| 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 | 38.9 | Very low | 41.1 | Very low | 240 Ų | 240 | 151 Ų | 151 | 100% | 1.182 | 81% | 0.806 | S | S | * | * | 0 | 142.2 | 0 | -59.2 | 173.3 | 87.2 | 0 | 0 | 107.7 | |||||
| 2 | H | 35.2 | Very low | 41.2 | Very low | 194 Ų | 194 | 153.4 Ų | 153.4 | 90% | 0.898 | 81% | 0.813 | S | S | * | * | trans | -129.1 | 137.4 | 178.6 | -83.2 | -0.3 | 0 | 0 | 0 | 110.1 | ||||
| 3 | S | 31.7 | Very low | 41.3 | Very low | 119 Ų | 119 | 153.1 Ų | 153.1 | 83% | 0.832 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 136.7 | 169.8 | -53.7 | 0 | 0 | 0 | 0 | 109.5 | ||
| 4 | P | 44.6 | Very low | 40.9 | Very low | 116 Ų | 116 | 156.9 Ų | 156.9 | 75% | 0.753 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 147.2 | 170 | 32.5 | -33.4 | 0 | 0 | 0 | 111.3 | ||
| 5 | P | 47.6 | Very low | 40.8 | Very low | 125 Ų | 125 | 158.2 Ų | 158.2 | 81% | 0.812 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 173.2 | 167.6 | 33.9 | -35 | 0 | 0 | 0 | 111.8 | ||
| 6 | R | 43.1 | Very low | 40.8 | Very low | 228 Ų | 228 | 157.7 Ų | 157.7 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -98.8 | 170 | 176 | -65.4 | -179.1 | 165.9 | -175.5 | -4 | 112.3 | ||
| 7 | E | 39.3 | Very low | 40.9 | Very low | 167 Ų | 167 | 155.1 Ų | 155.1 | 78% | 0.78 | 80% | 0.797 | S | S | * | * | trans | 75.8 | 116 | 159.8 | -64.1 | 175.1 | -155.6 | 0 | 0 | 119.2 | ||||
| 8 | Q | 36.3 | Very low | 40.8 | Very low | 150 Ų | 150 | 156.4 Ų | 156.4 | 70% | 0.701 | 80% | 0.8 | S | S | * | * | 179.9 | 99.4 | 115.1 | -98.1 | -177.2 | 50.6 | 0 | 0 | 112.4 | A10 | Q8-A10 VanDerWaalsContact C-N 3.35Å; Q8-A10 PolarHBondContact O-N 3.32Å | |||
| 9 | P | 46.2 | Very low | 41 | Very low | 141 Ų | 141 | 155.3 Ų | 155.3 | 92% | 0.916 | 80% | 0.796 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | 51.4 | 174.5 | 37.8 | -34.5 | 0 | 0 | 0 | 112.5 | ||
| 10 | A | 46.1 | Very low | 40.7 | Very low | 66 Ų | 66 | 154.4 Ų | 154.4 | 55% | 0.545 | 80% | 0.797 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -123.9 | -20.1 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | Q8 | Q8-A10 VanDerWaalsContact C-N 3.35Å; Q8-A10 PolarHBondContact O-N 3.32Å |
| 11 | I | 43.3 | Very low | 40.4 | Very low | 115 Ų | 115 | 155.4 Ų | 155.4 | 59% | 0.59 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -94.6 | -18.3 | -166.1 | -65.2 | 175.1 | 0 | 0 | 0 | 113.4 | ||
| 12 | M | 41.6 | Very low | 40.1 | Very low | 180 Ų | 180 | 154.5 Ų | 154.5 | 89% | 0.887 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.7 | -30.1 | -175.8 | -64.9 | -168.3 | -172 | 0 | 0 | 114.4 | W14 K15 | M12-W14 VanDerWaalsContact C-N 3.32Å; M12-W14 PolarHBondContact O-N 3.21Å; M12-K15 PolarHBondContact O-N 2.87Å |
| 13 | L | 42.6 | Very low | 39.9 | Very low | 149 Ų | 149 | 153.4 Ų | 153.4 | 78% | 0.78 | 78% | 0.776 | S | S | * | * | G | 310 helix | trans | -68.4 | -26.9 | -172.9 | -103 | 162.3 | 0 | 0 | 0 | 114.1 | ||
| 14 | W | 36.3 | Very low | 40 | Very low | 207 Ų | 207 | 154.3 Ų | 154.3 | 78% | 0.784 | 77% | 0.771 | S | S | * | * | G | 310 helix | trans | -80.2 | -23.9 | 179.4 | -76.2 | 103 | 0 | 0 | 0 | 114 | M12 L16 | M12-W14 VanDerWaalsContact C-N 3.32Å; M12-W14 PolarHBondContact O-N 3.21Å; W14-L16 VanDerWaalsContact C-N 3.33Å; W14-L16 PolarHBondContact O-N 2.82Å |
| 15 | K | 39.3 | Very low | 39.3 | Very low | 176 Ų | 176 | 156.1 Ų | 156.1 | 77% | 0.765 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -81.5 | -4.9 | -178.4 | -81.1 | -166.5 | 171.2 | -173.4 | 0 | 115.1 | M12 | M12-K15 PolarHBondContact O-N 2.87Š|
| 16 | L | 40.7 | Very low | 38.5 | Very low | 150 Ų | 150 | 160.9 Ų | 160.9 | 79% | 0.785 | 78% | 0.777 | S | S | * | * | G | 310 helix | trans | -88.4 | -7.8 | 179.3 | -145.6 | 75.7 | 0 | 0 | 0 | 113.9 | W14 | W14-L16 VanDerWaalsContact C-N 3.33Å; W14-L16 PolarHBondContact O-N 2.82Å |
| 17 | V | 42.5 | Very low | 38 | Very low | 113 Ų | 113 | 158 Ų | 158 | 69% | 0.685 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -94.2 | -25.7 | -171.4 | -179.2 | 0 | 0 | 0 | 0 | 113.4 | ||
| 18 | E | 39.6 | Very low | 37.5 | Very low | 179 Ų | 179 | 156.2 Ų | 156.2 | 84% | 0.836 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -97.8 | -6.1 | -172 | -63.8 | -167.4 | 127.1 | 0 | 0 | 115.1 | ||
| 19 | N | 43.6 | Very low | 37.3 | Very low | 136 Ų | 136 | 159.9 Ų | 159.9 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | trans | -121.8 | 37.6 | -163.3 | -130.7 | 31.9 | 0 | 0 | 0 | 115.3 | ||||
| 20 | V | 34.7 | Very low | 36.6 | Very low | 136 Ų | 136 | 161.2 Ų | 161.2 | 82% | 0.824 | 77% | 0.77 | S | S | * | * | trans | -107 | 85 | 165.1 | -174.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 21 | K | 34.8 | Very low | 36.1 | Very low | 177 Ų | 177 | 165.8 Ų | 165.8 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | trans | -77 | 155.7 | 161.9 | -72.4 | -177.3 | 178.1 | 178 | 0 | 109.5 | ||||
| 22 | Y | 33.7 | Very low | 35.5 | Very low | 221 Ų | 221 | 163.7 Ų | 163.7 | 87% | 0.867 | 79% | 0.792 | S | S | * | * | trans | -63.2 | 133.7 | 161.2 | -95.5 | -121.2 | 0 | 0 | 0 | 109.1 | ||||
| 23 | E | 30.2 | Very low | 35 | Very low | 171 Ų | 171 | 161.9 Ų | 161.9 | 80% | 0.799 | 79% | 0.79 | S | S | * | * | trans | -112.3 | 140 | 158.5 | -90.2 | -65.8 | 158.9 | 0 | 0 | 107.3 | ||||
| 24 | D | 33.2 | Very low | 35 | Very low | 137 Ų | 137 | 160.7 Ų | 160.7 | 73% | 0.733 | 79% | 0.792 | S | S | * | * | trans | -86.9 | 115.7 | -173.6 | -80.4 | -57.5 | 0 | 0 | 0 | 111 | Y26 | D24-Y26 PolarHBondContact O-N 3.2Š| ||
| 25 | I | 30.4 | Very low | 34.7 | Very low | 155 Ų | 155 | 155.2 Ų | 155.2 | 80% | 0.795 | 79% | 0.785 | S | S | * | * | trans | -91.3 | 86 | 172.4 | -54.3 | 179.8 | 0 | 0 | 0 | 109.6 | ||||
| 26 | Y | 30.7 | Very low | 34.5 | Very low | 225 Ų | 225 | 155.7 Ų | 155.7 | 88% | 0.882 | 79% | 0.79 | S | S | * | * | trans | -111.5 | 90.6 | 152.9 | -88 | -85.6 | 0 | 0 | 0 | 108.3 | D24 | D24-Y26 PolarHBondContact O-N 3.2Š| ||
| 27 | E | 31.9 | Very low | 33.9 | Very low | 168 Ų | 168 | 153 Ų | 153 | 79% | 0.785 | 78% | 0.784 | S | S | * | * | trans | -83.4 | 119.9 | 163 | -80.5 | -163.4 | 142.5 | 0 | 0 | 109.7 | ||||
| 28 | D | 29.8 | Very low | 33.4 | Very low | 128 Ų | 128 | 152.7 Ų | 152.7 | 68% | 0.684 | 79% | 0.786 | S | S | * | * | trans | -72.4 | 150.2 | 170.4 | -174.3 | 16.8 | 0 | 0 | 0 | 110.9 | H30 | D28-H30 IonicContact OD2-CD2 2.75Å; D28-H30 PolarHBondContact OD2-CD2 3.42Å | ||
| 29 | R | 32 | Very low | 33.1 | Very low | 228 Ų | 228 | 156.3 Ų | 156.3 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | -135.4 | 75.5 | 173.1 | -78 | -165.5 | 177.5 | -173.8 | -0.1 | 110.5 | ||||
| 30 | H | 31.7 | Very low | 32.6 | Very low | 169 Ų | 169 | 157.8 Ų | 157.8 | 78% | 0.782 | 80% | 0.799 | S | S | * | * | trans | -72.3 | 122.9 | 164.4 | -108.6 | -67.6 | 0 | 0 | 0 | 111 | D28 | D28-H30 IonicContact OD2-CD2 2.75Å; D28-H30 PolarHBondContact OD2-CD2 3.42Å | ||
| 31 | D | 35.6 | Very low | 32.5 | Very low | 162 Ų | 162 | 156.6 Ų | 156.6 | 87% | 0.866 | 80% | 0.797 | S | S | * | * | trans | -153.9 | 145 | 164.4 | -134.1 | -26.4 | 0 | 0 | 0 | 111.9 | ||||
| 32 | G | 29.7 | Very low | 32.4 | Very low | 71 Ų | 71 | 156.4 Ų | 156.4 | 73% | 0.732 | 80% | 0.799 | S | S | * | * | trans | 55.5 | 95.2 | 163.2 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 33 | V | 33 | Very low | 32.4 | Very low | 141 Ų | 141 | 154 Ų | 154 | 86% | 0.855 | 80% | 0.8 | S | S | * | * | trans | -88.8 | 156.3 | 155.4 | -152.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 34 | P | 41.2 | Very low | 32.4 | Very low | 125 Ų | 125 | 149.6 Ų | 149.6 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | -139.7 | 128.1 | 118.7 | 34.4 | -21.5 | 0 | 0 | 0 | 115.9 | |||||
| 35 | S | 30.7 | Very low | 32.4 | Very low | 92 Ų | 92 | 148.7 Ų | 148.7 | 64% | 0.643 | 81% | 0.805 | S | S | * | * | trans | 6.2 | 139.1 | 152.1 | -166.1 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 36 | H | 34.4 | Very low | 32.6 | Very low | 185 Ų | 185 | 148 Ų | 148 | 86% | 0.856 | 81% | 0.808 | S | S | * | * | -159.3 | 123.2 | 122.3 | -99.5 | -62.5 | 0 | 0 | 0 | 114.7 | |||||
| 37 | S | 29.1 | Very low | 32.7 | Very low | 95 Ų | 95 | 142.2 Ų | 142.2 | 66% | 0.664 | 80% | 0.8 | S | S | * | * | trans | 27.6 | 104.4 | 150.1 | -57.7 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 38 | S | 30.8 | Very low | 33 | Very low | 106 Ų | 106 | 142.6 Ų | 142.6 | 74% | 0.741 | 80% | 0.801 | S | S | * | * | 34.2 | 133.1 | 119.5 | 58.1 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 39 | R | 33.1 | Very low | 33.3 | Very low | 255 Ų | 255 | 139.3 Ų | 139.3 | 96% | 0.962 | 80% | 0.798 | S | S | * | * | -165.9 | 160.6 | 121.9 | -105.4 | 162.2 | -164.1 | -126.9 | 1.4 | 112.6 | |||||
| 40 | L | 34.4 | Very low | 34.2 | Very low | 166 Ų | 166 | 133.3 Ų | 133.3 | 87% | 0.869 | 79% | 0.789 | S | S | * | * | trans | -129.4 | 135.9 | -172.5 | -166.3 | 89.3 | 0 | 0 | 0 | 110.1 | ||||
| 41 | S | 33.3 | Very low | 34.5 | Very low | 112 Ų | 112 | 136 Ų | 136 | 78% | 0.783 | 79% | 0.794 | S | S | * | * | trans | -178.4 | 150.8 | 167.4 | -72.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 42 | Q | 31.7 | Very low | 34.4 | Very low | 172 Ų | 172 | 134 Ų | 134 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | cis | -178.7 | 121.8 | -31.3 | -120.2 | -176.7 | -15 | 0 | 0 | 105.1 | ||||
| 43 | L | 33.2 | Very low | 34.6 | Very low | 172 Ų | 172 | 135.9 Ų | 135.9 | 90% | 0.901 | 79% | 0.794 | S | S | * | * | trans | 29 | 132.7 | 150.6 | -73.9 | 159 | 0 | 0 | 0 | 123.1 | ||||
| 44 | G | 30.5 | Very low | 34.6 | Very low | 77 Ų | 77 | 133.5 Ų | 133.5 | 79% | 0.794 | 79% | 0.79 | S | S | * | * | trans | -150.7 | 145.3 | 151.7 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 45 | S | 33.7 | Very low | 34.7 | Very low | 118 Ų | 118 | 133.4 Ų | 133.4 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | trans | -152.2 | -172.6 | -171.3 | -170.1 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 46 | V | 34.2 | Very low | 35.7 | Very low | 142 Ų | 142 | 134.3 Ų | 134.3 | 86% | 0.861 | 79% | 0.792 | S | S | * | * | trans | 89.3 | 140.6 | -178 | 179.5 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 47 | S | 33.3 | Very low | 35.7 | Very low | 102 Ų | 102 | 133 Ų | 133 | 71% | 0.713 | 79% | 0.791 | S | S | * | * | cis | 176.1 | 152.5 | -20.5 | -169.5 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 48 | Q | 37.9 | Very low | 35.8 | Very low | 176 Ų | 176 | 134 Ų | 134 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | cis | -165.8 | 156.6 | -20.6 | -106.9 | -71.4 | 22.6 | 0 | 0 | 110.8 | ||||
| 49 | G | 35.8 | Very low | 36.2 | Very low | 60 Ų | 60 | 137.7 Ų | 137.7 | 62% | 0.619 | 80% | 0.803 | S | S | * | * | trans | 81.9 | 174.5 | 148.2 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 50 | P | 50.9 | Low | 36.3 | Very low | 102 Ų | 102 | 132 Ų | 132 | 66% | 0.662 | 80% | 0.797 | S | S | * | * | cis | -130.5 | 167.8 | -7.5 | 35.8 | -17.4 | 0 | 0 | 0 | 116.6 | ||||
| 51 | Y | 38 | Very low | 36.8 | Very low | 225 Ų | 225 | 130.6 Ų | 130.6 | 88% | 0.882 | 80% | 0.798 | S | S | * | * | trans | 70.3 | 134.2 | 174.6 | -44.4 | -71.4 | 0 | 0 | 0 | 116.6 | ||||
| 52 | S | 33.2 | Very low | 37 | Very low | 119 Ų | 119 | 130.1 Ų | 130.1 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | cis | -146.5 | 171.6 | -0.3 | -160.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 53 | S | 35.3 | Very low | 37.9 | Very low | 111 Ų | 111 | 127.6 Ų | 127.6 | 78% | 0.776 | 80% | 0.796 | S | S | * | * | trans | -123.7 | 161.4 | -161.4 | 50.8 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 54 | A | 32.1 | Very low | 38.4 | Very low | 92 Ų | 92 | 126.1 Ų | 126.1 | 76% | 0.76 | 79% | 0.789 | S | S | * | * | cis | -169.6 | -160.4 | -5.1 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 55 | P | 43.9 | Very low | 39.1 | Very low | 122 Ų | 122 | 131 Ų | 131 | 79% | 0.792 | 79% | 0.788 | S | S | * | * | cis | -129.9 | -174 | -8.4 | 44.5 | -26.8 | 0 | 0 | 0 | 114.9 | ||||
| 56 | P | 50.6 | Low | 40.1 | Very low | 111 Ų | 111 | 134 Ų | 134 | 72% | 0.721 | 79% | 0.789 | S | S | * | * | trans | -117 | -177 | -175.4 | 41.5 | -31.3 | 0 | 0 | 0 | 116.6 | ||||
| 57 | L | 35.3 | Very low | 41.4 | Very low | 157 Ų | 157 | 132 Ų | 132 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | trans | 81.1 | 142.3 | 176.6 | -50.8 | 173.5 | 0 | 0 | 0 | 114.7 | ||||
| 58 | S | 31.3 | Very low | 42.6 | Very low | 116 Ų | 116 | 132.2 Ų | 132.2 | 81% | 0.811 | 78% | 0.778 | S | S | * | * | cis | -143.8 | 170.8 | 29.2 | -60.3 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 59 | H | 37.7 | Very low | 43.8 | Very low | 185 Ų | 185 | 133.2 Ų | 133.2 | 86% | 0.856 | 78% | 0.776 | S | S | * | * | trans | -94.9 | 138.6 | 175.5 | -70.2 | -99.5 | 0 | 0 | 0 | 113.8 | ||||
| 60 | T | 35.6 | Very low | 45 | Very low | 136 Ų | 136 | 138.8 Ų | 138.8 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | trans | -143.2 | 148.1 | 142.1 | 46.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 61 | P | 44.8 | Very low | 45.4 | Very low | 135 Ų | 135 | 138.5 Ų | 138.5 | 88% | 0.877 | 78% | 0.781 | S | S | * | * | trans | -98.2 | 129.5 | 177.9 | 34.7 | -30 | 0 | 0 | 0 | 112.6 | ||||
| 62 | S | 37.5 | Very low | 46.6 | Very low | 103 Ų | 103 | 132.3 Ų | 132.3 | 72% | 0.72 | 77% | 0.769 | S | S | * | * | trans | -127.2 | 135.9 | 163.8 | 59.2 | 0 | 0 | 0 | 0 | 110.4 | D64 | S62-D64 PolarHBondContact O-N 3.06Š| ||
| 63 | S | 50.1 | Low | 47.5 | Very low | 118 Ų | 118 | 132.4 Ų | 132.4 | 83% | 0.825 | 77% | 0.767 | S | S | * | * | trans | -97.8 | 78.8 | -171.6 | 171.5 | 0 | 0 | 0 | 0 | 111.7 | F65 | S63-F65 PolarHBondContact O-N 3.45Š| ||
| 64 | D | 44.1 | Very low | 48 | Very low | 141 Ų | 141 | 138.1 Ų | 138.1 | 75% | 0.754 | 77% | 0.773 | S | S | * | * | trans | -88.5 | 79.5 | 176.2 | -72.6 | -66.1 | 0 | 0 | 0 | 112.1 | S62 Q66 | S62-D64 PolarHBondContact O-N 3.06Å; D64-Q66 PolarHBondContact O-N 3.11Å | ||
