | 75% | 0.749 | S | S | * | * | trans | -175.4 | 42.1 | 144.6 | -114.8 | 77.1 | 0 | 0 | 0 | 113.6 | S447 | S447-W449 PolarHBondContact O-N 2.89Š| ||
| 450 | K | 38 | Very low | 38.4 | Very low | 211 Ų | 211 | 149.4 Ų | 149.4 | 92% | 0.917 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -102.5 | 11.7 | 166.6 | -105.9 | -171.4 | -179.7 | -174 | 0 | 113.9 | ||
| 451 | R | 34.8 | Very low | 38.2 | Very low | 233 Ų | 233 | 145.2 Ų | 145.2 | 88% | 0.879 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -111.3 | 6.5 | -167.6 | -142.8 | 177.3 | -152.5 | 125.3 | 10 | 117.8 | ||
| 452 | N | 34.1 | Very low | 37.8 | Very low | 133 Ų | 133 | 147.7 Ų | 147.7 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -127 | 34.1 | 179.4 | -78.6 | -22.2 | 0 | 0 | 0 | 115 | ||
| 453 | V | 36.4 | Very low | 37.4 | Very low | 131 Ų | 131 | 158.7 Ų | 158.7 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | trans | -123.9 | 95.6 | 156.7 | -174.8 | 0 | 0 | 0 | 0 | 107.6 | P455 | V453-P455 WeakPolarHBondContact O-CD 3.44Š| ||
| 454 | K | 30.9 | Very low | 37.3 | Very low | 198 Ų | 198 | 161.2 Ų | 161.2 | 86% | 0.861 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 122.5 | 165.9 | -118.4 | 177.6 | 179.1 | 178.4 | 0 | 107 | Q456 | K454-Q456 PolarHBondContact O-N 3.5Š|
| 455 | P | 36 | Very low | 37.2 | Very low | 110 Ų | 110 | 159.9 Ų | 159.9 | 71% | 0.714 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -65 | 128.4 | 163.6 | 26.7 | -29.8 | 0 | 0 | 0 | 108 | V453 D457 | V453-P455 WeakPolarHBondContact O-CD 3.44Å; P455-D457 PolarHBondContact O-N 2.93Å |
| 456 | Q | 34.3 | Very low | 37.1 | Very low | 184 Ų | 184 | 161.4 Ų | 161.4 | 86% | 0.86 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 124 | 163.8 | -83.7 | -176 | -15.1 | 0 | 0 | 108.1 | K454 T458 | K454-Q456 PolarHBondContact O-N 3.5Å; Q456-T458 PolarHBondContact O-N 2.92Å |
| 457 | D | 32.8 | Very low | 37.3 | Very low | 159 Ų | 159 | 165.1 Ų | 165.1 | 85% | 0.85 | 84% | 0.836 | S | S | * | * | trans | -63.1 | 96.9 | 170.3 | -75.7 | -45.3 | 0 | 0 | 0 | 110 | P455 K459 | P455-D457 PolarHBondContact O-N 2.93Å; D457-K459 PolarHBondContact O-N 3.39Å | ||
| 458 | T | 38.2 | Very low | 37.2 | Very low | 133 Ų | 133 | 167.8 Ų | 167.8 | 82% | 0.816 | 84% | 0.835 | S | S | * | * | trans | -71.8 | 102.9 | 157.3 | 39.1 | 0 | 0 | 0 | 0 | 108.5 | Q456 | Q456-T458 PolarHBondContact O-N 2.92Š| ||
| 459 | K | 35.3 | Very low | 36.8 | Very low | 193 Ų | 193 | 170.1 Ų | 170.1 | 84% | 0.839 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 128.6 | 165.9 | -74.8 | -178.1 | 176.4 | -179.4 | 0 | 109.5 | D457 | D457-K459 PolarHBondContact O-N 3.39Š|
| 460 | P | 40.2 | Very low | 36.1 | Very low | 117 Ų | 117 | 167.1 Ų | 167.1 | 76% | 0.76 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 133.3 | 165.6 | 30.3 | -28.7 | 0 | 0 | 0 | 108.9 | ||
| 461 | G | 38.3 | Very low | 35.9 | Very low | 80 Ų | 80 | 163.8 Ų | 163.8 | 83% | 0.825 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 139.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 462 | V | 39.3 | Very low | 36 | Very low | 143 Ų | 143 | 158 Ų | 158 | 87% | 0.867 | 84% | 0.84 | S | S | * | * | trans | -109.4 | 135.6 | 161.9 | 177.4 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 463 | R | 36.5 | Very low | 36.2 | Very low | 315 Ų | 315 | 160.3 Ų | 160.3 | 100% | 1.189 | 85% | 0.852 | S | S | * | * | trans | -46.6 | 0 | -176.2 | -81.6 | 178.4 | 175.4 | 172.3 | -2.1 | 115.3 |
Retrieved 463 of 463 residues in 151 ms
(Link to these results)