| 65 | F | 44.9 | Very low | 49.1 | Very low | 180 Ų | 180 | 141.9 Ų | 141.9 | 79% | 0.789 | 78% | 0.775 | S | S | * | * | trans | -75.8 | 96.1 | 171 | -170.5 | -83.7 | 0 | 0 | 0 | 109.5 | S63 P67 | S63-F65 PolarHBondContact O-N 3.45Å; F65-P67 VanDerWaalsContact O-CD 3.26Å; F65-P67 WeakPolarHBondContact O-CD 3.42Å | ||
| 66 | Q | 55.5 | Low | 49.2 | Very low | 180 Ų | 180 | 142.1 Ų | 142.1 | 84% | 0.841 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -71 | 116.8 | 174.4 | -81.8 | -172.5 | -31.8 | 0 | 0 | 110.9 | D64 | D64-Q66 PolarHBondContact O-N 3.11Š|
| 67 | P | 61.7 | Low | 49 | Very low | 100 Ų | 100 | 143.9 Ų | 143.9 | 65% | 0.649 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 151.4 | 171.9 | 31.5 | -34.7 | 0 | 0 | 0 | 110.7 | F65 Y69 | F65-P67 VanDerWaalsContact O-CD 3.26Å; F65-P67 WeakPolarHBondContact O-CD 3.42Å; P67-Y69 PolarHBondContact O-N 3.21Å |
| 68 | P | 59.3 | Low | 49.2 | Very low | 107 Ų | 107 | 142.2 Ų | 142.2 | 70% | 0.695 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 132.3 | 179.7 | 26.5 | -34.3 | 0 | 0 | 0 | 111.7 | F70 | P68-F70 PolarHBondContact O-N 3.43Š|
| 69 | Y | 61.6 | Low | 49.4 | Very low | 197 Ų | 197 | 147.5 Ų | 147.5 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 118.7 | 179 | 177.6 | -93.7 | 0 | 0 | 0 | 111.6 | P67 P71 | P67-Y69 PolarHBondContact O-N 3.21Å; Y69-P71 HydrophobicContact CE1-CB 4.41Å |
| 70 | F | 60.8 | Low | 49.4 | Very low | 178 Ų | 178 | 147.6 Ų | 147.6 | 78% | 0.781 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -92.1 | 129.4 | 167 | -88.5 | -100.8 | 0 | 0 | 0 | 110 | P68 | P68-F70 PolarHBondContact O-N 3.43Š|
| 71 | P | 60.9 | Low | 49.4 | Very low | 95 Ų | 95 | 149.9 Ų | 149.9 | 62% | 0.617 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 148.4 | 172.1 | 30.1 | -34.3 | 0 | 0 | 0 | 110.8 | Y69 | Y69-P71 HydrophobicContact CE1-CB 4.41Š|
| 72 | P | 62.1 | Low | 49 | Very low | 96 Ų | 96 | 148 Ų | 148 | 62% | 0.623 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 152.9 | 177.5 | 28.8 | -35.1 | 0 | 0 | 0 | 111.8 | ||
| 73 | P | 52.6 | Low | 49.1 | Very low | 120 Ų | 120 | 152 Ų | 152 | 78% | 0.779 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 139.8 | 176.7 | 28 | -34.6 | 0 | 0 | 0 | 111.2 | Q75 | P73-Q75 PolarHBondContact O-N 3.09Š|
| 74 | Y | 46.6 | Very low | 48.6 | Very low | 231 Ų | 231 | 152.8 Ų | 152.8 | 91% | 0.906 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 119.1 | 178.4 | -80.1 | -94.8 | 0 | 0 | 0 | 111.6 | ||
| 75 | Q | 54 | Low | 48.5 | Very low | 172 Ų | 172 | 150.5 Ų | 150.5 | 80% | 0.804 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 130.8 | 159 | -70.3 | -173.8 | -15.9 | 0 | 0 | 109.1 | P73 L77 | P73-Q75 PolarHBondContact O-N 3.09Å; Q75-L77 PolarHBondContact O-N 3.34Å |
| 76 | P | 45.6 | Very low | 48.3 | Very low | 127 Ų | 127 | 150.8 Ų | 150.8 | 83% | 0.825 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 116.3 | 172.9 | 28.8 | -32.3 | 0 | 0 | 0 | 109.8 | ||
| 77 | L | 46.2 | Very low | 47.9 | Very low | 147 Ų | 147 | 147.8 Ų | 147.8 | 77% | 0.77 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 140.6 | 169.9 | -71.4 | 169 | 0 | 0 | 0 | 110 | Q75 Y79 | Q75-L77 PolarHBondContact O-N 3.34Å; L77-Y79 PolarHBondContact O-N 2.98Å |
| 78 | P | 39.7 | Very low | 47.2 | Very low | 122 Ų | 122 | 149.8 Ų | 149.8 | 79% | 0.792 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 117.4 | 174.5 | 28.3 | -33.1 | 0 | 0 | 0 | 109.9 | H80 | P78-H80 PolarHBondContact O-N 3.43Š|
| 79 | Y | 35.4 | Very low | 46.7 | Very low | 227 Ų | 227 | 150.9 Ų | 150.9 | 89% | 0.89 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 126.7 | 173.2 | -95.1 | -97.4 | 0 | 0 | 0 | 110.5 | L77 Q81 | L77-Y79 PolarHBondContact O-N 2.98Å; Y79-Q81 PolarHBondContact O-N 3.32Å |
| 80 | H | 38.7 | Very low | 45.7 | Very low | 187 Ų | 187 | 148.7 Ų | 148.7 | 87% | 0.866 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 129.6 | 166 | -113.9 | -98.9 | 0 | 0 | 0 | 109.4 | P78 S82 | P78-H80 PolarHBondContact O-N 3.43Å; H80-S82 PolarHBondContact O-N 3.33Å; H80-S82 VanDerWaalsContact O-N 3.15Å |
| 81 | Q | 35.8 | Very low | 44.7 | Very low | 184 Ų | 184 | 145.7 Ų | 145.7 | 86% | 0.86 | 76% | 0.763 | S | S | * | * | trans | -77.7 | 99.3 | -178.4 | -170.9 | 174.7 | 37.5 | 0 | 0 | 110.5 | Y79 | Y79-Q81 PolarHBondContact O-N 3.32Š| ||
| 82 | S | 36 | Very low | 43.8 | Very low | 97 Ų | 97 | 146.6 Ų | 146.6 | 68% | 0.678 | 77% | 0.768 | S | S | * | * | trans | -72.8 | 132.3 | 168.5 | 49.3 | 0 | 0 | 0 | 0 | 110.6 | H80 | H80-S82 PolarHBondContact O-N 3.33Å; H80-S82 VanDerWaalsContact O-N 3.15Å | ||
| 83 | Q | 40.3 | Very low | 42.8 | Very low | 186 Ų | 186 | 152.2 Ų | 152.2 | 87% | 0.869 | 78% | 0.779 | S | S | * | * | trans | -86.8 | 110 | 177.2 | -67 | 172.4 | -72.2 | 0 | 0 | 110.3 | ||||
| 84 | D | 38 | Very low | 42.3 | Very low | 134 Ų | 134 | 151 Ų | 151 | 72% | 0.717 | 77% | 0.773 | S | S | * | * | trans | -79.9 | 125.1 | 173.1 | -86.5 | -59.1 | 0 | 0 | 0 | 111.6 | Y86 | D84-Y86 VanDerWaalsContact C-N 3.29Å; D84-Y86 PolarHBondContact O-N 3.49Å | ||
| 85 | P | 42.2 | Very low | 41.8 | Very low | 94 Ų | 94 | 147.8 Ų | 147.8 | 61% | 0.61 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | -4 | -171.2 | -22.3 | 34.8 | 0 | 0 | 0 | 117.3 | H88 | P85-H88 PolarHBondContact O-CE1 3.38Š|
| 86 | Y | 41.7 | Very low | 40.8 | Very low | 186 Ų | 186 | 146.3 Ų | 146.3 | 73% | 0.729 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.8 | 29 | -163.9 | -79.8 | -80.4 | 0 | 0 | 0 | 115.4 | D84 H88 | D84-Y86 VanDerWaalsContact C-N 3.29Å; D84-Y86 PolarHBondContact O-N 3.49Å; Y86-H88 PolarHBondContact O-N 2.64Å |
| 87 | S | 45.9 | Very low | 40.5 | Very low | 116 Ų | 116 | 146.5 Ų | 146.5 | 81% | 0.811 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70 | 14.9 | -177.2 | 54.6 | 0 | 0 | 0 | 0 | 116.7 | ||
| 88 | H | 48.9 | Very low | 39.9 | Very low | 143 Ų | 143 | 146.1 Ų | 146.1 | 66% | 0.662 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.7 | 19.1 | -166.8 | 51.3 | -95.4 | 0 | 0 | 0 | 115.3 | P85 Y86 | P85-H88 PolarHBondContact O-CE1 3.38Å; Y86-H88 PolarHBondContact O-N 2.64Å |
| 89 | V | 46.9 | Very low | 39.7 | Very low | 129 Ų | 129 | 148.2 Ų | 148.2 | 78% | 0.782 | 77% | 0.766 | S | S | * | * | trans | -99.3 | 116.8 | 161.9 | -80.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 90 | N | 42.6 | Very low | 39.6 | Very low | 151 Ų | 151 | 146.5 Ų | 146.5 | 81% | 0.807 | 77% | 0.766 | S | S | * | * | trans | -105.7 | 131.3 | -171.9 | -164.1 | 13.1 | 0 | 0 | 0 | 110.5 | ||||
| 91 | D | 39.2 | Very low | 39.6 | Very low | 115 Ų | 115 | 142.4 Ų | 142.4 | 62% | 0.615 | 76% | 0.756 | S | S | * | * | trans | -89.9 | 115.4 | -168.5 | -161.7 | -13.2 | 0 | 0 | 0 | 111.5 | Y93 S94 | D91-Y93 PolarHBondContact O-N 3Å; D91-S94 PolarHBondContact O-N 3.06Å; D91-S94 PolarHBondContact O-OG 3.39Å | ||
| 92 | P | 40.8 | Very low | 39.4 | Very low | 114 Ų | 114 | 142.5 Ų | 142.5 | 74% | 0.74 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | 15.5 | -161.6 | 28.8 | -37.9 | 0 | 0 | 0 | 117.1 | ||
| 93 | Y | 41.1 | Very low | 39.2 | Very low | 215 Ų | 215 | 146.3 Ų | 146.3 | 84% | 0.843 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.2 | 10.2 | 174.3 | -74.7 | -78.4 | 0 | 0 | 0 | 114.4 | D91 L95 | D91-Y93 PolarHBondContact O-N 3Å; Y93-L95 PolarHBondContact O-N 3.45Å |
| 94 | S | 43 | Very low | 38.8 | Very low | 93 Ų | 93 | 146 Ų | 146 | 65% | 0.65 | 76% | 0.762 | S | S | * | * | trans | -84.4 | 107.2 | -178.3 | -57.6 | 0 | 0 | 0 | 0 | 112.9 | D91 | D91-S94 PolarHBondContact O-N 3.06Å; D91-S94 PolarHBondContact O-OG 3.39Å | ||
| 95 | L | 35 | Very low | 38.9 | Very low | 164 Ų | 164 | 144.9 Ų | 144.9 | 86% | 0.859 | 76% | 0.762 | S | S | * | * | trans | -117.1 | 118.9 | 171.2 | -79.7 | 173.2 | 0 | 0 | 0 | 112.6 | Y93 | Y93-L95 PolarHBondContact O-N 3.45Š| ||
| 96 | N | 33.8 | Very low | 38.3 | Very low | 141 Ų | 141 | 153 Ų | 153 | 75% | 0.754 | 78% | 0.781 | S | S | * | * | trans | 52.6 | 102.2 | 164.8 | -70.4 | 1.9 | 0 | 0 | 0 | 120.2 | ||||
| 97 | P | 38.4 | Very low | 37.7 | Very low | 131 Ų | 131 | 148 Ų | 148 | 85% | 0.851 | 79% | 0.786 | S | S | * | * | trans | -111.4 | 107.7 | 139.1 | 33.1 | -21.7 | 0 | 0 | 0 | 110 | ||||
| 98 | L | 33.8 | Very low | 37 | Very low | 140 Ų | 140 | 150.3 Ų | 150.3 | 73% | 0.733 | 78% | 0.784 | S | S | * | * | trans | -117.3 | 119.9 | -179.7 | -145.1 | 82.1 | 0 | 0 | 0 | 112.6 | ||||
| 99 | H | 35.8 | Very low | 36.1 | Very low | 166 Ų | 166 | 153.2 Ų | 153.2 | 77% | 0.769 | 79% | 0.789 | S | S | * | * | trans | 63.3 | 109.2 | 170.2 | -65 | 113.5 | 0 | 0 | 0 | 120 | ||||
| 100 | Q | 33.2 | Very low | 35.2 | Very low | 190 Ų | 190 | 154.1 Ų | 154.1 | 89% | 0.888 | 79% | 0.785 | S | S | * | * | trans | -127.6 | 127 | 135 | -171.6 | -177.4 | 69.5 | 0 | 0 | 107.6 | ||||
| 101 | P | 39.3 | Very low | 34.5 | Very low | 101 Ų | 101 | 156.1 Ų | 156.1 | 66% | 0.656 | 78% | 0.781 | S | S | * | * | -138.6 | 179.7 | 120.3 | 41.2 | -29.2 | 0 | 0 | 0 | 110.5 | |||||
| 102 | Q | 31.1 | Very low | 34 | Very low | 186 Ų | 186 | 155.8 Ų | 155.8 | 87% | 0.869 | 78% | 0.776 | S | S | * | * | cis | -149.4 | 176.1 | 8.6 | -149.2 | 169.6 | 30.2 | 0 | 0 | 111 | ||||
| 103 | Q | 33.2 | Very low | 33.5 | Very low | 177 Ų | 177 | 157.8 Ų | 157.8 | 83% | 0.827 | 78% | 0.775 | S | S | * | * | trans | -77 | 157.1 | 179 | -67.4 | -77.6 | -3.5 | 0 | 0 | 113.9 | ||||
| 104 | H | 31.1 | Very low | 33.1 | Very low | 180 Ų | 180 | 154.3 Ų | 154.3 | 83% | 0.833 | 78% | 0.776 | S | S | * | * | trans | -77.7 | 157.6 | 168.4 | -61.4 | -67.9 | 0 | 0 | 0 | 112.4 | ||||
| 105 | P | 39.6 | Very low | 32.4 | Very low | 111 Ų | 111 | 153.2 Ų | 153.2 | 72% | 0.721 | 78% | 0.78 | S | S | * | * | -148.2 | 150 | 108.5 | 35.3 | -18.5 | 0 | 0 | 0 | 117.3 | |||||
| 106 | W | 29.2 | Very low | 32.2 | Very low | 264 Ų | 264 | 150.9 Ų | 150.9 | 100% | 1 | 78% | 0.777 | S | S | * | * | trans | 27.9 | 125.7 | 148.9 | -64.5 | 90.2 | 0 | 0 | 0 | 122.6 | ||||
| 107 | G | 30.8 | Very low | 32.1 | Very low | 81 Ų | 81 | 152.4 Ų | 152.4 | 84% | 0.835 | 78% | 0.78 | S | S | * | * | trans | -165.2 | 147.1 | 161.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 108 | Q | 30.6 | Very low | 32 | Very low | 164 Ų | 164 | 153.4 Ų | 153.4 | 77% | 0.766 | 78% | 0.783 | S | S | * | * | trans | -102.7 | 164.9 | 177.4 | -86.7 | -160.1 | -5.2 | 0 | 0 | 112.7 | ||||
| 109 | R | 28.9 | Very low | 31.9 | Very low | 204 Ų | 204 | 150.2 Ų | 150.2 | 77% | 0.77 | 78% | 0.784 | S | S | * | * | trans | 70.1 | 164.2 | 161.3 | -70.7 | 165.1 | -167.3 | -96.1 | 9.5 | 115.3 | ||||
| 110 | Q | 28.7 | Very low | 31.7 | Very low | 149 Ų | 149 | 147.7 Ų | 147.7 | 70% | 0.696 | 79% | 0.785 | S | S | * | * | cis | -178.4 | 161.4 | -28.2 | -179.4 | 173.7 | -2.9 | 0 | 0 | 105.7 | ||||
| 111 | R | 28.4 | Very low | 31.8 | Very low | 192 Ų | 192 | 146.5 Ų | 146.5 | 73% | 0.725 | 78% | 0.784 | S | S | * | * | trans | 75.6 | 114 | 165.7 | -95.4 | -162.3 | 155.3 | -112.6 | -6.6 | 119.6 | ||||
| 112 | Q | 28.7 | Very low | 31.6 | Very low | 108 Ų | 108 | 149.6 Ų | 149.6 | 51% | 0.505 | 79% | 0.794 | S | S | . | * | 87.6 | 112 | 108.9 | -145.3 | 124.2 | -8.1 | 0 | 0 | 122.3 | |||||
| 113 | E | 29.9 | Very low | 32.3 | Very low | 157 Ų | 157 | 146.2 Ų | 146.2 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | trans | 83.6 | 161.8 | 133.3 | -96.1 | 163.8 | -127.5 | 0 | 0 | 123.9 | ||||
| 114 | V | 31.9 | Very low | 32.5 | Very low | 141 Ų | 141 | 145.4 Ų | 145.4 | 86% | 0.855 | 79% | 0.785 | S | S | * | * | trans | 67.5 | 121.4 | -179.6 | -161.8 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 115 | G | 29.1 | Very low | 33 | Very low | 71 Ų | 71 | 142.6 Ų | 142.6 | 73% | 0.732 | 78% | 0.782 | S | S | * | * | cis | 134.1 | 97.2 | -7.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 116 | S | 31.1 | Very low | 32.7 | Very low | 114 Ų | 114 | 148.4 Ų | 148.4 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | trans | -172.8 | 101.6 | 162 | -169.2 | 0 | 0 | 0 | 0 | 107 | ||||
| 117 | E | 31.5 | Very low | 32.9 | Very low | 174 Ų | 174 | 140.8 Ų | 140.8 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | 74.6 | 83.4 | 76.9 | -70.1 | -69.2 | 102.4 | 0 | 0 | 114.2 | |||||
| 118 | T | 36.1 | Very low | 33 | Very low | 151 Ų | 151 | 141.9 Ų | 141.9 | 93% | 0.926 | 78% | 0.784 | S | S | * | * | trans | -171.8 | 145.1 | 134.2 | 15.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 119 | G | 32 | Very low | 33.3 | Very low | 73 Ų | 73 | 142 Ų | 142 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | -94.9 | -161.8 | -172.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 120 | S | 32.1 | Very low | 34.1 | Very low | 113 Ų | 113 | 137.7 Ų | 137.7 | 79% | 0.79 | 79% | 0.788 | S | S | * | * | cis | -164.8 | 155.7 | 0.3 | -144.1 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 121 | L | 34.8 | Very low | 34.3 | Very low | 165 Ų | 165 | 138.9 Ų | 138.9 | 86% | 0.864 | 79% | 0.794 | S | S | * | * | trans | 71.6 | 144.8 | 160.1 | -55.6 | 179.9 | 0 | 0 | 0 | 121.6 | ||||
| 122 | L | 35.1 | Very low | 34.4 | Very low | 166 Ų | 166 | 138.3 Ų | 138.3 | 87% | 0.869 | 80% | 0.804 | S | S | * | * | trans | -102.1 | -168.8 | 176 | -65.9 | 161.5 | 0 | 0 | 0 | 109 | ||||
| 123 | P | 44.9 | Very low | 34.5 | Very low | 116 Ų | 116 | 138.7 Ų | 138.7 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | cis | -132 | 177.7 | -7.7 | 26.6 | -2.6 | 0 | 0 | 0 | 115.4 | ||||
| 124 | Q | 37.2 | Very low | 34.6 | Very low | 159 Ų | 159 | 134.6 Ų | 134.6 | 74% | 0.743 | 82% | 0.818 | S | S | * | * | trans | -81.3 | 160.3 | 161.1 | -161.5 | -160.2 | 87 | 0 | 0 | 111 | ||||
| 125 | P | 43.2 | Very low | 34.8 | Very low | 121 Ų | 121 | 136.1 Ų | 136.1 | 79% | 0.786 | 82% | 0.82 | S | S | * | * | trans | -129 | 159.1 | 135.8 | 36.9 | -28.8 | 0 | 0 | 0 | 114.6 | ||||
| 126 | R | 32 | Very low | 35.2 | Very low | 233 Ų | 233 | 139.6 Ų | 139.6 | 88% | 0.879 | 82% | 0.823 | S | S | * | * | trans | -78.1 | 155.6 | -176.5 | -67.1 | 168.1 | 159.1 | 134.5 | -8.9 | 113.2 | ||||
| 127 | A | 34 | Very low | 35.9 | Very low | 105 Ų | 105 | 139.7 Ų | 139.7 | 87% | 0.868 | 82% | 0.82 | S | S | * | * | trans | -120.2 | 153.1 | 150 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 128 | A | 32.7 | Very low | 36 | Very low | 103 Ų | 103 | 141.7 Ų | 141.7 | 85% | 0.851 | 82% | 0.82 | S | S | * | * | trans | -113.5 | 156.5 | -171.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 129 | L | 36.8 | Very low | 36 | Very low | 168 Ų | 168 | 146.3 Ų | 146.3 | 88% | 0.88 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 125.5 | -179.5 | -124.8 | 158 | 0 | 0 | 0 | 109.9 | ||
| 130 | P | 45 | Very low | 36 | Very low | 112 Ų | 112 | 149.1 Ų | 149.1 | 73% | 0.727 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 139.5 | 170.2 | -9.1 | 25.8 | 0 | 0 | 0 | 110.9 | ||
| 131 | Q | 32.9 | Very low | 36 | Very low | 175 Ų | 175 | 154.7 Ų | 154.7 | 82% | 0.818 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -94.2 | 145.3 | 160.5 | -73.5 | -153.2 | -18.6 | 0 | 0 | 110.4 | ||
| 132 | L | 32.1 | Very low | 35.9 | Very low | 180 Ų | 180 | 154.5 Ų | 154.5 | 94% | 0.942 | 82% | 0.818 | S | S | * | * | trans | -137.5 | 137.3 | 155.9 | -75.8 | 178.4 | 0 | 0 | 0 | 109.3 | ||||
| 133 | S | 31.2 | Very low | 35.8 | Very low | 116 Ų | 116 | 152.5 Ų | 152.5 | 81% | 0.811 | 82% | 0.818 | S | S | * | * | trans | -125.1 | 141.4 | 175.5 | -64 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 134 | G | 31.4 | Very low | 35.2 | Very low | 70 Ų | 70 | 152.9 Ų | 152.9 | 72% | 0.722 | 82% | 0.818 | S | S | * | * | trans | 145.8 | 131.1 | 156.4 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 135 | L | 35.6 | Very low | 35 | Very low | 173 Ų | 173 | 156.5 Ų | 156.5 | 91% | 0.906 | 83% | 0.825 | S | S | * | * | trans | 75.6 | 94.4 | 145.2 | -49.7 | -175.6 | 0 | 0 | 0 | 119.5 | ||||
| 136 | D | 37.6 | Very low | 34.6 | Very low | 145 Ų | 145 | 160.2 Ų | 160.2 | 78% | 0.775 | 82% | 0.823 | S | S | * | * | trans | -71.7 | 141.5 | 147.8 | 172.3 | 3.4 | 0 | 0 | 0 | 110.1 | R138 | D136-R138 PolarHBondContact OD1-N 3.22Š| ||
| 137 | P | 44.8 | Very low | 35 | Very low | 115 Ų | 115 | 154.8 Ų | 154.8 | 75% | 0.747 | 82% | 0.818 | S | S | * | * | trans | -138.9 | 107.5 | 135.3 | 35.2 | -20.7 | 0 | 0 | 0 | 115.5 | ||||
| 138 | R | 35.4 | Very low | 34.9 | Very low | 216 Ų | 216 | 155.8 Ų | 155.8 | 82% | 0.815 | 81% | 0.809 | S | S | * | * | trans | 45.7 | 120.5 | 138.8 | -71 | -174 | 166.2 | 111.7 | -2.3 | 119.1 | D136 | D136-R138 PolarHBondContact OD1-N 3.22Š| ||
| 139 | R | 34.5 | Very low | 34.9 | Very low | 249 Ų | 249 | 156.8 Ų | 156.8 | 94% | 0.94 | 80% | 0.804 | S | S | * | * | trans | -138.6 | 116.7 | 141.3 | -86.7 | -166.4 | 172.3 | -161.2 | -2.2 | 111.9 | ||||
| 140 | D | 33.5 | Very low | 34.8 | Very low | 131 Ų | 131 | 156.7 Ų | 156.7 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | trans | -70.4 | 151.1 | 162.1 | -55 | -92.7 | 0 | 0 | 0 | 111.1 | ||||
| 141 | Y | 32 | Very low | 34.2 | Very low | 230 Ų | 230 | 159.2 Ų | 159.2 | 90% | 0.902 | 81% | 0.81 | S | S | * | * | trans | -151.6 | 153 | 145.7 | -128.4 | -86.6 | 0 | 0 | 0 | 111.5 | ||||
| 142 | H | 31.6 | Very low | 34.3 | Very low | 162 Ų | 162 | 159 Ų | 159 | 75% | 0.75 | 81% | 0.809 | S | S | * | * | trans | -85.5 | 150.6 | -158.8 | -72.2 | -92.4 | 0 | 0 | 0 | 116.5 | ||||
| 143 | S | 32.5 | Very low | 34.1 | Very low | 124 Ų | 124 | 156 Ų | 156 | 87% | 0.867 | 80% | 0.803 | S | S | * | * | trans | -60.9 | 125.2 | 163.5 | -43.2 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 144 | V | 33.2 | Very low | 34 | Very low | 124 Ų | 124 | 154.8 Ų | 154.8 | 75% | 0.752 | 80% | 0.8 | S | S | * | * | trans | -136.4 | 103.2 | 169.5 | -175.8 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 145 | R | 32 | Very low | 34.1 | Very low | 234 Ų | 234 | 160 Ų | 160 | 88% | 0.883 | 81% | 0.805 | S | S | * | * | trans | 57.1 | 124.7 | 149.4 | -66.8 | -171 | 176.3 | -153 | -0.9 | 122 | ||||
| 146 | R | 35.3 | Very low | 33.9 | Very low | 199 Ų | 199 | 161.3 Ų | 161.3 | 75% | 0.751 | 81% | 0.807 | S | S | * | * | trans | -61.5 | 156.6 | 140.4 | -64.7 | 177.8 | 176.5 | 176.9 | -2.5 | 111.5 | D148 | R146-D148 WeakPolarHBondContact CD-OD2 3.28Å; R146-D148 IonicContact NH1-OD1 3.73Å; R146-D148 IonicContact NH1-OD2 3.69Å | ||
| 147 | P | 40.6 | Very low | 33.5 | Very low | 119 Ų | 119 | 157.8 Ų | 157.8 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | -100.3 | 110.2 | 145.1 | 20.6 | -2.6 | 0 | 0 | 0 | 110.5 | ||||
| 148 | D | 32.4 | Very low | 33 | Very low | 127 Ų | 127 | 160.8 Ų | 160.8 | 68% | 0.679 | 81% | 0.813 | S | S | * | * | trans | -81.3 | 124.1 | 160.8 | -77.1 | -84.6 | 0 | 0 | 0 | 108.3 | R146 | R146-D148 WeakPolarHBondContact CD-OD2 3.28Å; R146-D148 IonicContact NH1-OD1 3.73Å; R146-D148 IonicContact NH1-OD2 3.69Å | ||
| 149 | V | 33.1 | Very low | 32.9 | Very low | 124 Ų | 124 | 157.3 Ų | 157.3 | 75% | 0.752 | 81% | 0.81 | S | S | * | * | trans | -132.8 | 90.9 | 172.5 | -175.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 150 | L | 34.5 | Very low | 32.9 | Very low | 166 Ų | 166 | 151 Ų | 151 | 87% | 0.869 | 81% | 0.805 | S | S | * | * | trans | -107.9 | 120.3 | 159.6 | -78.8 | 171.9 | 0 | 0 | 0 | 108 | ||||
| 151 | L | 32.9 | Very low | 32.9 | Very low | 164 Ų | 164 | 148 Ų | 148 | 86% | 0.859 | 81% | 0.805 | S | S | * | * | trans | -138.5 | 130.4 | 169.6 | -117.9 | 167.4 | 0 | 0 | 0 | 108.9 | ||||
| 152 | H | 33.4 | Very low | 33 | Very low | 170 Ų | 170 | 146.2 Ų | 146.2 | 79% | 0.787 | 81% | 0.807 | S | S | * | * | trans | -88.8 | 135.2 | -175.6 | -72.3 | 46 | 0 | 0 | 0 | 111 | ||||
| 153 | S | 28.3 | Very low | 33 | Very low | 118 Ų | 118 | 141.3 Ų | 141.3 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | trans | -157 | 116.9 | 149.3 | -86.8 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 154 | A | 30 | Very low | 33.1 | Very low | 91 Ų | 91 | 143.3 Ų | 143.3 | 75% | 0.752 | 80% | 0.801 | S | S | * | * | 109.1 | 136.8 | 53.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 155 | H | 33.9 | Very low | 33 | Very low | 179 Ų | 179 | 142.2 Ų | 142.2 | 83% | 0.829 | 80% | 0.799 | S | S | * | * | trans | -45.1 | 134.3 | -169.7 | -54.9 | -102.2 | 0 | 0 | 0 | 116.1 | ||||
| 156 | H | 31.3 | Very low | 33.1 | Very low | 201 Ų | 201 | 138.9 Ų | 138.9 | 93% | 0.931 | 80% | 0.798 | S | S | * | * | trans | -145.4 | 142.4 | 131.2 | -85.8 | -71.2 | 0 | 0 | 0 | 109.4 | ||||
| 157 | G | 29.3 | Very low | 33 | Very low | 70 Ų | 70 | 134.7 Ų | 134.7 | 72% | 0.722 | 80% | 0.799 | S | S | * | * | trans | -131 | 154.1 | 162 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 158 | L | 34.2 | Very low | 32.7 | Very low | 179 Ų | 179 | 136.3 Ų | 136.3 | 94% | 0.937 | 80% | 0.801 | S | S | * | * | trans | -154.6 | 152.3 | 166.7 | -109.5 | 174.4 | 0 | 0 | 0 | 109.9 | ||||
| 159 | D | 31.9 | Very low | 32.7 | Very low | 142 Ų | 142 | 138.2 Ų | 138.2 | 76% | 0.759 | 81% | 0.805 | S | S | * | * | trans | -95.9 | 144.3 | 171.6 | 172.2 | 44.1 | 0 | 0 | 0 | 110.1 | ||||
| 160 | S | 35.3 | Very low | 32.5 | Very low | 117 Ų | 117 | 135.1 Ų | 135.1 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | 167 | 141.3 | 163.6 | -77.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 161 | G | 33.2 | Very low | 32.5 | Very low | 69 Ų | 69 | 136 Ų | 136 | 71% | 0.711 | 80% | 0.802 | S | S | * | * | cis | 120.9 | 56.9 | 3.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 162 | M | 35.1 | Very low | 32.2 | Very low | 191 Ų | 191 | 131.5 Ų | 131.5 | 94% | 0.941 | 80% | 0.796 | S | S | * | * | trans | -158.7 | 145.5 | 173.8 | -150.8 | 63.3 | 120.3 | 0 | 0 | 110.4 | ||||
| 163 | G | 31.1 | Very low | 32.2 | Very low | 60 Ų | 60 | 132.1 Ų | 132.1 | 62% | 0.619 | 80% | 0.798 | S | S | * | * | cis | 152.8 | 56.2 | -6.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 164 | D | 34.2 | Very low | 33 | Very low | 165 Ų | 165 | 132.3 Ų | 132.3 | 88% | 0.882 | 80% | 0.797 | S | S | * | * | trans | 66.8 | 172.8 | 152.6 | -129.6 | -31.1 | 0 | 0 | 0 | 120.8 | ||||
| 165 | S | 30.6 | Very low | 33 | Very low | 101 Ų | 101 | 131.1 Ų | 131.1 | 71% | 0.706 | 79% | 0.794 | S | S | * | * | trans | 68.9 | 141.5 | -176.5 | -94.2 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 166 | L | 33.9 | Very low | 32.9 | Very low | 164 Ų | 164 | 130.6 Ų | 130.6 | 86% | 0.859 | 79% | 0.793 | S | S | * | * | cis | -118.5 | 159.3 | 18.3 | -67.7 | 163.8 | 0 | 0 | 0 | 113.9 | ||||
| 167 | S | 33.8 | Very low | 32.9 | Very low | 111 Ų | 111 | 128.6 Ų | 128.6 | 78% | 0.776 | 79% | 0.785 | S | S | * | * | trans | -147.1 | 127.3 | 173.2 | -74.4 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 168 | L | 33.6 | Very low | 32.9 | Very low | 153 Ų | 153 | 133.2 Ų | 133.2 | 80% | 0.801 | 79% | 0.788 | S | S | * | * | trans | 170.7 | 144.2 | 164 | -119.6 | 57.2 | 0 | 0 | 0 | 107.3 | ||||
| 169 | H | 33.3 | Very low | 32.8 | Very low | 168 Ų | 168 | 129.8 Ų | 129.8 | 78% | 0.778 | 77% | 0.773 | S | S | * | * | cis | -124.3 | 172.1 | -8.5 | -78.9 | -98.3 | 0 | 0 | 0 | 107.8 | ||||
| 170 | G | 28.7 | Very low | 32.6 | Very low | 58 Ų | 58 | 131.9 Ų | 131.9 | 60% | 0.598 | 78% | 0.779 | S | S | * | * | cis | 116.6 | 130.9 | 6.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 171 | I | 34.2 | Very low | 32.4 | Very low | 184 Ų | 184 | 131.5 Ų | 131.5 | 94% | 0.944 | 78% | 0.776 | S | S | * | * | trans | 76.3 | 129.6 | -174.4 | -47.9 | 165 | 0 | 0 | 0 | 113.4 | ||||
| 172 | G | 27.3 | Very low | 32.4 | Very low | 71 Ų | 71 | 135.3 Ų | 135.3 | 73% | 0.732 | 79% | 0.785 | S | S | * | * | cis | 178.7 | 148 | -7.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 173 | H | 33.2 | Very low | 32.3 | Very low | 182 Ų | 182 | 134.9 Ų | 134.9 | 84% | 0.843 | 78% | 0.781 | S | S | * | * | trans | -95.6 | 154.7 | 174.7 | -97.7 | -69.3 | 0 | 0 | 0 | 111.8 | ||||
| 174 | P | 43.9 | Very low | 32.4 | Very low | 122 Ų | 122 | 139.8 Ų | 139.8 | 79% | 0.792 | 79% | 0.793 | S | S | * | * | -110.7 | -179 | 88.6 | -9.2 | 29.5 | 0 | 0 | 0 | 112.7 | |||||
| 175 | G | 30.8 | Very low | 32.3 | Very low | 67 Ų | 67 | 136 Ų | 136 | 69% | 0.691 | 79% | 0.785 | S | S | * | * | cis | 112.3 | 132.2 | 21 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 176 | M | 32.9 | Very low | 32.3 | Very low | 167 Ų | 167 | 138.8 Ų | 138.8 | 82% | 0.823 | 79% | 0.792 | S | S | * | * | cis | -144 | -178 | 13.3 | -69.4 | 155 | 57.6 | 0 | 0 | 111.5 | ||||
| 177 | E | 30.7 | Very low | 32.2 | Very low | 160 Ų | 160 | 138 Ų | 138 | 75% | 0.748 | 79% | 0.789 | S | S | * | * | trans | 6.8 | 156.9 | 146.7 | -69.5 | 150.2 | 151.3 | 0 | 0 | 121.2 | ||||
| 178 | E | 29.3 | Very low | 32.1 | Very low | 167 Ų | 167 | 138.2 Ų | 138.2 | 78% | 0.78 | 79% | 0.79 | S | S | * | * | cis | -160.5 | 146.3 | 27.1 | -142.3 | -168.9 | 143.8 | 0 | 0 | 113.9 | ||||
| 179 | V | 31.3 | Very low | 31.8 | Very low | 106 Ų | 106 | 134.1 Ų | 134.1 | 64% | 0.642 | 79% | 0.785 | S | S | * | * | trans | 48.5 | 143.6 | 137.6 | 165.7 | 0 | 0 | 0 | 0 | 125.4 | ||||
| 180 | Q | 27.9 | Very low | 31.8 | Very low | 186 Ų | 186 | 135 Ų | 135 | 87% | 0.869 | 79% | 0.791 | S | S | * | * | trans | 103.9 | 148.5 | 148.7 | -102.4 | 155.7 | 32.4 | 0 | 0 | 122.9 | ||||
| 181 | S | 31.5 | Very low | 32 | Very low | 110 Ų | 110 | 139.2 Ų | 139.2 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | trans | -127.9 | 150.7 | -168.1 | -22.9 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 182 | V | 32.7 | Very low | 31.9 | Very low | 148 Ų | 148 | 137.9 Ų | 137.9 | 90% | 0.897 | 79% | 0.794 | S | S | * | * | trans | -154.6 | 168.6 | 153.3 | -111.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 183 | E | 33.1 | Very low | 32.3 | Very low | 183 Ų | 183 | 140.9 Ų | 140.9 | 86% | 0.855 | 79% | 0.793 | S | S | * | * | trans | -105.5 | 157.5 | -161 | -60.5 | 158 | 109.1 | 0 | 0 | 114.2 | ||||
| 184 | D | 32.8 | Very low | 32.2 | Very low | 162 Ų | 162 | 139.9 Ų | 139.9 | 87% | 0.866 | 79% | 0.794 | S | S | * | * | trans | 40.6 | 159.4 | 143.6 | -109.3 | -51 | 0 | 0 | 0 | 125.9 | ||||
| 185 | A | 31.9 | Very low | 31.8 | Very low | 87 Ų | 87 | 142 Ų | 142 | 72% | 0.719 | 79% | 0.793 | S | S | * | * | trans | 59.6 | 103.3 | 156.3 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 186 | N | 30.8 | Very low | 31.9 | Very low | 159 Ų | 159 | 144.5 Ų | 144.5 | 85% | 0.85 | 80% | 0.8 | S | S | * | * | -146 | 141.6 | 117.5 | -154.4 | -11.1 | 0 | 0 | 0 | 113 | |||||
| 187 | N | 32.8 | Very low | 32 | Very low | 148 Ų | 148 | 143.2 Ų | 143.2 | 79% | 0.791 | 80% | 0.801 | S | S | * | * | trans | -144.5 | 117.4 | 176.9 | 168.9 | 27.6 | 0 | 0 | 0 | 109.5 | ||||
| 188 | S | 31.6 | Very low | 32.5 | Very low | 114 Ų | 114 | 143 Ų | 143 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | trans | -165.4 | 138.1 | 167.1 | -86.6 | 0 | 0 | 0 | 0 | 113 | ||||
| 189 | G | 28.1 | Very low | 33.3 | Very low | 68 Ų | 68 | 145.5 Ų | 145.5 | 70% | 0.701 | 81% | 0.812 | S | S | * | * | trans | 96.4 | 81.4 | 143.9 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 190 | M | 32 | Very low | 33.4 | Very low | 185 Ų | 185 | 149.3 Ų | 149.3 | 91% | 0.911 | 82% | 0.82 | S | S | * | * | -159.3 | 143 | 97.4 | -157.1 | 59.4 | 70.5 | 0 | 0 | 110.9 | |||||
| 191 | N | 32.3 | Very low | 33.8 | Very low | 147 Ų | 147 | 146.7 Ų | 146.7 | 79% | 0.786 | 82% | 0.816 | S | S | * | * | trans | -152.3 | 120.7 | 178.5 | -170.6 | -5.8 | 0 | 0 | 0 | 108.8 | ||||
| 192 | L | 32.5 | Very low | 33.9 | Very low | 156 Ų | 156 | 146.9 Ų | 146.9 | 82% | 0.817 | 82% | 0.815 | S | S | * | * | trans | -154 | 130.3 | 169.5 | -143 | 72 | 0 | 0 | 0 | 111.4 | ||||
| 193 | L | 37 | Very low | 34.4 | Very low | 135 Ų | 135 | 146.3 Ų | 146.3 | 71% | 0.707 | 81% | 0.812 | S | S | * | * | trans | 2.4 | 141.2 | 161.7 | -81.8 | 66.3 | 0 | 0 | 0 | 118.6 | ||||
| 194 | D | 31 | Very low | 34.7 | Very low | 161 Ų | 161 | 142 Ų | 142 | 86% | 0.861 | 80% | 0.8 | S | S | * | * | -141.9 | 172.6 | 66.9 | -146.4 | -8.4 | 0 | 0 | 0 | 117.2 | |||||
| 195 | Q | 34.3 | Very low | 35.1 | Very low | 166 Ų | 166 | 140.5 Ų | 140.5 | 78% | 0.776 | 80% | 0.798 | S | S | * | * | trans | -122.3 | 120.1 | -158.2 | -165.4 | -176.7 | 122.6 | 0 | 0 | 111 | ||||
| 196 | S | 33.4 | Very low | 35.4 | Very low | 120 Ų | 120 | 145.2 Ų | 145.2 | 84% | 0.839 | 80% | 0.803 | S | S | * | * | trans | -149.6 | 143.3 | 167 | 61.9 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 197 | V | 34.6 | Very low | 35.6 | Very low | 139 Ų | 139 | 141.7 Ų | 141.7 | 84% | 0.842 | 79% | 0.791 | S | S | * | * | trans | -104.7 | 108.5 | -176.3 | 177.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 198 | I | 41.1 | Very low | 36.3 | Very low | 156 Ų | 156 | 139.4 Ų | 139.4 | 80% | 0.8 | 78% | 0.782 | S | S | * | * | trans | -154.6 | 136.8 | 157.2 | -100.6 | 143 | 0 | 0 | 0 | 108.9 | K200 | I198-K200 PolarHBondContact O-N 3.18Š| ||
| 199 | K | 46.1 | Very low | 36.6 | Very low | 219 Ų | 219 | 138.2 Ų | 138.2 | 95% | 0.952 | 77% | 0.77 | S | S | * | * | trans | -71.1 | 108.9 | 175.5 | -73.4 | 174.3 | 176.6 | 171.7 | 0 | 110 | ||||
| 200 | K | 34.5 | Very low | 37.1 | Very low | 187 Ų | 187 | 139.5 Ų | 139.5 | 81% | 0.813 | 77% | 0.768 | S | S | * | * | trans | -123.4 | 122.8 | 168.5 | -157.3 | 171 | -172.1 | 175.4 | 0 | 109.7 | I198 P202 | I198-K200 PolarHBondContact O-N 3.18Å; K200-P202 WeakPolarHBondContact O-CD 3.44Å | ||
| 201 | V | 35.3 | Very low | 37.8 | Very low | 130 Ų | 130 | 133 Ų | 133 | 79% | 0.788 | 74% | 0.737 | S | S | * | * | trans | -71 | 122.8 | -177.4 | 179.1 | 0 | 0 | 0 | 0 | 109.6 | V203 | V201-V203 PolarHBondContact O-N 3.03Š| ||
| 202 | P | 33.5 | Very low | 38.2 | Very low | 115 Ų | 115 | 131.5 Ų | 131.5 | 75% | 0.747 | 73% | 0.726 | S | S | * | * | trans | -70.5 | 121.1 | 174.3 | -17.5 | 32.1 | 0 | 0 | 0 | 110.6 | K200 P204 | K200-P202 WeakPolarHBondContact O-CD 3.44Å; P202-P204 WeakPolarHBondContact O-CD 3.35Å | ||
| 203 | V | 44.6 | Very low | 38.8 | Very low | 136 Ų | 136 | 131.1 Ų | 131.1 | 82% | 0.824 | 72% | 0.722 | S | S | * | * | trans | -85.3 | 113.7 | 164.3 | -143.3 | 0 | 0 | 0 | 0 | 106.7 | V201 | V201-V203 PolarHBondContact O-N 3.03Š| ||
| 204 | P | 37.6 | Very low | 38.4 | Very low | 93 Ų | 93 | 131.6 Ų | 131.6 | 60% | 0.604 | 73% | 0.725 | S | S | * | * | trans | -74.5 | 130.6 | -173.2 | 28 | -33.8 | 0 | 0 | 0 | 111 | P202 K206 | P202-P204 WeakPolarHBondContact O-CD 3.35Å; P204-K206 PolarHBondContact O-N 3.05Å; P204-K206 VanDerWaalsContact O-N 3.07Å | ||
| 205 | P | 41.6 | Very low | 38.8 | Very low | 129 Ų | 129 | 133.2 Ų | 133.2 | 84% | 0.838 | 73% | 0.725 | S | S | * | * | trans | -67.1 | 109.2 | 170.2 | 28.1 | -32.5 | 0 | 0 | 0 | 108.7 | S207 | P205-S207 PolarHBondContact O-N 3.29Š| ||
| 206 | K | 38.7 | Very low | 38.9 | Very low | 187 Ų | 187 | 132 Ų | 132 | 81% | 0.813 | 72% | 0.723 | S | S | * | * | trans | -73.2 | 98.6 | 176.7 | -75.7 | -174.1 | 176.5 | -179.6 | 0 | 109.8 | P204 V208 | P204-K206 PolarHBondContact O-N 3.05Å; P204-K206 VanDerWaalsContact O-N 3.07Å; K206-V208 PolarHBondContact O-N 3.01Å | ||
| 207 | S | 35.5 | Very low | 39 | Very low | 85 Ų | 85 | 130.2 Ų | 130.2 | 59% | 0.594 | 72% | 0.724 | S | S | * | * | trans | -46.1 | 124.8 | 166.8 | 169.7 | 0 | 0 | 0 | 0 | 111 | P205 T209 | P205-S207 PolarHBondContact O-N 3.29Å; S207-T209 WeakPolarHBondContact OG-CB 3.45Å; S207-T209 PolarHBondContact OG-N 2.64Å; S207-T209 PolarHBondContact OG-OG1 3.48Å | ||
| 208 | V | 47.8 | Very low | 39.2 | Very low | 100 Ų | 100 | 132.6 Ų | 132.6 | 61% | 0.606 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88 | 9.9 | 173.1 | -66.1 | 0 | 0 | 0 | 0 | 112.4 | K206 S210 S393 | K206-V208 PolarHBondContact O-N 3.01Å; V208-S210 VanDerWaalsContact C-N 3.28Å; V208-S210 PolarHBondContact O-N 3.31Å; V208-S393 PolarHBondContact O-OG 2.89Å |
| 209 | T | 38.1 | Very low | 39.2 | Very low | 89 Ų | 89 | 133.3 Ų | 133.3 | 55% | 0.546 | 73% | 0.728 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -76.1 | -15.3 | -179.4 | -38.5 | 0 | 0 | 0 | 0 | 112.5 | S207 L211 | S207-T209 WeakPolarHBondContact OG-CB 3.45Å; S207-T209 PolarHBondContact OG-N 2.64Å; S207-T209 PolarHBondContact OG-OG1 3.48Å; T209-L211 VanDerWaalsContact C-N 3.27Å; T209-L211 PolarHBondContact O-N 3.09Å; T209-L211 VanDerWaalsContact O-N 3.16Å |
| 210 | S | 38.5 | Very low | 38.9 | Very low | 95 Ų | 95 | 126 Ų | 126 | 66% | 0.664 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89 | 50.5 | 177 | -159 | 0 | 0 | 0 | 0 | 113 | V208 | V208-S210 VanDerWaalsContact C-N 3.28Å; V208-S210 PolarHBondContact O-N 3.31Å |
| 211 | L | 46.6 | Very low | 39.2 | Very low | 49 Ų | 49 | 121.4 Ų | 121.4 | 26% | 0.257 | 72% | 0.72 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -110.9 | -5.4 | 161.7 | -69.5 | -177.4 | 0 | 0 | 0 | 112.6 | T209 M213 P259 H397 | T209-L211 VanDerWaalsContact C-N 3.27Å; T209-L211 PolarHBondContact O-N 3.09Å; T209-L211 VanDerWaalsContact O-N 3.16Å; L211-M213 PolarHBondContact O-N 3.14Å; L211-P259 HydrophobicContact CD2-CB 4.42Å; L211-H397 HydrophobicContact CD1-CB 4.28Å |
| 212 | M | 40.2 | Very low | 40.2 | Very low | 114 Ų | 114 | 120.5 Ų | 120.5 | 56% | 0.562 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -61.3 | 127.8 | 163.7 | -59.7 | -173.1 | 112.3 | 0 | 0 | 108.1 | N214 P389 | M212-N214 PolarHBondContact O-N 3.26Å; M212-N214 VanDerWaalsContact O-N 3.08Å; M212-P389 HydrophobicContact CE-CB 3.82Å; M212-P389 HydrophobicContact CE-CG 3.92Å; M212-P389 HydrophobicContact SD-CB 4.3Å |
| 213 | M | 44.5 | Very low | 41.7 | Very low | 149 Ų | 149 | 120.6 Ų | 120.6 | 73% | 0.734 | 71% | 0.713 | S | S | * | * | trans | -66.6 | 113.4 | -173 | -70.7 | -169.5 | 173.4 | 0 | 0 | 110.5 | L211 K215 P377 | L211-M213 PolarHBondContact O-N 3.14Å; M213-K215 VanDerWaalsContact C-N 3.3Å; M213-K215 PolarHBondContact O-N 3.37Å; M213-P377 HydrophobicContact CE-CG 3.8Å | ||
| 214 | N | 29.8 | Very low | 43.4 | Very low | 144 Ų | 144 | 115.9 Ų | 115.9 | 77% | 0.77 | 69% | 0.685 | S | S | * | * | trans | -61.2 | 95.1 | 167.5 | -94.1 | -5.4 | 0 | 0 | 0 | 109.6 | M212 D216 | M212-N214 PolarHBondContact O-N 3.26Å; M212-N214 VanDerWaalsContact O-N 3.08Å; N214-D216 PolarHBondContact O-N 2.91Å | ||
| 215 | K | 39.3 | Very low | 45.8 | Very low | 196 Ų | 196 | 116.5 Ų | 116.5 | 85% | 0.852 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -64.6 | 77 | 152.7 | 178.4 | -160.3 | 168.3 | -173.3 | 0 | 107.4 | M213 | M213-K215 VanDerWaalsContact C-N 3.3Å; M213-K215 PolarHBondContact O-N 3.37Å |
| 216 | D | 36.6 | Very low | 48.1 | Very low | 139 Ų | 139 | 112 Ų | 112 | 74% | 0.743 | 65% | 0.654 | S | S | * | * | trans | -171.9 | 69.5 | 157.9 | -91 | -25.5 | 0 | 0 | 0 | 110.1 | N214 F218 | N214-D216 PolarHBondContact O-N 2.91Å; D216-F218 PolarHBondContact O-N 2.81Å; D216-F218 VanDerWaalsContact O-N 3.16Å | ||
| 217 | G | 35.1 | Very low | 50.5 | Low | 83 Ų | 83 | 104.6 Ų | 104.6 | 86% | 0.856 | 63% | 0.63 | S | S | * | * | trans | -83 | 53.1 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L219 | G217-L219 PolarHBondContact O-N 3.47Š| ||
| 218 | F | 39.4 | Very low | 53.2 | Low | 190 Ų | 190 | 105.2 Ų | 105.2 | 83% | 0.833 | 62% | 0.623 | S | S | * | * | trans | -78.2 | 85.4 | -171.9 | -157.2 | -82.5 | 0 | 0 | 0 | 112.5 | D216 | D216-F218 PolarHBondContact O-N 2.81Å; D216-F218 VanDerWaalsContact O-N 3.16Å | ||
| 219 | L | 40.8 | Very low | 55.5 | Low | 170 Ų | 170 | 103.1 Ų | 103.1 | 89% | 0.89 | 61% | 0.611 | S | S | * | * | S | Bend | trans | -171.5 | 104.1 | 150 | -104.4 | 169.4 | 0 | 0 | 0 | 109.5 | G217 | G217-L219 PolarHBondContact O-N 3.47Š|
| 220 | G | 38.1 | Very low | 58.3 | Low | 65 Ų | 65 | 99.2 Ų | 99.2 | 67% | 0.67 | 59% | 0.586 | S | S | * | * | S | Bend | trans | 99 | 52 | 162.6 | 0 | 0 | 0 | 0 | 0 | 118.9 | I222 | G220-I222 VanDerWaalsContact C-N 3.26Å; G220-I222 PolarHBondContact O-N 3Å |
| 221 | G | 41.8 | Very low | 61 | Low | 91 Ų | 91 | 96.1 Ų | 96.1 | 94% | 0.938 | 56% | 0.564 | S | S | * | * | trans | 58.7 | -9.3 | 138 | 0 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 222 | I | 56.5 | Low | 63.4 | Low | 111 Ų | 111 | 97.1 Ų | 97.1 | 57% | 0.569 | 58% | 0.575 | S | S | * | * | trans | -98.5 | 111.4 | -175.4 | -59.9 | 175.2 | 0 | 0 | 0 | 109.7 | G220 V224 | G220-I222 VanDerWaalsContact C-N 3.26Å; G220-I222 PolarHBondContact O-N 3Å; I222-V224 PolarHBondContact O-N 2.96Å | ||
| 223 | S | 65.6 | Low | 66 | Low | 117 Ų | 117 | 91.8 Ų | 91.8 | 82% | 0.818 | 55% | 0.549 | S | S | * | . | trans | -71.4 | 94.6 | 171.3 | 47.3 | 0 | 0 | 0 | 0 | 110.6 | N225 | S223-N225 PolarHBondContact O-N 3.09Š| ||
| 224 | V | 80.6 | Confident | 68.3 | Low | 38 Ų | 38 | 88 Ų | 88 | 23% | 0.23 | 54% | 0.536 | C | S | . | . | trans | -58.5 | 109.7 | 179 | -179.1 | 0 | 0 | 0 | 0 | 110.3 | I222 T226 V250 L293 | I222-V224 PolarHBondContact O-N 2.96Å; V224-T226 HydrophobicContact CG1-CG2 4.32Å; V224-T226 WeakPolarHBondContact O-CG2 3.4Å; V224-T226 PolarHBondContact O-N 2.84Å; V224-V250 HydrophobicContact CG1-CG1 3.44Å; V224-V250 VanDerWaalsContact CG1-CG1 3.44Å; V224-L293 HydrophobicContact CG1-CD2 4.04Å; V224-L293 HydrophobicContact CG1-CG 4.41Å | ||
| 225 | N | 86.7 | Confident | 71.3 | Confident | 105 Ų | 105 | 82 Ų | 82 | 56% | 0.561 | 51% | 0.507 | S | S | * | . | trans | -76.5 | 86.3 | 180 | -168.1 | -29.5 | 0 | 0 | 0 | 110.7 | S223 G227 E228 | S223-N225 PolarHBondContact O-N 3.09Å; N225-G227 PolarHBondContact O-N 3.5Å; N225-G227 PolarHBondContact OD1-N 2.67Å; N225-E228 HydrophobicContact CB-CB 4.34Å; N225-E228 VanDerWaalsContact O-CB 3.3Å; N225-E228 WeakPolarHBondContact O-CB 3.5Å; N225-E228 PolarHBondContact O-N 3Å | ||
| 226 | T | 89.2 | Confident | 73.8 | Confident | 36 Ų | 36 | 77.4 Ų | 77.4 | 22% | 0.221 | 49% | 0.485 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64 | -10 | -173.7 | 70.7 | 0 | 0 | 0 | 0 | 115.1 | V224 G251 R382 | V224-T226 HydrophobicContact CG1-CG2 4.32Å; V224-T226 WeakPolarHBondContact O-CG2 3.4Å; V224-T226 PolarHBondContact O-N 2.84Å; T226-G251 WeakPolarHBondContact O-CA 3.36Å; T226-G251 PolarHBondContact O-N 3.04Å; T226-R382 PolarHBondContact O-NH2 3.28Å; T226-R382 PolarHBondContact OG1-NE 3.13Å; T226-R382 PolarHBondContact OG1-NH2 3.02Å |
| 227 | G | 89.1 | Confident | 76.4 | Confident | 30 Ų | 30 | 76.2 Ų | 76.2 | 31% | 0.309 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.4 | -12.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | N225 | N225-G227 PolarHBondContact O-N 3.5Å; N225-G227 PolarHBondContact OD1-N 2.67Å |
| 228 | E | 93.8 | Very high | 78.8 | Confident | 99 Ų | 99 | 73.8 Ų | 73.8 | 46% | 0.463 | 45% | 0.448 | S | S | . | . | S | Bend | trans | -64.9 | 146.9 | 179.7 | -168.8 | -170.3 | 147.4 | 0 | 0 | 111.7 | N225 F230 T249 V250 | N225-E228 HydrophobicContact CB-CB 4.34Å; N225-E228 VanDerWaalsContact O-CB 3.3Å; N225-E228 WeakPolarHBondContact O-CB 3.5Å; N225-E228 PolarHBondContact O-N 3Å; E228-F230 PolarHBondContact O-N 3.48Å; E228-T249 CarbonylContact O-C 3.53Å; E228-T249 WeakPolarHBondContact O-CA 3.31Å; E228-T249 VanDerWaalsContact O-CB 3.32Å; E228-T249 WeakPolarHBondContact O-CB 3.43Å; E228-V250 HydrophobicContact CB-CG2 3.92Å; E228-V250 PolarHBondContact O-N 3.03Å |
| 229 | V | 95.5 | Very high | 81 | Confident | 56 Ų | 56 | 71 Ų | 71 | 34% | 0.339 | 44% | 0.441 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.4 | 106.1 | 178.3 | -178.4 | 0 | 0 | 0 | 0 | 110.3 | C231 K247 V248 | V229-C231 VanDerWaalsContact CG1-O 3.24Å; V229-C231 WeakPolarHBondContact CG1-O 3.45Å; V229-K247 HydrophobicContact CG1-CB 3.98Å; V229-K247 HydrophobicContact CG1-CG 4.08Å; V229-K247 HydrophobicContact CG2-CB 4.16Å; V229-K247 HydrophobicContact CG2-CD 3.92Å; V229-K247 HydrophobicContact CG2-CG 4.18Å; V229-V248 CarbonylContact C-O 3.58Å |
| 230 | F | 95.8 | Very high | 82.7 | Confident | 7 Ų | 7 | 70.9 Ų | 70.9 | 3% | 0.031 | 44% | 0.44 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.6 | -42.1 | 176.4 | -175.1 | -112.6 | 0 | 0 | 0 | 112.3 | E228 V248 V250 V253 L272 L284 R287 L288 I291 | E228-F230 PolarHBondContact O-N 3.48Å; F230-V248 PolarHBondContact N-O 3.2Å; F230-V250 HydrophobicContact CB-CG2 4.29Å; F230-V253 HydrophobicContact CB-CG2 4.19Å; F230-V253 HydrophobicContact CD1-CG2 3.87Å; F230-V253 HydrophobicContact CG-CG2 4.14Å; F230-L272 HydrophobicContact CD1-CD1 4.34Å; F230-L272 HydrophobicContact CD1-CD2 4.17Å; F230-L272 HydrophobicContact CE1-CD1 3.83Å; F230-L272 HydrophobicContact CE1-CD2 4.48Å; F230-L284 HydrophobicContact CE1-CD1 4.25Å; F230-L284 HydrophobicContact CZ-CD1 4.2Å; F230-R287 HydrophobicContact CE2-CG 3.9Å; F230-R287 HydrophobicContact CZ-CB 4.45Å; F230-R287 HydrophobicContact CZ-CG 4.07Å; F230-R287 PolarHBondContact O-NH1 3.35Å; F230-R287 PolarHBondContact O-NH2 2.97Å; F230-L288 HydrophobicContact CE1-CD2 4.33Å; F230-L288 HydrophobicContact CE2-CD2 3.94Å; F230-L288 HydrophobicContact CZ-CD2 3.69Å; F230-L288 HydrophobicContact CZ-CG 4.23Å; F230-I291 HydrophobicContact CD2-CD1 3.56Å; F230-I291 HydrophobicContact CE2-CD1 3.73Å |
| 231 | C | 95.8 | Very high | 84.5 | Confident | 29 Ų | 29 | 73.1 Ų | 73.1 | 20% | 0.196 | 45% | 0.446 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -159.3 | 175 | 168.5 | 66.9 | 0 | 0 | 0 | 0 | 111.4 | V229 V248 | V229-C231 VanDerWaalsContact CG1-O 3.24Å; V229-C231 WeakPolarHBondContact CG1-O 3.45Å; C231-V248 PolarHBondContact N-O 2.68Å; C231-V248 PolarHBondContact O-N 3.49Å |
| 232 | S | 96.6 | Very high | 86.1 | Confident | 71 Ų | 71 | 72.4 Ų | 72.4 | 50% | 0.497 | 43% | 0.426 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 138.9 | 163.3 | -61.4 | 0 | 0 | 0 | 0 | 109.8 | Y246 | S232-Y246 CarbonylContact C-O 3.59Å; S232-Y246 VanDerWaalsContact CA-O 3.26Å; S232-Y246 WeakPolarHBondContact CA-O 3.49Å |
| 233 | V | 95.5 | Very high | 87 | Confident | 2 Ų | 2 | 71 Ų | 71 | 1% | 0.012 | 42% | 0.423 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.2 | 141 | -179 | -61.4 | 0 | 0 | 0 | 0 | 111.3 | K245 Y246 V248 L272 V312 | V233-K245 CarbonylContact O-C 3.53Å; V233-K245 WeakPolarHBondContact O-CA 3.5Å; V233-Y246 PolarHBondContact N-O 2.75Å; V233-Y246 PolarHBondContact O-N 2.7Å; V233-V248 HydrophobicContact CG1-CG2 3.97Å; V233-V248 HydrophobicContact CG2-CG2 3.94Å; V233-L272 WeakPolarHBondContact CG1-O 3.36Å; V233-V312 HydrophobicContact CG2-CG1 4.15Å; V233-V312 HydrophobicContact CG2-CG2 3.82Å |
| 234 | P | 93.1 | Very high | 87.9 | Confident | 70 Ų | 70 | 67.6 Ų | 67.6 | 46% | 0.455 | 40% | 0.399 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.5 | 136.6 | 173.6 | 30.5 | -34.1 | 0 | 0 | 0 | 110.4 | R273 | P234-R273 VanDerWaalsContact O-CD 3.23Å; P234-R273 WeakPolarHBondContact O-CD 3.46Å; P234-R273 PolarHBondContact O-NH1 2.94Å |
| 235 | G | 93 | Very high | 88.4 | Confident | 16 Ų | 16 | 73.5 Ų | 73.5 | 17% | 0.165 | 42% | 0.421 | C | S | . | . | trans | -60.4 | 140.3 | -175 | 0 | 0 | 0 | 0 | 0 | 114.3 | S244 E315 | G235-S244 PolarHBondContact N-O 3.26Å; G235-E315 VanDerWaalsContact CA-OE1 3.27Å; G235-E315 WeakPolarHBondContact CA-OE1 3.25Å | ||
| 236 | R | 92 | Very high | 88.9 | Confident | 101 Ų | 101 | 70.2 Ų | 70.2 | 38% | 0.381 | 40% | 0.401 | S | S | . | . | S | Bend | trans | -77.6 | -34.6 | 174.4 | -60.4 | -163.4 | -166.8 | -85 | -1.3 | 113 | G270 S310 E315 | R236-G270 PolarHBondContact NH2-O 3.24Å; R236-S310 VanDerWaalsContact CZ-O 3.3Å; R236-S310 PolarHBondContact NE-O 3.05Å; R236-S310 PolarHBondContact NH2-O 3.44Å; R236-E315 PolarHBondContact N-OE1 3.44Å |
| 237 | L | 89.8 | Confident | 89.2 | Confident | 114 Ų | 114 | 75.3 Ų | 75.3 | 60% | 0.597 | 42% | 0.421 | S | S | * | . | S | Bend | trans | -97.5 | 10.3 | -177.3 | -53.9 | -179.2 | 0 | 0 | 0 | 112.2 | L311 L319 | L237-L311 HydrophobicContact CD1-CD2 4.1Å; L237-L311 HydrophobicContact CG-CD2 4.33Å; L237-L319 HydrophobicContact CD1-CD1 4.07Å; L237-L319 HydrophobicContact CD1-CD2 4.03Å; L237-L319 HydrophobicContact CD1-CG 4.5Å |
| 238 | S | 85.2 | Confident | 89.6 | Confident | 32 Ų | 32 | 74 Ų | 74 | 22% | 0.224 | 41% | 0.406 | C | S | . | . | trans | -84.8 | 128.1 | 177.4 | -81.7 | 0 | 0 | 0 | 0 | 111.2 | S242 S244 | S238-S242 VanDerWaalsContact CB-O 3.23Å; S238-S242 WeakPolarHBondContact CB-O 3.4Å; S238-S242 PolarHBondContact OG-O 3.48Å; S238-S244 WeakPolarHBondContact OG-CB 3.41Å; S238-S244 PolarHBondContact OG-N 3.49Å | ||
| 239 | L | 85.6 | Confident | 89.7 | Confident | 131 Ų | 131 | 69.9 Ų | 69.9 | 69% | 0.686 | 39% | 0.388 | S | S | * | . | trans | -68.4 | 156.1 | 163.7 | -60.7 | 179.4 | 0 | 0 | 0 | 110.4 | S241 S242 T243 | L239-S241 VanDerWaalsContact C-N 3.3Å; L239-S241 PolarHBondContact O-N 3.11Å; L239-S242 CarbonylContact O-C 3.57Å; L239-S242 VanDerWaalsContact O-C 3.24Å; L239-S242 WeakPolarHBondContact O-CA 3.5Å; L239-S242 PolarHBondContact O-N 2.83Å; L239-T243 PolarHBondContact O-N 3Å | ||
| 240 | L | 78 | Confident | 89.7 | Confident | 167 Ų | 167 | 67.3 Ų | 67.3 | 87% | 0.874 | 37% | 0.372 | S | S | * | . | G | 310 helix | trans | -52 | -44.7 | -173.3 | -62.6 | 173.2 | 0 | 0 | 0 | 113.3 | S242 T243 | L240-S242 VanDerWaalsContact C-N 3.28Å; L240-S242 PolarHBondContact O-N 3.18Å; L240-T243 PolarHBondContact O-OG1 3.11Å |
| 241 | S | 75.5 | Confident | 89.7 | Confident | 113 Ų | 113 | 67 Ų | 67 | 79% | 0.79 | 37% | 0.371 | S | S | * | . | G | 310 helix | trans | -69 | -21 | 177.5 | 46.6 | 0 | 0 | 0 | 0 | 114.4 | L239 | L239-S241 VanDerWaalsContact C-N 3.3Å; L239-S241 PolarHBondContact O-N 3.11Å |
| 242 | S | 74.7 | Confident | 89.8 | Confident | 75 Ų | 75 | 65.7 Ų | 65.7 | 52% | 0.524 | 36% | 0.362 | S | S | . | . | G | 310 helix | trans | -119.8 | 46.8 | -175 | -58.2 | 0 | 0 | 0 | 0 | 111 | S238 L239 L240 S244 | S238-S242 VanDerWaalsContact CB-O 3.23Å; S238-S242 WeakPolarHBondContact CB-O 3.4Å; S238-S242 PolarHBondContact OG-O 3.48Å; L239-S242 CarbonylContact O-C 3.57Å; L239-S242 VanDerWaalsContact O-C 3.24Å; L239-S242 WeakPolarHBondContact O-CA 3.5Å; L239-S242 PolarHBondContact O-N 2.83Å; L240-S242 VanDerWaalsContact C-N 3.28Å; L240-S242 PolarHBondContact O-N 3.18Å; S242-S244 PolarHBondContact O-N 3.29Å |
| 243 | T | 75.6 | Confident | 89.8 | Confident | 83 Ų | 83 | 62.3 Ų | 62.3 | 51% | 0.509 | 34% | 0.339 | S | S | . | . | trans | -70.1 | 84.8 | -177.1 | -63.5 | 0 | 0 | 0 | 0 | 111.8 | L239 L240 | L239-T243 PolarHBondContact O-N 3Å; L240-T243 PolarHBondContact O-OG1 3.11Å | ||
| 244 | S | 84.4 | Confident | 89.7 | Confident | 44 Ų | 44 | 66 Ų | 66 | 31% | 0.308 | 36% | 0.356 | S | S | . | . | trans | -69.9 | 139 | 174.8 | -63.6 | 0 | 0 | 0 | 0 | 111.2 | G235 S238 S242 | G235-S244 PolarHBondContact N-O 3.26Å; S238-S244 WeakPolarHBondContact OG-CB 3.41Å; S238-S244 PolarHBondContact OG-N 3.49Å; S242-S244 PolarHBondContact O-N 3.29Å | ||
| 245 | K | 92.4 | Very high | 89.8 | Confident | 163 Ų | 163 | 63.7 Ų | 63.7 | 71% | 0.709 | 34% | 0.338 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -110.8 | 115.7 | 172.2 | -70.5 | 178.9 | -177.3 | 172.7 | 0 | 109.7 | V233 | V233-K245 CarbonylContact O-C 3.53Å; V233-K245 WeakPolarHBondContact O-CA 3.5Å |
| 246 | Y | 95.3 | Very high | 89.9 | Confident | 35 Ų | 35 | 63 Ų | 63 | 14% | 0.137 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.5 | 131.4 | -177.4 | -63.9 | -86.6 | 0 | 0 | 0 | 110.6 | S232 V233 V312 G314 E315 H318 | S232-Y246 CarbonylContact C-O 3.59Å; S232-Y246 VanDerWaalsContact CA-O 3.26Å; S232-Y246 WeakPolarHBondContact CA-O 3.49Å; V233-Y246 PolarHBondContact N-O 2.75Å; V233-Y246 PolarHBondContact O-N 2.7Å; Y246-V312 HydrophobicContact CG-CG2 4.36Å; Y246-G314 VanDerWaalsContact CD1-C 3.4Å; Y246-G314 WeakPolarHBondContact CD1-O 3.33Å; Y246-G314 VanDerWaalsContact CE1-O 3.22Å; Y246-G314 WeakPolarHBondContact CE1-O 3.35Å; Y246-E315 HydrophobicContact CD1-CG 4Å; Y246-E315 HydrophobicContact CD2-CG 3.45Å; Y246-E315 VanDerWaalsContact CD2-CG 3.45Å; Y246-E315 HydrophobicContact CE1-CG 4.03Å; Y246-E315 HydrophobicContact CE2-CG 3.49Å; Y246-E315 VanDerWaalsContact CE2-CG 3.49Å; Y246-E315 HydrophobicContact CG-CG 3.71Å; Y246-H318 HydrophobicContact CE1-CB 4.34Å; Y246-H318 AromaticContact CE1-ND1 3.93Å; Y246-H318 AromaticContact CZ-ND1 3.88Å; Y246-H318 PolarHBondContact OH-ND1 3.21Å |
| 247 | K | 96.1 | Very high | 90 | Very high | 144 Ų | 144 | 58.7 Ų | 58.7 | 63% | 0.626 | 32% | 0.315 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78.8 | 119.6 | 175 | -68.9 | 173.5 | 175.6 | 179.7 | 0 | 109.1 | V229 | V229-K247 HydrophobicContact CG1-CB 3.98Å; V229-K247 HydrophobicContact CG1-CG 4.08Å; V229-K247 HydrophobicContact CG2-CB 4.16Å; V229-K247 HydrophobicContact CG2-CD 3.92Å; V229-K247 HydrophobicContact CG2-CG 4.18Å |
| 248 | V | 97.1 | Very high | 90.2 | Very high | 2 Ų | 2 | 55.3 Ų | 55.3 | 1% | 0.012 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.9 | 120.2 | 170.7 | -178.1 | 0 | 0 | 0 | 0 | 107.5 | V229 F230 C231 V233 E252 V253 L272 V312 | V229-V248 CarbonylContact C-O 3.58Å; F230-V248 PolarHBondContact N-O 3.2Å; C231-V248 PolarHBondContact N-O 2.68Å; C231-V248 PolarHBondContact O-N 3.49Å; V233-V248 HydrophobicContact CG1-CG2 3.97Å; V233-V248 HydrophobicContact CG2-CG2 3.94Å; V248-E252 HydrophobicContact CG1-CB 4.36Å; V248-E252 HydrophobicContact CG1-CG 4.26Å; V248-V253 HydrophobicContact CG1-CG2 3.86Å; V248-L272 HydrophobicContact CB-CD2 4.28Å; V248-L272 HydrophobicContact CG1-CD2 3.77Å; V248-L272 HydrophobicContact CG2-CD2 4.35Å; V248-V312 HydrophobicContact CG2-CB 4.09Å; V248-V312 HydrophobicContact CG2-CG1 3.6Å; V248-V312 HydrophobicContact CG2-CG2 4.35Å |
| 249 | T | 96.6 | Very high | 90.5 | Very high | 13 Ų | 13 | 57.2 Ų | 57.2 | 8% | 0.08 | 31% | 0.312 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.1 | 160.5 | -177 | 65.3 | 0 | 0 | 0 | 0 | 112.5 | E228 G251 E252 V253 | E228-T249 CarbonylContact O-C 3.53Å; E228-T249 WeakPolarHBondContact O-CA 3.31Å; E228-T249 VanDerWaalsContact O-CB 3.32Å; E228-T249 WeakPolarHBondContact O-CB 3.43Å; T249-G251 PolarHBondContact O-N 2.96Å; T249-E252 PolarHBondContact O-N 3.28Å; T249-E252 VanDerWaalsContact O-N 3.13Å; T249-E252 PolarHBondContact OG1-N 3.47Å; T249-V253 WeakPolarHBondContact O-CG2 3.42Å; T249-V253 PolarHBondContact O-N 3.42Å |
| 250 | V | 95.8 | Very high | 90.9 | Very high | 1 Ų | 1 | 51.4 Ų | 51.4 | 1% | 0.006 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -55.7 | -36.1 | 172.4 | 172.2 | 0 | 0 | 0 | 0 | 110.8 | V224 E228 F230 V253 Q254 I291 L293 | V224-V250 HydrophobicContact CG1-CG1 3.44Å; V224-V250 VanDerWaalsContact CG1-CG1 3.44Å; E228-V250 HydrophobicContact CB-CG2 3.92Å; E228-V250 PolarHBondContact O-N 3.03Å; F230-V250 HydrophobicContact CB-CG2 4.29Å; V250-V253 PolarHBondContact O-N 2.85Å; V250-Q254 WeakPolarHBondContact O-CB 3.07Å; V250-Q254 PolarHBondContact O-N 3.04Å; V250-I291 HydrophobicContact CB-CD1 4.46Å; V250-I291 HydrophobicContact CG1-CD1 4.05Å; V250-I291 HydrophobicContact CG2-CD1 3.73Å; V250-L293 HydrophobicContact CG1-CD1 4.06Å; V250-L293 HydrophobicContact CG1-CG 4.47Å |
| 251 | G | 95.7 | Very high | 91.6 | Very high | 1 Ų | 1 | 43.7 Ų | 43.7 | 1% | 0.01 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.7 | -42.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | T226 T249 Q254 R255 | T226-G251 WeakPolarHBondContact O-CA 3.36Å; T226-G251 PolarHBondContact O-N 3.04Å; T249-G251 PolarHBondContact O-N 2.96Å; G251-Q254 PolarHBondContact O-N 2.87Å; G251-R255 WeakPolarHBondContact O-CB 3.36Å; G251-R255 WeakPolarHBondContact O-CG 3.2Å; G251-R255 PolarHBondContact O-N 2.85Å |
| 252 | E | 97.2 | Very high | 92.5 | Very high | 2 Ų | 2 | 39.1 Ų | 39.1 | 1% | 0.009 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.1 | -46.2 | 173.7 | 172.6 | 172.6 | -170.8 | 0 | 0 | 110.5 | V248 T249 Q254 R255 R256 V312 E313 | V248-E252 HydrophobicContact CG1-CB 4.36Å; V248-E252 HydrophobicContact CG1-CG 4.26Å; T249-E252 PolarHBondContact O-N 3.28Å; T249-E252 VanDerWaalsContact O-N 3.13Å; T249-E252 PolarHBondContact OG1-N 3.47Å; E252-Q254 VanDerWaalsContact C-N 3.31Å; E252-Q254 PolarHBondContact O-N 3.47Å; E252-R255 PolarHBondContact O-N 3.05Å; E252-R256 HydrophobicContact CG-CG 4.47Å; E252-R256 WeakPolarHBondContact O-CG 3.33Å; E252-R256 PolarHBondContact O-N 3.19Å; E252-R256 IonicContact OE1-CZ 2.9Å; E252-R256 IonicContact OE1-NE 2.99Å; E252-R256 PolarHBondContact OE1-NE 3.41Å; E252-R256 IonicContact OE1-NH2 3.79Å; E252-R256 PolarHBondContact OE1-NH2 3.08Å; E252-V312 VanDerWaalsContact OE1-CA 3.27Å; E252-V312 WeakPolarHBondContact OE1-CA 3.47Å; E252-V312 WeakPolarHBondContact OE1-CB 3.39Å; E252-E313 WeakPolarHBondContact CA-OE1 3.39Å; E252-E313 HydrophobicContact CB-CG 4.41Å; E252-E313 WeakPolarHBondContact CB-OE1 3.41Å; E252-E313 HydrophobicContact CG-CG 3.95Å; E252-E313 WeakPolarHBondContact CG-OE1 3.37Å; E252-E313 PolarHBondContact OE1-N 3.09Å; E252-E313 PolarHBondContact OE2-N 2.81Å |
| 253 | V | 96.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.3 | -43.5 | 178.4 | 177.8 | 0 | 0 | 0 | 0 | 110.9 | F230 V248 T249 V250 R256 L257 L268 L272 L288 L293 | F230-V253 HydrophobicContact CB-CG2 4.19Å; F230-V253 HydrophobicContact CD1-CG2 3.87Å; F230-V253 HydrophobicContact CG-CG2 4.14Å; V248-V253 HydrophobicContact CG1-CG2 3.86Å; T249-V253 WeakPolarHBondContact O-CG2 3.42Å; T249-V253 PolarHBondContact O-N 3.42Å; V250-V253 PolarHBondContact O-N 2.85Å; V253-R256 PolarHBondContact O-N 3.44Å; V253-L257 HydrophobicContact CG1-CD1 4.31Å; V253-L257 WeakPolarHBondContact O-CG 3.34Å; V253-L257 PolarHBondContact O-N 3.2Å; V253-L257 VanDerWaalsContact O-N 3.1Å; V253-L268 HydrophobicContact CG1-CD1 4.5Å; V253-L268 HydrophobicContact CG1-CD2 4.08Å; V253-L272 HydrophobicContact CG2-CD2 4.5Å; V253-L288 HydrophobicContact CG1-CD2 3.5Å; V253-L288 VanDerWaalsContact CG1-CD2 3.5Å; V253-L293 HydrophobicContact CB-CD1 4.2Å; V253-L293 HydrophobicContact CG1-CD1 3.84Å |
| 254 | Q | 94.9 | Very high | 94.1 | Very high | 80 Ų | 80 | 34 Ų | 34 | 37% | 0.374 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -59.3 | -49.9 | 175.8 | -171.2 | 179.4 | 16.4 | 0 | 0 | 111.7 | V250 G251 E252 R256 L257 S258 L293 | V250-Q254 WeakPolarHBondContact O-CB 3.07Å; V250-Q254 PolarHBondContact O-N 3.04Å; G251-Q254 PolarHBondContact O-N 2.87Å; E252-Q254 VanDerWaalsContact C-N 3.31Å; E252-Q254 PolarHBondContact O-N 3.47Å; Q254-R256 VanDerWaalsContact C-N 3.29Å; Q254-R256 PolarHBondContact O-N 2.89Å; Q254-L257 PolarHBondContact O-N 2.8Å; Q254-L257 VanDerWaalsContact O-N 3.1Å; Q254-S258 PolarHBondContact O-N 3.43Å; Q254-S258 PolarHBondContact O-OG 3.02Å; Q254-L293 HydrophobicContact CB-CD1 4.33Å; Q254-L293 HydrophobicContact CB-CD2 4.02Å; Q254-L293 HydrophobicContact CG-CD2 3.93Å |
| 255 | R | 95.6 | Very high | 94.4 | Very high | 21 Ų | 21 | 32.3 Ų | 32.3 | 8% | 0.079 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -57.8 | -36.7 | 177.8 | -77.5 | -176.2 | -70.6 | -95.7 | -2.2 | 113.3 | G251 E252 S258 E313 P377 G379 L400 | G251-R255 WeakPolarHBondContact O-CB 3.36Å; G251-R255 WeakPolarHBondContact O-CG 3.2Å; G251-R255 PolarHBondContact O-N 2.85Å; E252-R255 PolarHBondContact O-N 3.05Å; R255-S258 WeakPolarHBondContact CA-OG 3.36Å; R255-S258 PolarHBondContact O-OG 3.42Å; R255-E313 IonicContact CZ-OE1 3.77Å; R255-E313 VanDerWaalsContact CZ-OE1 3.3Å; R255-E313 IonicContact CZ-OE2 2.84Å; R255-E313 IonicContact NE-OE1 3.44Å; R255-E313 PolarHBondContact NE-OE1 3.31Å; R255-E313 IonicContact NE-OE2 3.78Å; R255-E313 VanDerWaalsContact NH2-CD 3.28Å; R255-E313 IonicContact NH2-OE1 3.74Å; R255-E313 PolarHBondContact NH2-OE1 3.03Å; R255-E313 IonicContact NH2-OE2 3.5Å; R255-E313 PolarHBondContact NH2-OE2 3.47Å; R255-P377 WeakPolarHBondContact CD-O 3.49Å; R255-P377 PolarHBondContact NH1-O 3.43Å; R255-G379 PolarHBondContact NH1-O 3.22Å; R255-G379 VanDerWaalsContact NH2-N 3.17Å; R255-G379 PolarHBondContact NH2-O 2.85Å; R255-L400 HydrophobicContact CB-CD2 4.14Å; R255-L400 VanDerWaalsContact CD-CD2 3.46Å; R255-L400 HydrophobicContact CG-CD2 3.94Å |
| 256 | R | 95.1 | Very high | 94.2 | Very high | 2 Ų | 2 | 29.4 Ų | 29.4 | 1% | 0.008 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -75.4 | -26.8 | 177.2 | -69.8 | -178.1 | 179.8 | -90.9 | 7.5 | 113.8 | E252 V253 Q254 E261 C262 L263 T309 L311 H403 | E252-R256 HydrophobicContact CG-CG 4.47Å; E252-R256 WeakPolarHBondContact O-CG 3.33Å; E252-R256 PolarHBondContact O-N 3.19Å; E252-R256 IonicContact OE1-CZ 2.9Å; E252-R256 IonicContact OE1-NE 2.99Å; E252-R256 PolarHBondContact OE1-NE 3.41Å; E252-R256 IonicContact OE1-NH2 3.79Å; E252-R256 PolarHBondContact OE1-NH2 3.08Å; V253-R256 PolarHBondContact O-N 3.44Å; Q254-R256 VanDerWaalsContact C-N 3.29Å; Q254-R256 PolarHBondContact O-N 2.89Å; R256-E261 IonicContact CZ-OE2 2.7Å; R256-E261 IonicContact NH1-OE2 3.4Å; R256-E261 PolarHBondContact NH1-OE2 3.48Å; R256-C262 PolarHBondContact O-N 3.26Å; R256-L263 HydrophobicContact CB-CD1 3.99Å; R256-L263 HydrophobicContact CB-CG 4.24Å; R256-L263 HydrophobicContact CG-CD1 4.3Å; R256-L263 PolarHBondContact O-N 2.97Å; R256-T309 PolarHBondContact NH1-O 3.04Å; R256-L311 PolarHBondContact NH2-O 3.22Å; R256-H403 PolarHBondContact NH1-NE2 2.76Å; R256-H403 PolarHBondContact NH2-CD2 3.44Å; R256-H403 VanDerWaalsContact NH2-CD2 3.28Å |
| 257 | L | 93.6 | Very high | 94.1 | Very high | 10 Ų | 10 | 30.2 Ų | 30.2 | 5% | 0.052 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -82.2 | -31.2 | 176.6 | -69.3 | -172.9 | 0 | 0 | 0 | 112.3 | V253 Q254 L263 L268 L288 L295 R299 | V253-L257 HydrophobicContact CG1-CD1 4.31Å; V253-L257 WeakPolarHBondContact O-CG 3.34Å; V253-L257 PolarHBondContact O-N 3.2Å; V253-L257 VanDerWaalsContact O-N 3.1Å; Q254-L257 PolarHBondContact O-N 2.8Å; Q254-L257 VanDerWaalsContact O-N 3.1Å; L257-L263 WeakPolarHBondContact CD2-O 2.85Å; L257-L268 HydrophobicContact CD2-CD2 3.84Å; L257-L268 HydrophobicContact CG-CD2 4.33Å; L257-L288 HydrophobicContact CD1-CD1 4.22Å; L257-L295 HydrophobicContact CD1-CB 4.19Å; L257-L295 HydrophobicContact CD2-CD1 3.75Å; L257-L295 HydrophobicContact CD2-CD2 4.09Å; L257-L295 HydrophobicContact CD2-CG 4.37Å; L257-R299 PolarHBondContact O-NH1 3.41Å |
| 258 | S | 92.5 | Very high | 94 | Very high | 43 Ų | 43 | 23.3 Ų | 23.3 | 30% | 0.301 | 14% | 0.139 | S | C | . | . | S | Bend | trans | -73.8 | 172.7 | 169.4 | 59.7 | 0 | 0 | 0 | 0 | 112.4 | Q254 R255 C262 | Q254-S258 PolarHBondContact O-N 3.43Å; Q254-S258 PolarHBondContact O-OG 3.02Å; R255-S258 WeakPolarHBondContact CA-OG 3.36Å; R255-S258 PolarHBondContact O-OG 3.42Å; S258-C262 WeakPolarHBondContact O-CA 3.48Å; S258-C262 PolarHBondContact O-N 2.99Å |
| 259 | P | 92.3 | Very high | 93.8 | Very high | 71 Ų | 71 | 23.8 Ų | 23.8 | 46% | 0.461 | 14% | 0.144 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -54.6 | 152.9 | 158.1 | -23.3 | 35 | 0 | 0 | 0 | 110.8 | L211 C262 | L211-P259 HydrophobicContact CD2-CB 4.42Å; P259-C262 VanDerWaalsContact N-SG 3.43Å |
| 260 | P | 94 | Very high | 93.7 | Very high | 10 Ų | 10 | 25 Ų | 25 | 7% | 0.065 | 16% | 0.16 | C | C | . | . | T | Hydrogen-bonded Turn | cis | -81.4 | -21.4 | 2.7 | 31 | -35.1 | 0 | 0 | 0 | 115.1 | A302 A303 L400 I401 | P260-A302 WeakPolarHBondContact O-CB 3.47Å; P260-A303 PolarHBondContact O-N 3.26Å; P260-L400 HydrophobicContact CG-CB 3.78Å; P260-L400 HydrophobicContact CG-CD1 4.38Å; P260-I401 HydrophobicContact CB-CG2 3.82Å; P260-I401 HydrophobicContact CG-CG2 3.44Å; P260-I401 VanDerWaalsContact CG-CG2 3.44Å |
| 261 | E | 93.8 | Very high | 93.6 | Very high | 5 Ų | 5 | 25.3 Ų | 25.3 | 2% | 0.023 | 16% | 0.161 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | -45 | -173.9 | -68.4 | -154.2 | 111 | 0 | 0 | 113.5 | R256 L263 A302 A303 T309 H403 | R256-E261 IonicContact CZ-OE2 2.7Å; R256-E261 IonicContact NH1-OE2 3.4Å; R256-E261 PolarHBondContact NH1-OE2 3.48Å; E261-L263 VanDerWaalsContact C-N 3.33Å; E261-L263 HydrophobicContact CB-CD2 3.87Å; E261-L263 HydrophobicContact CB-CG 3.93Å; E261-L263 PolarHBondContact O-N 3.22Å; E261-A302 PolarHBondContact O-N 3.34Å; E261-A303 HydrophobicContact CG-CB 4.46Å; E261-A303 PolarHBondContact O-N 2.97Å; E261-T309 VanDerWaalsContact OE1-CG2 3.24Å; E261-T309 WeakPolarHBondContact OE1-CG2 3.48Å; E261-T309 PolarHBondContact OE1-OG1 3.22Å; E261-H403 WeakPolarHBondContact CG-NE2 3.47Å; E261-H403 IonicContact OE1-CE1 3.72Å; E261-H403 PolarHBondContact OE1-CE1 2.77Å; E261-H403 IonicContact OE1-NE2 3.3Å; E261-H403 PolarHBondContact OE1-NE2 3.04Å; E261-H403 IonicContact OE2-CE1 3.05Å; E261-H403 IonicContact OE2-NE2 3.53Å; E261-H403 PolarHBondContact OE2-NE2 3.01Å |
| 262 | C | 93.3 | Very high | 93.6 | Very high | 17 Ų | 17 | 25.7 Ų | 25.7 | 12% | 0.115 | 16% | 0.163 | C | C | . | . | trans | 50.2 | 46.4 | -172.3 | -73.6 | 0 | 0 | 0 | 0 | 113.5 | R256 S258 P259 A302 | R256-C262 PolarHBondContact O-N 3.26Å; S258-C262 WeakPolarHBondContact O-CA 3.48Å; S258-C262 PolarHBondContact O-N 2.99Å; P259-C262 VanDerWaalsContact N-SG 3.43Å; C262-A302 HydrophobicContact CB-CB 3.75Å | ||
| 263 | L | 93.2 | Very high | 93.5 | Very high | 3 Ų | 3 | 28.2 Ų | 28.2 | 2% | 0.016 | 17% | 0.172 | C | C | . | . | trans | -58.5 | 141.3 | -175 | -63 | -168.4 | 0 | 0 | 0 | 112.6 | R256 L257 E261 L267 L268 V271 T309 | R256-L263 HydrophobicContact CB-CD1 3.99Å; R256-L263 HydrophobicContact CB-CG 4.24Å; R256-L263 HydrophobicContact CG-CD1 4.3Å; R256-L263 PolarHBondContact O-N 2.97Å; L257-L263 WeakPolarHBondContact CD2-O 2.85Å; E261-L263 VanDerWaalsContact C-N 3.33Å; E261-L263 HydrophobicContact CB-CD2 3.87Å; E261-L263 HydrophobicContact CB-CG 3.93Å; E261-L263 PolarHBondContact O-N 3.22Å; L263-L267 HydrophobicContact CB-CB 4.37Å; L263-L267 HydrophobicContact CD2-CB 4.18Å; L263-L267 HydrophobicContact CD2-CD1 4.1Å; L263-L268 HydrophobicContact CB-CB 4.49Å; L263-V271 HydrophobicContact CD1-CG2 4.15Å; L263-T309 HydrophobicContact CD2-CG2 4.34Å | ||
| 264 | N | 90.9 | Very high | 93.1 | Very high | 47 Ų | 47 | 32.7 Ų | 32.7 | 25% | 0.251 | 19% | 0.189 | S | C | . | . | trans | -86.2 | 168 | 169.9 | 70.1 | 46.4 | 0 | 0 | 0 | 111.3 | S266 L267 L268 | N264-S266 PolarHBondContact O-N 3.38Å; N264-S266 VanDerWaalsContact O-N 3.16Å; N264-S266 WeakPolarHBondContact OD1-CB 3.48Å; N264-S266 PolarHBondContact OD1-N 3.36Å; N264-L267 PolarHBondContact O-N 3.12Å; N264-L267 PolarHBondContact OD1-N 3.43Å; N264-L268 WeakPolarHBondContact O-CB 3.23Å; N264-L268 PolarHBondContact O-N 3.27Å | ||
| 265 | A | 90.3 | Very high | 92.7 | Very high | 8 Ų | 8 | 33.3 Ų | 33.3 | 7% | 0.066 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -58.1 | -29.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | G269 L284 L295 | A265-G269 PolarHBondContact O-N 3.31Å; A265-L284 HydrophobicContact CB-CD2 4.22Å; A265-L284 WeakPolarHBondContact O-CD2 3.4Å; A265-L295 HydrophobicContact CB-CD2 3.81Å |
| 266 | S | 88.8 | Confident | 92.2 | Very high | 103 Ų | 103 | 42.7 Ų | 42.7 | 72% | 0.72 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -75.3 | -45.3 | 178.3 | -52.9 | 0 | 0 | 0 | 0 | 111.5 | N264 G269 G270 | N264-S266 PolarHBondContact O-N 3.38Å; N264-S266 VanDerWaalsContact O-N 3.16Å; N264-S266 WeakPolarHBondContact OD1-CB 3.48Å; N264-S266 PolarHBondContact OD1-N 3.36Å; S266-G269 PolarHBondContact O-N 3.03Å; S266-G270 PolarHBondContact O-N 2.92Å; S266-G270 VanDerWaalsContact O-N 3.07Å |
| 267 | L | 92.4 | Very high | 91.9 | Very high | 51 Ų | 51 | 46.1 Ų | 46.1 | 27% | 0.267 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -64.9 | -48.4 | 176.3 | -68.3 | 173.2 | 0 | 0 | 0 | 111 | L263 N264 G269 G270 V271 K301 V305 | L263-L267 HydrophobicContact CB-CB 4.37Å; L263-L267 HydrophobicContact CD2-CB 4.18Å; L263-L267 HydrophobicContact CD2-CD1 4.1Å; N264-L267 PolarHBondContact O-N 3.12Å; N264-L267 PolarHBondContact OD1-N 3.43Å; L267-G269 VanDerWaalsContact C-N 3.31Å; L267-G269 PolarHBondContact O-N 3.15Å; L267-G270 PolarHBondContact O-N 3.05Å; L267-V271 WeakPolarHBondContact O-CG2 3.24Å; L267-V271 PolarHBondContact O-N 3.44Å; L267-K301 HydrophobicContact CD1-CB 4.38Å; L267-V305 HydrophobicContact CD1-CG2 4.13Å; L267-V305 HydrophobicContact CD2-CG2 4.21Å |
| 268 | L | 93.9 | Very high | 91.6 | Very high | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -59.3 | -41.9 | 175.4 | -179.7 | 60.8 | 0 | 0 | 0 | 111.2 | V253 L257 L263 N264 G270 V271 L272 L284 L288 L295 | V253-L268 HydrophobicContact CG1-CD1 4.5Å; V253-L268 HydrophobicContact CG1-CD2 4.08Å; L257-L268 HydrophobicContact CD2-CD2 3.84Å; L257-L268 HydrophobicContact CG-CD2 4.33Å; L263-L268 HydrophobicContact CB-CB 4.49Å; N264-L268 WeakPolarHBondContact O-CB 3.23Å; N264-L268 PolarHBondContact O-N 3.27Å; L268-G270 VanDerWaalsContact C-N 3.29Å; L268-G270 PolarHBondContact O-N 2.93Å; L268-V271 PolarHBondContact O-N 3.17Å; L268-L272 HydrophobicContact CD1-CD1 3.92Å; L268-L272 HydrophobicContact CD1-CG 3.99Å; L268-L272 HydrophobicContact CD2-CD1 4.45Å; L268-L272 HydrophobicContact CG-CD1 3.75Å; L268-L272 HydrophobicContact CG-CG 4.27Å; L268-L272 WeakPolarHBondContact O-CB 3.32Å; L268-L272 WeakPolarHBondContact O-CG 3.26Å; L268-L272 PolarHBondContact O-N 2.96Å; L268-L284 HydrophobicContact CB-CD2 4.34Å; L268-L284 HydrophobicContact CD2-CD2 4.13Å; L268-L284 HydrophobicContact CG-CD2 4.21Å; L268-L288 HydrophobicContact CD2-CD1 4.15Å; L268-L295 HydrophobicContact CD2-CD2 4.24Å |
| 269 | G | 93.8 | Very high | 91.4 | Very high | 12 Ų | 12 | 58.3 Ų | 58.3 | 12% | 0.124 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -57.7 | -38.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | A265 S266 L267 L272 R273 R274 | A265-G269 PolarHBondContact O-N 3.31Å; S266-G269 PolarHBondContact O-N 3.03Å; L267-G269 VanDerWaalsContact C-N 3.31Å; L267-G269 PolarHBondContact O-N 3.15Å; G269-L272 CarbonylContact O-C 3.07Å; G269-R273 PolarHBondContact O-N 2.83Å; G269-R274 PolarHBondContact O-N 2.88Å |
| 270 | G | 93.4 | Very high | 91.3 | Very high | 39 Ų | 39 | 55.6 Ų | 55.6 | 40% | 0.402 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -72.5 | -37 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | R236 S266 L267 L268 R273 | R236-G270 PolarHBondContact NH2-O 3.24Å; S266-G270 PolarHBondContact O-N 2.92Å; S266-G270 VanDerWaalsContact O-N 3.07Å; L267-G270 PolarHBondContact O-N 3.05Å; L268-G270 VanDerWaalsContact C-N 3.29Å; L268-G270 PolarHBondContact O-N 2.93Å; G270-R273 PolarHBondContact O-N 2.6Å |
| 271 | V | 95.4 | Very high | 91 | Very high | 6 Ų | 6 | 56.9 Ų | 56.9 | 4% | 0.036 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61 | -50 | 170.7 | 173.8 | 0 | 0 | 0 | 0 | 110.1 | L263 L267 L268 R273 T309 V312 | L263-V271 HydrophobicContact CD1-CG2 4.15Å; L267-V271 WeakPolarHBondContact O-CG2 3.24Å; L267-V271 PolarHBondContact O-N 3.44Å; L268-V271 PolarHBondContact O-N 3.17Å; V271-R273 PolarHBondContact O-N 3.28Å; V271-R273 VanDerWaalsContact O-N 3.07Å; V271-R273 PolarHBondContact O-NE 3.28Å; V271-R273 PolarHBondContact O-NH2 3.06Å; V271-T309 WeakPolarHBondContact CG2-O 3.37Å; V271-V312 HydrophobicContact CG1-CG1 3.71Å |
| 272 | L | 95.6 | Very high | 90.9 | Very high | 9 Ų | 9 | 64.3 Ų | 64.3 | 5% | 0.047 | 35% | 0.353 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.8 | 3.7 | 177.7 | -62.2 | 172.7 | 0 | 0 | 0 | 114.2 | F230 V233 V248 V253 L268 G269 R274 L284 | F230-L272 HydrophobicContact CD1-CD1 4.34Å; F230-L272 HydrophobicContact CD1-CD2 4.17Å; F230-L272 HydrophobicContact CE1-CD1 3.83Å; F230-L272 HydrophobicContact CE1-CD2 4.48Å; V233-L272 WeakPolarHBondContact CG1-O 3.36Å; V248-L272 HydrophobicContact CB-CD2 4.28Å; V248-L272 HydrophobicContact CG1-CD2 3.77Å; V248-L272 HydrophobicContact CG2-CD2 4.35Å; V253-L272 HydrophobicContact CG2-CD2 4.5Å; L268-L272 HydrophobicContact CD1-CD1 3.92Å; L268-L272 HydrophobicContact CD1-CG 3.99Å; L268-L272 HydrophobicContact CD2-CD1 4.45Å; L268-L272 HydrophobicContact CG-CD1 3.75Å; L268-L272 HydrophobicContact CG-CG 4.27Å; L268-L272 WeakPolarHBondContact O-CB 3.32Å; L268-L272 WeakPolarHBondContact O-CG 3.26Å; L268-L272 PolarHBondContact O-N 2.96Å; G269-L272 CarbonylContact O-C 3.07Å; L272-R274 HydrophobicContact CB-CG 4.17Å; L272-R274 PolarHBondContact O-N 2.95Å; L272-R274 VanDerWaalsContact O-N 3.07Å; L272-L284 HydrophobicContact CD1-CD1 3.94Å |
| 273 | R | 94.1 | Very high | 90.8 | Very high | 56 Ų | 56 | 65.5 Ų | 65.5 | 21% | 0.211 | 36% | 0.361 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 51.7 | 33.1 | 177.4 | -78.9 | 149 | -100.2 | -153.3 | -16.9 | 113.8 | P234 G269 G270 V271 E315 | P234-R273 VanDerWaalsContact O-CD 3.23Å; P234-R273 WeakPolarHBondContact O-CD 3.46Å; P234-R273 PolarHBondContact O-NH1 2.94Å; G269-R273 PolarHBondContact O-N 2.83Å; G270-R273 PolarHBondContact O-N 2.6Å; V271-R273 PolarHBondContact O-N 3.28Å; V271-R273 VanDerWaalsContact O-N 3.07Å; V271-R273 PolarHBondContact O-NE 3.28Å; V271-R273 PolarHBondContact O-NH2 3.06Å; R273-E315 IonicContact CZ-OE1 3.01Å; R273-E315 IonicContact CZ-OE2 3.32Å; R273-E315 VanDerWaalsContact NH1-CD 3.29Å; R273-E315 IonicContact NH1-OE1 3.64Å; R273-E315 PolarHBondContact NH1-OE1 2.89Å; R273-E315 IonicContact NH1-OE2 1.95Å; R273-E315 PolarHBondContact NH1-OE2 2.92Å; R273-E315 IonicContact NH2-OE1 3.88Å; R273-E315 IonicContact NH2-OE2 2.95Å; R273-E315 PolarHBondContact NH2-OE2 3.05Å |
| 274 | R | 88.9 | Confident | 90.8 | Very high | 94 Ų | 94 | 65.4 Ų | 65.4 | 36% | 0.355 | 36% | 0.361 | S | S | . | . | P | Polyproline II helix | trans | -78.5 | 133.8 | 176.5 | -67 | -173.5 | 68 | -179.4 | 0.4 | 110.6 | G269 L272 S283 | G269-R274 PolarHBondContact O-N 2.88Å; L272-R274 HydrophobicContact CB-CG 4.17Å; L272-R274 PolarHBondContact O-N 2.95Å; L272-R274 VanDerWaalsContact O-N 3.07Å; R274-S283 PolarHBondContact NH2-OG 3.36Å |
| 275 | A | 85.3 | Confident | 90.9 | Very high | 92 Ų | 92 | 66.8 Ų | 66.8 | 76% | 0.76 | 36% | 0.362 | S | S | * | . | P | Polyproline II helix | trans | -58 | 141.8 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | S277 | A275-S277 PolarHBondContact O-N 3.01Š|
| 276 | K | 86.3 | Confident | 91.1 | Very high | 219 Ų | 219 | 70.6 Ų | 70.6 | 95% | 0.952 | 38% | 0.379 | S | S | * | . | P | Polyproline II helix | trans | -70.9 | 119.5 | 178.9 | -174.9 | -178.4 | 179.4 | -175.3 | 0 | 109.7 | ||
| 277 | S | 87.4 | Confident | 91.3 | Very high | 73 Ų | 73 | 71.1 Ų | 71.1 | 51% | 0.51 | 37% | 0.365 | S | S | . | . | trans | -135.8 | 153.8 | 176.5 | 70.7 | 0 | 0 | 0 | 0 | 111.5 | A275 N279 G280 | A275-S277 PolarHBondContact O-N 3.01Å; S277-N279 PolarHBondContact O-N 3.39Å; S277-N279 VanDerWaalsContact O-N 3.11Å; S277-G280 PolarHBondContact O-N 3Å; S277-G280 WeakPolarHBondContact OG-CA 3.49Å; S277-G280 PolarHBondContact OG-N 3.39Å | ||
| 278 | K | 87.9 | Confident | 91.4 | Very high | 214 Ų | 214 | 68.7 Ų | 68.7 | 93% | 0.93 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.1 | -38.2 | -175 | -172.6 | 174.6 | -179.6 | 176.9 | 0 | 113.4 | ||
| 279 | N | 89.4 | Confident | 91.3 | Very high | 95 Ų | 95 | 75.4 Ų | 75.4 | 51% | 0.508 | 38% | 0.383 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.8 | 5.1 | -179.6 | -63.5 | -15 | 0 | 0 | 0 | 113.5 | S277 G281 R282 S283 | S277-N279 PolarHBondContact O-N 3.39Å; S277-N279 VanDerWaalsContact O-N 3.11Å; N279-G281 VanDerWaalsContact C-N 3.31Å; N279-G281 PolarHBondContact O-N 2.78Å; N279-R282 WeakPolarHBondContact O-CB 3.4Å; N279-R282 PolarHBondContact O-N 3.13Å; N279-S283 PolarHBondContact O-N 3.17Å |
| 280 | G | 88.6 | Confident | 91.3 | Very high | 14 Ų | 14 | 83.3 Ų | 83.3 | 14% | 0.144 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -58.3 | -38 | -170.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | S277 R282 L284 | S277-G280 PolarHBondContact O-N 3Å; S277-G280 WeakPolarHBondContact OG-CA 3.49Å; S277-G280 PolarHBondContact OG-N 3.39Å; G280-R282 VanDerWaalsContact C-N 3.33Å; G280-R282 PolarHBondContact O-N 3.03Å; G280-L284 WeakPolarHBondContact O-CB 3.45Å; G280-L284 PolarHBondContact O-N 2.86Å |
| 281 | G | 89.1 | Confident | 91.3 | Very high | 37 Ų | 37 | 82.9 Ų | 82.9 | 38% | 0.381 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -73 | -18 | 175.7 | 0 | 0 | 0 | 0 | 0 | 115 | N279 R285 | N279-G281 VanDerWaalsContact C-N 3.31Å; N279-G281 PolarHBondContact O-N 2.78Å; G281-R285 WeakPolarHBondContact O-CG 3.39Å; G281-R285 PolarHBondContact O-NE 3.23Å |
| 282 | R | 90.9 | Very high | 91 | Very high | 162 Ų | 162 | 84.2 Ų | 84.2 | 61% | 0.611 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -84.8 | -50.7 | 171.3 | -162.9 | -164.5 | -71.8 | 169.6 | -4.4 | 109.9 | N279 G280 L284 R285 E286 | N279-R282 WeakPolarHBondContact O-CB 3.4Å; N279-R282 PolarHBondContact O-N 3.13Å; G280-R282 VanDerWaalsContact C-N 3.33Å; G280-R282 PolarHBondContact O-N 3.03Å; R282-L284 PolarHBondContact O-N 3.46Å; R282-L284 VanDerWaalsContact O-N 3.14Å; R282-R285 WeakPolarHBondContact O-CA 3.45Å; R282-R285 WeakPolarHBondContact O-CB 3.48Å; R282-R285 PolarHBondContact O-N 3.02Å; R282-E286 WeakPolarHBondContact CD-OE1 3.5Å; R282-E286 WeakPolarHBondContact CG-OE1 3.41Å; R282-E286 WeakPolarHBondContact O-CG 3.49Å; R282-E286 PolarHBondContact O-N 3.48Å |
| 283 | S | 92.2 | Very high | 90.9 | Very high | 41 Ų | 41 | 84.4 Ų | 84.4 | 29% | 0.287 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -52.5 | -33.5 | 172.1 | 162.7 | 0 | 0 | 0 | 0 | 113.5 | R274 N279 E286 R287 | R274-S283 PolarHBondContact NH2-OG 3.36Å; N279-S283 PolarHBondContact O-N 3.17Å; S283-E286 WeakPolarHBondContact CA-OE2 3.48Å; S283-R287 WeakPolarHBondContact O-CB 3.5Å; S283-R287 PolarHBondContact O-N 3.23Å |
| 284 | L | 92.7 | Very high | 90.6 | Very high | 2 Ų | 2 | 87.9 Ų | 87.9 | 1% | 0.01 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -67.4 | -44.4 | 173 | -175.9 | 57.6 | 0 | 0 | 0 | 112 | F230 A265 L268 L272 G280 R282 R287 L288 L295 | F230-L284 HydrophobicContact CE1-CD1 4.25Å; F230-L284 HydrophobicContact CZ-CD1 4.2Å; A265-L284 HydrophobicContact CB-CD2 4.22Å; A265-L284 WeakPolarHBondContact O-CD2 3.4Å; L268-L284 HydrophobicContact CB-CD2 4.34Å; L268-L284 HydrophobicContact CD2-CD2 4.13Å; L268-L284 HydrophobicContact CG-CD2 4.21Å; L272-L284 HydrophobicContact CD1-CD1 3.94Å; G280-L284 WeakPolarHBondContact O-CB 3.45Å; G280-L284 PolarHBondContact O-N 2.86Å; R282-L284 PolarHBondContact O-N 3.46Å; R282-L284 VanDerWaalsContact O-N 3.14Å; L284-R287 PolarHBondContact O-N 3.44Å; L284-L288 HydrophobicContact CD1-CD1 4.11Å; L284-L288 HydrophobicContact CD1-CG 4.26Å; L284-L288 HydrophobicContact CG-CD1 3.93Å; L284-L288 WeakPolarHBondContact O-CD1 3.46Å; L284-L288 WeakPolarHBondContact O-CG 3.38Å; L284-L288 PolarHBondContact O-N 3.46Å; L284-L295 HydrophobicContact CD2-CD2 4.46Å |
| 285 | R | 92.7 | Very high | 90.6 | Very high | 76 Ų | 76 | 83.8 Ų | 83.8 | 29% | 0.287 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -65.3 | -49.5 | 178.9 | -63.5 | 170.5 | -158 | -87.7 | 3.7 | 111.1 | G281 R282 R287 L288 E289 L295 P296 | G281-R285 WeakPolarHBondContact O-CG 3.39Å; G281-R285 PolarHBondContact O-NE 3.23Å; R282-R285 WeakPolarHBondContact O-CA 3.45Å; R282-R285 WeakPolarHBondContact O-CB 3.48Å; R282-R285 PolarHBondContact O-N 3.02Å; R285-R287 PolarHBondContact O-N 2.98Å; R285-R287 VanDerWaalsContact O-N 3.15Å; R285-L288 PolarHBondContact O-N 2.99Å; R285-E289 WeakPolarHBondContact O-CB 3.47Å; R285-E289 PolarHBondContact O-N 3.43Å; R285-L295 HydrophobicContact CG-CB 4.4Å; R285-L295 HydrophobicContact CG-CG 4.45Å; R285-L295 PolarHBondContact NH1-O 3.36Å; R285-P296 PolarHBondContact NH1-O 3.02Å |
| 286 | E | 93.6 | Very high | 90.4 | Very high | 88 Ų | 88 | 81.6 Ų | 81.6 | 41% | 0.411 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -54.2 | -33.8 | 175.4 | -66 | 160.8 | -169.6 | 0 | 0 | 112.7 | R282 S283 K290 | R282-E286 WeakPolarHBondContact CD-OE1 3.5Å; R282-E286 WeakPolarHBondContact CG-OE1 3.41Å; R282-E286 WeakPolarHBondContact O-CG 3.49Å; R282-E286 PolarHBondContact O-N 3.48Å; S283-E286 WeakPolarHBondContact CA-OE2 3.48Å; E286-K290 WeakPolarHBondContact O-CD 3.28Å; E286-K290 VanDerWaalsContact O-CG 3.29Å; E286-K290 WeakPolarHBondContact O-CG 3.46Å; E286-K290 PolarHBondContact O-N 3.06Å |
| 287 | R | 93.4 | Very high | 90 | Very high | 114 Ų | 114 | 75.1 Ų | 75.1 | 43% | 0.43 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -81.4 | -29.8 | 177.7 | -166 | 177.3 | -175.1 | -126.3 | -6.2 | 113.3 | F230 S283 L284 R285 | F230-R287 HydrophobicContact CE2-CG 3.9Å; F230-R287 HydrophobicContact CZ-CB 4.45Å; F230-R287 HydrophobicContact CZ-CG 4.07Å; F230-R287 PolarHBondContact O-NH1 3.35Å; F230-R287 PolarHBondContact O-NH2 2.97Å; S283-R287 WeakPolarHBondContact O-CB 3.5Å; S283-R287 PolarHBondContact O-N 3.23Å; L284-R287 PolarHBondContact O-N 3.44Å; R285-R287 PolarHBondContact O-N 2.98Å; R285-R287 VanDerWaalsContact O-N 3.15Å |
| 288 | L | 94 | Very high | 89.4 | Confident | 0 Ų | 0 | 75.3 Ų | 75.3 | 0% | 0 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -75.5 | -40.6 | 175.2 | -67.7 | 167.2 | 0 | 0 | 0 | 110.9 | F230 V253 L257 L268 L284 R285 K290 I291 G292 L293 L295 | F230-L288 HydrophobicContact CE1-CD2 4.33Å; F230-L288 HydrophobicContact CE2-CD2 3.94Å; F230-L288 HydrophobicContact CZ-CD2 3.69Å; F230-L288 HydrophobicContact CZ-CG 4.23Å; V253-L288 HydrophobicContact CG1-CD2 3.5Å; V253-L288 VanDerWaalsContact CG1-CD2 3.5Å; L257-L288 HydrophobicContact CD1-CD1 4.22Å; L268-L288 HydrophobicContact CD2-CD1 4.15Å; L284-L288 HydrophobicContact CD1-CD1 4.11Å; L284-L288 HydrophobicContact CD1-CG 4.26Å; L284-L288 HydrophobicContact CG-CD1 3.93Å; L284-L288 WeakPolarHBondContact O-CD1 3.46Å; L284-L288 WeakPolarHBondContact O-CG 3.38Å; L284-L288 PolarHBondContact O-N 3.46Å; R285-L288 PolarHBondContact O-N 2.99Å; L288-K290 VanDerWaalsContact C-N 3.31Å; L288-K290 PolarHBondContact O-N 3.36Å; L288-I291 HydrophobicContact CD2-CD1 4.48Å; L288-I291 CarbonylContact O-C 3.57Å; L288-I291 WeakPolarHBondContact O-CG1 3.45Å; L288-I291 PolarHBondContact O-N 2.99Å; L288-G292 PolarHBondContact O-N 2.86Å; L288-L293 CarbonylContact C-O 3.46Å; L288-L293 HydrophobicContact CB-CB 4.07Å; L288-L293 WeakPolarHBondContact CB-O 3.34Å; L288-L293 HydrophobicContact CD2-CB 4.31Å; L288-L293 HydrophobicContact CD2-CD1 4.2Å; L288-L293 PolarHBondContact O-N 3.14Å; L288-L295 HydrophobicContact CD1-CB 3.78Å; L288-L295 HydrophobicContact CD1-CD2 3.65Å; L288-L295 HydrophobicContact CD1-CG 4.39Å |
| 289 | E | 93.2 | Very high | 89 | Confident | 140 Ų | 140 | 69.6 Ų | 69.6 | 65% | 0.654 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -58.7 | -42 | 176.9 | -175.4 | 168.5 | -146.9 | 0 | 0 | 111.8 | R285 I291 G292 L293 | R285-E289 WeakPolarHBondContact O-CB 3.47Å; R285-E289 PolarHBondContact O-N 3.43Å; E289-I291 PolarHBondContact O-N 3.43Å; E289-I291 VanDerWaalsContact O-N 3.1Å; E289-G292 PolarHBondContact O-N 2.93Å; E289-L293 PolarHBondContact N-O 2.77Å |
| 290 | K | 93.4 | Very high | 88.3 | Confident | 178 Ų | 178 | 75.6 Ų | 75.6 | 77% | 0.774 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -15.3 | 174.1 | -76.5 | 174.8 | -179.3 | -175.6 | 0 | 115.5 | E286 L288 | E286-K290 WeakPolarHBondContact O-CD 3.28Å; E286-K290 VanDerWaalsContact O-CG 3.29Å; E286-K290 WeakPolarHBondContact O-CG 3.46Å; E286-K290 PolarHBondContact O-N 3.06Å; L288-K290 VanDerWaalsContact C-N 3.31Å; L288-K290 PolarHBondContact O-N 3.36Å |
| 291 | I | 92.8 | Very high | 87.9 | Confident | 31 Ų | 31 | 79.9 Ų | 79.9 | 16% | 0.159 | 41% | 0.408 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -115.8 | 17.7 | 175.5 | 62.1 | 164.5 | 0 | 0 | 0 | 112.3 | F230 V250 L288 E289 L293 | F230-I291 HydrophobicContact CD2-CD1 3.56Å; F230-I291 HydrophobicContact CE2-CD1 3.73Å; V250-I291 HydrophobicContact CB-CD1 4.46Å; V250-I291 HydrophobicContact CG1-CD1 4.05Å; V250-I291 HydrophobicContact CG2-CD1 3.73Å; L288-I291 HydrophobicContact CD2-CD1 4.48Å; L288-I291 CarbonylContact O-C 3.57Å; L288-I291 WeakPolarHBondContact O-CG1 3.45Å; L288-I291 PolarHBondContact O-N 2.99Å; E289-I291 PolarHBondContact O-N 3.43Å; E289-I291 VanDerWaalsContact O-N 3.1Å; I291-L293 VanDerWaalsContact C-N 3.34Å; I291-L293 HydrophobicContact CD1-CD1 3.97Å; I291-L293 HydrophobicContact CD1-CG 4.25Å; I291-L293 HydrophobicContact CG1-CB 4.41Å; I291-L293 HydrophobicContact CG1-CG 4.3Å; I291-L293 PolarHBondContact O-N 3.39Å |
| 292 | G | 90.6 | Very high | 87.5 | Confident | 33 Ų | 33 | 81.5 Ų | 81.5 | 34% | 0.34 | 42% | 0.418 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.5 | 13 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | L288 E289 | L288-G292 PolarHBondContact O-N 2.86Å; E289-G292 PolarHBondContact O-N 2.93Å |
| 293 | L | 91.9 | Very high | 87.1 | Confident | 14 Ų | 14 | 74.8 Ų | 74.8 | 7% | 0.073 | 40% | 0.397 | C | S | . | . | trans | -101.3 | 115.3 | 176.7 | -67.4 | -172.3 | 0 | 0 | 0 | 111.8 | V224 V250 V253 Q254 L288 E289 I291 | V224-L293 HydrophobicContact CG1-CD2 4.04Å; V224-L293 HydrophobicContact CG1-CG 4.41Å; V250-L293 HydrophobicContact CG1-CD1 4.06Å; V250-L293 HydrophobicContact CG1-CG 4.47Å; V253-L293 HydrophobicContact CB-CD1 4.2Å; V253-L293 HydrophobicContact CG1-CD1 3.84Å; Q254-L293 HydrophobicContact CB-CD1 4.33Å; Q254-L293 HydrophobicContact CB-CD2 4.02Å; Q254-L293 HydrophobicContact CG-CD2 3.93Å; L288-L293 CarbonylContact C-O 3.46Å; L288-L293 HydrophobicContact CB-CB 4.07Å; L288-L293 WeakPolarHBondContact CB-O 3.34Å; L288-L293 HydrophobicContact CD2-CB 4.31Å; L288-L293 HydrophobicContact CD2-CD1 4.2Å; L288-L293 PolarHBondContact O-N 3.14Å; E289-L293 PolarHBondContact N-O 2.77Å; I291-L293 VanDerWaalsContact C-N 3.34Å; I291-L293 HydrophobicContact CD1-CD1 3.97Å; I291-L293 HydrophobicContact CD1-CG 4.25Å; I291-L293 HydrophobicContact CG1-CB 4.41Å; I291-L293 HydrophobicContact CG1-CG 4.3Å; I291-L293 PolarHBondContact O-N 3.39Å | ||
| 294 | N | 89.2 | Confident | 87 | Confident | 129 Ų | 129 | 79.1 Ų | 79.1 | 69% | 0.69 | 42% | 0.417 | S | S | * | . | trans | -86.4 | 125.6 | 173.7 | -173.8 | -10.8 | 0 | 0 | 0 | 111.6 | ||||
| 295 | L | 87.6 | Confident | 86.9 | Confident | 7 Ų | 7 | 82.5 Ų | 82.5 | 4% | 0.037 | 44% | 0.438 | C | S | . | . | trans | -114.7 | 100.5 | 167.4 | 176.3 | 45.8 | 0 | 0 | 0 | 109.7 | L257 A265 L268 L284 R285 L288 | L257-L295 HydrophobicContact CD1-CB 4.19Å; L257-L295 HydrophobicContact CD2-CD1 3.75Å; L257-L295 HydrophobicContact CD2-CD2 4.09Å; L257-L295 HydrophobicContact CD2-CG 4.37Å; A265-L295 HydrophobicContact CB-CD2 3.81Å; L268-L295 HydrophobicContact CD2-CD2 4.24Å; L284-L295 HydrophobicContact CD2-CD2 4.46Å; R285-L295 HydrophobicContact CG-CB 4.4Å; R285-L295 HydrophobicContact CG-CG 4.45Å; R285-L295 PolarHBondContact NH1-O 3.36Å; L288-L295 HydrophobicContact CD1-CB 3.78Å; L288-L295 HydrophobicContact CD1-CD2 3.65Å; L288-L295 HydrophobicContact CD1-CG 4.39Å | ||
| 296 | P | 80.5 | Confident | 87 | Confident | 46 Ų | 46 | 82.1 Ų | 82.1 | 30% | 0.299 | 44% | 0.444 | S | S | . | . | trans | -73.1 | 154.9 | -176.3 | 27.4 | -34.2 | 0 | 0 | 0 | 113.2 | R285 R299 | R285-P296 PolarHBondContact NH1-O 3.02Å; P296-R299 HydrophobicContact CG-CB 4.45Å | ||
| 297 | A | 79.9 | Confident | 87.1 | Confident | 84 Ų | 84 | 85.3 Ų | 85.3 | 69% | 0.694 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.8 | 158.5 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | R299 | A297-R299 PolarHBondContact O-N 3.26Š|
| 298 | G | 74.3 | Confident | 87.2 | Confident | 77 Ų | 77 | 81.9 Ų | 81.9 | 79% | 0.794 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.7 | -4.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | R300 | G298-R300 PolarHBondContact O-N 3.08Š|
| 299 | R | 78.1 | Confident | 87.3 | Confident | 94 Ų | 94 | 82.2 Ų | 82.2 | 36% | 0.355 | 46% | 0.455 | S | S | . | . | P | Polyproline II helix | trans | -54.7 | 122.4 | 179.8 | 179.9 | 168.6 | -69.9 | -147 | -1.8 | 111.4 | L257 P296 A297 | L257-R299 PolarHBondContact O-NH1 3.41Å; P296-R299 HydrophobicContact CG-CB 4.45Å; A297-R299 PolarHBondContact O-N 3.26Å |
| 300 | R | 75.3 | Confident | 87.3 | Confident | 221 Ų | 221 | 77.4 Ų | 77.4 | 83% | 0.834 | 44% | 0.437 | S | S | * | . | P | Polyproline II helix | trans | -79.4 | 145.7 | 170.5 | -59.8 | -178 | -177.3 | -174.6 | 0.5 | 109.4 | G298 | G298-R300 PolarHBondContact O-N 3.08Š|
| 301 | K | 80.1 | Confident | 87.5 | Confident | 104 Ų | 104 | 69.4 Ų | 69.4 | 45% | 0.452 | 40% | 0.403 | S | S | . | . | P | Polyproline II helix | trans | -60.9 | 149.4 | 167.2 | 65.8 | 176 | -172.5 | 169.9 | 0 | 109.7 | L267 A303 V305 | L267-K301 HydrophobicContact CD1-CB 4.38Å; K301-A303 WeakPolarHBondContact CD-O 3.27Å; K301-V305 HydrophobicContact CD-CG2 4.21Å |
| 302 | A | 80.6 | Confident | 87.7 | Confident | 70 Ų | 70 | 68 Ų | 68 | 58% | 0.579 | 40% | 0.395 | S | S | * | . | trans | -104.1 | -44.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | P260 E261 C262 | P260-A302 WeakPolarHBondContact O-CB 3.47Å; E261-A302 PolarHBondContact O-N 3.34Å; C262-A302 HydrophobicContact CB-CB 3.75Å | ||
| 303 | A | 84.2 | Confident | 88 | Confident | 22 Ų | 22 | 66.8 Ų | 66.8 | 18% | 0.182 | 38% | 0.381 | C | S | . | . | S | Bend | trans | -80 | 160.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | P260 E261 K301 | P260-A303 PolarHBondContact O-N 3.26Å; E261-A303 HydrophobicContact CG-CB 4.46Å; E261-A303 PolarHBondContact O-N 2.97Å; K301-A303 WeakPolarHBondContact CD-O 3.27Å |
| 304 | N | 89 | Confident | 88.2 | Confident | 131 Ų | 131 | 67.6 Ų | 67.6 | 70% | 0.701 | 39% | 0.392 | S | S | * | . | P | Polyproline II helix | trans | -71.5 | 141.9 | 161.5 | -78.4 | -33.7 | 0 | 0 | 0 | 109.9 | ||
| 305 | V | 90.8 | Very high | 88.5 | Confident | 74 Ų | 74 | 61.7 Ų | 61.7 | 45% | 0.448 | 36% | 0.36 | S | S | . | . | P | Polyproline II helix | trans | -80.1 | 124.3 | 175.8 | 176.4 | 0 | 0 | 0 | 0 | 107.5 | L267 K301 T309 | L267-V305 HydrophobicContact CD1-CG2 4.13Å; L267-V305 HydrophobicContact CD2-CG2 4.21Å; K301-V305 HydrophobicContact CD-CG2 4.21Å; V305-T309 HydrophobicContact CG1-CG2 4.06Å |
| 306 | T | 94.1 | Very high | 88.9 | Confident | 68 Ų | 68 | 61.3 Ų | 61.3 | 42% | 0.417 | 36% | 0.359 | S | S | . | . | trans | -114.6 | 178.5 | 177.6 | 68 | 0 | 0 | 0 | 0 | 110.6 | L308 T309 | T306-L308 PolarHBondContact O-N 3.49Å; T306-L308 PolarHBondContact OG1-N 2.84Å; T306-T309 PolarHBondContact N-OG1 3.4Å; T306-T309 WeakPolarHBondContact O-CB 3.46Å; T306-T309 PolarHBondContact O-N 2.88Å; T306-T309 PolarHBondContact OG1-N 3.02Å | ||
| 307 | L | 95.4 | Very high | 89.7 | Confident | 155 Ų | 155 | 62 Ų | 62 | 81% | 0.812 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -61.9 | -34.5 | 168.7 | -61.9 | 179.3 | 0 | 0 | 0 | 111.6 | S310 | L307-S310 WeakPolarHBondContact O-CB 3.37Å; L307-S310 PolarHBondContact O-N 3.33Å; L307-S310 VanDerWaalsContact O-N 3.13Å; L307-S310 PolarHBondContact O-OG 2.92Å |
| 308 | L | 96.1 | Very high | 90.4 | Very high | 42 Ų | 42 | 60.9 Ų | 60.9 | 22% | 0.22 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64.8 | -39.3 | 177.8 | -60.8 | 177.4 | 0 | 0 | 0 | 111.9 | T306 S310 L311 T402 H403 F405 | T306-L308 PolarHBondContact O-N 3.49Å; T306-L308 PolarHBondContact OG1-N 2.84Å; L308-S310 PolarHBondContact O-N 3.1Å; L308-L311 HydrophobicContact CD2-CD1 4.02Å; L308-L311 WeakPolarHBondContact O-CB 3.37Å; L308-L311 PolarHBondContact O-N 3.43Å; L308-T402 HydrophobicContact CD1-CG2 3.8Å; L308-H403 PolarHBondContact O-ND1 2.76Å; L308-F405 HydrophobicContact CD1-CD1 4.38Å; L308-F405 HydrophobicContact CD2-CD1 4.13Å; L308-F405 HydrophobicContact CD2-CG 4.44Å |
| 309 | T | 95.3 | Very high | 91.5 | Very high | 6 Ų | 6 | 60 Ų | 60 | 4% | 0.037 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -51.2 | -27.2 | 172.7 | -60.9 | 0 | 0 | 0 | 0 | 113 | R256 E261 L263 V271 V305 T306 H403 | R256-T309 PolarHBondContact NH1-O 3.04Å; E261-T309 VanDerWaalsContact OE1-CG2 3.24Å; E261-T309 WeakPolarHBondContact OE1-CG2 3.48Å; E261-T309 PolarHBondContact OE1-OG1 3.22Å; L263-T309 HydrophobicContact CD2-CG2 4.34Å; V271-T309 WeakPolarHBondContact CG2-O 3.37Å; V305-T309 HydrophobicContact CG1-CG2 4.06Å; T306-T309 PolarHBondContact N-OG1 3.4Å; T306-T309 WeakPolarHBondContact O-CB 3.46Å; T306-T309 PolarHBondContact O-N 2.88Å; T306-T309 PolarHBondContact OG1-N 3.02Å; T309-H403 WeakPolarHBondContact CA-CE1 3.49Å; T309-H403 PolarHBondContact N-CE1 3.07Å; T309-H403 VanDerWaalsContact N-CE1 3.35Å; T309-H403 PolarHBondContact OG1-CE1 3.5Å |
| 310 | S | 94.3 | Very high | 92.4 | Very high | 40 Ų | 40 | 55.8 Ų | 55.8 | 28% | 0.28 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -75.4 | -30.4 | 178.8 | 82.7 | 0 | 0 | 0 | 0 | 114.1 | R236 L307 L308 | R236-S310 VanDerWaalsContact CZ-O 3.3Å; R236-S310 PolarHBondContact NE-O 3.05Å; R236-S310 PolarHBondContact NH2-O 3.44Å; L307-S310 WeakPolarHBondContact O-CB 3.37Å; L307-S310 PolarHBondContact O-N 3.33Å; L307-S310 VanDerWaalsContact O-N 3.13Å; L307-S310 PolarHBondContact O-OG 2.92Å; L308-S310 PolarHBondContact O-N 3.1Å |
| 311 | L | 96.5 | Very high | 93.5 | Very high | 10 Ų | 10 | 53.1 Ų | 53.1 | 5% | 0.052 | 29% | 0.294 | C | S | . | . | S | Bend | trans | -72.2 | 147.7 | 178.2 | -57 | 179.6 | 0 | 0 | 0 | 109.6 | L237 R256 L308 E315 A316 L319 | L237-L311 HydrophobicContact CD1-CD2 4.1Å; L237-L311 HydrophobicContact CG-CD2 4.33Å; R256-L311 PolarHBondContact NH2-O 3.22Å; L308-L311 HydrophobicContact CD2-CD1 4.02Å; L308-L311 WeakPolarHBondContact O-CB 3.37Å; L308-L311 PolarHBondContact O-N 3.43Å; L311-E315 WeakPolarHBondContact CA-OE2 3.4Å; L311-E315 HydrophobicContact CB-CB 4.18Å; L311-E315 HydrophobicContact CD2-CB 4.29Å; L311-A316 HydrophobicContact CB-CB 4.43Å; L311-A316 HydrophobicContact CD1-CB 4.36Å; L311-L319 HydrophobicContact CD1-CD2 3.97Å |
| 312 | V | 97.2 | Very high | 94.3 | Very high | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 29% | 0.291 | C | S | . | . | trans | -87 | 159.4 | 162.6 | -67.4 | 0 | 0 | 0 | 0 | 110.5 | V233 Y246 V248 E252 V271 G314 E315 A316 | V233-V312 HydrophobicContact CG2-CG1 4.15Å; V233-V312 HydrophobicContact CG2-CG2 3.82Å; Y246-V312 HydrophobicContact CG-CG2 4.36Å; V248-V312 HydrophobicContact CG2-CB 4.09Å; V248-V312 HydrophobicContact CG2-CG1 3.6Å; V248-V312 HydrophobicContact CG2-CG2 4.35Å; E252-V312 VanDerWaalsContact OE1-CA 3.27Å; E252-V312 WeakPolarHBondContact OE1-CA 3.47Å; E252-V312 WeakPolarHBondContact OE1-CB 3.39Å; V271-V312 HydrophobicContact CG1-CG1 3.71Å; V312-G314 PolarHBondContact O-N 3.11Å; V312-G314 VanDerWaalsContact O-N 3.12Å; V312-E315 HydrophobicContact CG2-CB 4.39Å; V312-E315 HydrophobicContact CG2-CG 3.86Å; V312-E315 WeakPolarHBondContact CG2-OE2 3.45Å; V312-E315 PolarHBondContact N-OE2 3.44Å; V312-E315 WeakPolarHBondContact O-CA 3.41Å; V312-E315 WeakPolarHBondContact O-CB 3.38Å; V312-E315 PolarHBondContact O-N 3.45Å; V312-A316 PolarHBondContact O-N 2.96Å | ||
| 313 | E | 97.1 | Very high | 95.1 | Very high | 9 Ų | 9 | 52.1 Ų | 52.1 | 4% | 0.042 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -53.4 | -38.6 | -176.4 | -71.3 | 174.6 | -163.2 | 0 | 0 | 112.4 | E252 R255 E315 A316 V317 I378 G379 H403 | E252-E313 WeakPolarHBondContact CA-OE1 3.39Å; E252-E313 HydrophobicContact CB-CG 4.41Å; E252-E313 WeakPolarHBondContact CB-OE1 3.41Å; E252-E313 HydrophobicContact CG-CG 3.95Å; E252-E313 WeakPolarHBondContact CG-OE1 3.37Å; E252-E313 PolarHBondContact OE1-N 3.09Å; E252-E313 PolarHBondContact OE2-N 2.81Å; R255-E313 IonicContact CZ-OE1 3.77Å; R255-E313 VanDerWaalsContact CZ-OE1 3.3Å; R255-E313 IonicContact CZ-OE2 2.84Å; R255-E313 IonicContact NE-OE1 3.44Å; R255-E313 PolarHBondContact NE-OE1 3.31Å; R255-E313 IonicContact NE-OE2 3.78Å; R255-E313 VanDerWaalsContact NH2-CD 3.28Å; R255-E313 IonicContact NH2-OE1 3.74Å; R255-E313 PolarHBondContact NH2-OE1 3.03Å; R255-E313 IonicContact NH2-OE2 3.5Å; R255-E313 PolarHBondContact NH2-OE2 3.47Å; E313-E315 VanDerWaalsContact C-N 3.29Å; E313-E315 PolarHBondContact O-N 2.86Å; E313-A316 PolarHBondContact O-N 3.44Å; E313-V317 WeakPolarHBondContact O-CB 3.45Å; E313-V317 WeakPolarHBondContact O-CG2 3.38Å; E313-V317 PolarHBondContact O-N 2.68Å; E313-I378 HydrophobicContact CG-CG2 4.39Å; E313-G379 WeakPolarHBondContact OE2-CA 3.27Å; E313-G379 PolarHBondContact OE2-N 2.7Å; E313-H403 HydrophobicContact CG-CB 4.02Å |
| 314 | G | 95.7 | Very high | 95.8 | Very high | 30 Ų | 30 | 52.1 Ų | 52.1 | 31% | 0.309 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -63.8 | -27.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | Y246 V312 H318 | Y246-G314 VanDerWaalsContact CD1-C 3.4Å; Y246-G314 WeakPolarHBondContact CD1-O 3.33Å; Y246-G314 VanDerWaalsContact CE1-O 3.22Å; Y246-G314 WeakPolarHBondContact CE1-O 3.35Å; V312-G314 PolarHBondContact O-N 3.11Å; V312-G314 VanDerWaalsContact O-N 3.12Å; G314-H318 WeakPolarHBondContact O-CB 3.4Å; G314-H318 PolarHBondContact O-N 3.11Å |
| 315 | E | 96.1 | Very high | 96.2 | Very high | 5 Ų | 5 | 52.9 Ų | 52.9 | 2% | 0.023 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -81.2 | -43.1 | 172.8 | -69.6 | 172.5 | 131.8 | 0 | 0 | 111.3 | G235 R236 Y246 R273 L311 V312 E313 V317 H318 L319 | G235-E315 VanDerWaalsContact CA-OE1 3.27Å; G235-E315 WeakPolarHBondContact CA-OE1 3.25Å; R236-E315 PolarHBondContact N-OE1 3.44Å; Y246-E315 HydrophobicContact CD1-CG 4Å; Y246-E315 HydrophobicContact CD2-CG 3.45Å; Y246-E315 VanDerWaalsContact CD2-CG 3.45Å; Y246-E315 HydrophobicContact CE1-CG 4.03Å; Y246-E315 HydrophobicContact CE2-CG 3.49Å; Y246-E315 VanDerWaalsContact CE2-CG 3.49Å; Y246-E315 HydrophobicContact CG-CG 3.71Å; R273-E315 IonicContact CZ-OE1 3.01Å; R273-E315 IonicContact CZ-OE2 3.32Å; R273-E315 VanDerWaalsContact NH1-CD 3.29Å; R273-E315 IonicContact NH1-OE1 3.64Å; R273-E315 PolarHBondContact NH1-OE1 2.89Å; R273-E315 IonicContact NH1-OE2 1.95Å; R273-E315 PolarHBondContact NH1-OE2 2.92Å; R273-E315 IonicContact NH2-OE1 3.88Å; R273-E315 IonicContact NH2-OE2 2.95Å; R273-E315 PolarHBondContact NH2-OE2 3.05Å; L311-E315 WeakPolarHBondContact CA-OE2 3.4Å; L311-E315 HydrophobicContact CB-CB 4.18Å; L311-E315 HydrophobicContact CD2-CB 4.29Å; V312-E315 HydrophobicContact CG2-CB 4.39Å; V312-E315 HydrophobicContact CG2-CG 3.86Å; V312-E315 WeakPolarHBondContact CG2-OE2 3.45Å; V312-E315 PolarHBondContact N-OE2 3.44Å; V312-E315 WeakPolarHBondContact O-CA 3.41Å; V312-E315 WeakPolarHBondContact O-CB 3.38Å; V312-E315 PolarHBondContact O-N 3.45Å; E313-E315 VanDerWaalsContact C-N 3.29Å; E313-E315 PolarHBondContact O-N 2.86Å; E315-V317 PolarHBondContact O-N 3.12Å; E315-H318 PolarHBondContact O-N 3.48Å; E315-L319 WeakPolarHBondContact O-CB 3.49Å; E315-L319 PolarHBondContact O-N 3.34Å |
| 316 | A | 97.3 | Very high | 96.6 | Very high | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61.9 | -43.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L311 V312 E313 A320 H403 F405 | L311-A316 HydrophobicContact CB-CB 4.43Å; L311-A316 HydrophobicContact CD1-CB 4.36Å; V312-A316 PolarHBondContact O-N 2.96Å; E313-A316 PolarHBondContact O-N 3.44Å; A316-A320 WeakPolarHBondContact O-CB 3.39Å; A316-A320 PolarHBondContact O-N 2.87Å; A316-H403 HydrophobicContact CB-CB 3.84Å; A316-H403 WeakPolarHBondContact CB-O 3.45Å; A316-F405 HydrophobicContact CB-CB 4.05Å |
| 317 | V | 95.6 | Very high | 96.8 | Very high | 61 Ų | 61 | 51.4 Ų | 51.4 | 37% | 0.37 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -69.2 | -32.8 | 174.8 | 173.4 | 0 | 0 | 0 | 0 | 112.2 | E313 E315 R321 I378 | E313-V317 WeakPolarHBondContact O-CB 3.45Å; E313-V317 WeakPolarHBondContact O-CG2 3.38Å; E313-V317 PolarHBondContact O-N 2.68Å; E315-V317 PolarHBondContact O-N 3.12Å; V317-R321 PolarHBondContact O-N 3.33Å; V317-I378 HydrophobicContact CG2-CG2 4.5Å |
| 318 | H | 95.7 | Very high | 96.8 | Very high | 59 Ų | 59 | 50.5 Ų | 50.5 | 27% | 0.273 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -70.4 | -48 | 176 | -162.1 | -175.2 | 0 | 0 | 0 | 111.1 | Y246 G314 E315 A320 R321 D322 | Y246-H318 HydrophobicContact CE1-CB 4.34Å; Y246-H318 AromaticContact CE1-ND1 3.93Å; Y246-H318 AromaticContact CZ-ND1 3.88Å; Y246-H318 PolarHBondContact OH-ND1 3.21Å; G314-H318 WeakPolarHBondContact O-CB 3.4Å; G314-H318 PolarHBondContact O-N 3.11Å; E315-H318 PolarHBondContact O-N 3.48Å; H318-A320 VanDerWaalsContact C-N 3.25Å; H318-A320 PolarHBondContact O-N 3.03Å; H318-R321 WeakPolarHBondContact O-CB 3.36Å; H318-R321 PolarHBondContact O-N 3.06Å; H318-D322 IonicContact CD2-OD1 2.74Å; H318-D322 PolarHBondContact CD2-OD1 2.9Å; H318-D322 IonicContact CD2-OD2 2.67Å; H318-D322 IonicContact NE2-OD1 2.74Å; H318-D322 PolarHBondContact O-N 3.5Å |
| 319 | L | 97.1 | Very high | 96.8 | Very high | 59 Ų | 59 | 51.6 Ų | 51.6 | 31% | 0.309 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -57.1 | -38.3 | 175.5 | -179.6 | 63.8 | 0 | 0 | 0 | 112.1 | L237 L311 E315 F323 F405 | L237-L319 HydrophobicContact CD1-CD1 4.07Å; L237-L319 HydrophobicContact CD1-CD2 4.03Å; L237-L319 HydrophobicContact CD1-CG 4.5Å; L311-L319 HydrophobicContact CD1-CD2 3.97Å; E315-L319 WeakPolarHBondContact O-CB 3.49Å; E315-L319 PolarHBondContact O-N 3.34Å; L319-F323 VanDerWaalsContact O-CB 3.25Å; L319-F323 WeakPolarHBondContact O-CB 3.31Å; L319-F323 PolarHBondContact O-N 2.97Å; L319-F405 HydrophobicContact CB-CD2 4.31Å; L319-F405 HydrophobicContact CB-CE2 4.5Å; L319-F405 HydrophobicContact CD2-CD2 4.14Å; L319-F405 HydrophobicContact CD2-CE2 4.02Å; L319-F405 HydrophobicContact CG-CD2 4.1Å; L319-F405 HydrophobicContact CG-CE2 3.85Å |
| 320 | A | 97.6 | Very high | 97 | Very high | 5 Ų | 5 | 57.4 Ų | 57.4 | 4% | 0.041 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -67.3 | -36.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113 | A316 H318 G324 F405 P408 | A316-A320 WeakPolarHBondContact O-CB 3.39Å; A316-A320 PolarHBondContact O-N 2.87Å; H318-A320 VanDerWaalsContact C-N 3.25Å; H318-A320 PolarHBondContact O-N 3.03Å; A320-G324 PolarHBondContact O-N 3.3Å; A320-F405 HydrophobicContact CB-CD2 3.7Å; A320-F405 HydrophobicContact CB-CE2 4.27Å; A320-F405 HydrophobicContact CB-CG 4.45Å; A320-P408 HydrophobicContact CB-CB 4.09Å |
| 321 | R | 96.8 | Very high | 97.1 | Very high | 166 Ų | 166 | 59.6 Ų | 59.6 | 63% | 0.626 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -65.7 | -48.1 | 173.9 | -177.7 | -167.9 | -63.2 | 148.9 | -0.5 | 111.1 | V317 H318 F323 G324 Y325 | V317-R321 PolarHBondContact O-N 3.33Å; H318-R321 WeakPolarHBondContact O-CB 3.36Å; H318-R321 PolarHBondContact O-N 3.06Å; R321-F323 VanDerWaalsContact C-N 3.33Å; R321-F323 PolarHBondContact O-N 3.5Å; R321-G324 WeakPolarHBondContact O-CA 3.2Å; R321-G324 PolarHBondContact O-N 3.45Å; R321-G324 VanDerWaalsContact O-N 3.11Å; R321-Y325 PolarHBondContact O-N 2.95Å |
| 322 | D | 96.9 | Very high | 97.2 | Very high | 73 Ų | 73 | 62.8 Ų | 62.8 | 39% | 0.39 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -66.1 | -39.3 | -176.8 | -62 | -4.6 | 0 | 0 | 0 | 110.7 | H318 Y325 I326 | H318-D322 IonicContact CD2-OD1 2.74Å; H318-D322 PolarHBondContact CD2-OD1 2.9Å; H318-D322 IonicContact CD2-OD2 2.67Å; H318-D322 IonicContact NE2-OD1 2.74Å; H318-D322 PolarHBondContact O-N 3.5Å; D322-Y325 PolarHBondContact O-N 2.86Å; D322-I326 VanDerWaalsContact O-CG1 3.31Å; D322-I326 WeakPolarHBondContact O-CG1 3.37Å; D322-I326 PolarHBondContact O-N 2.81Å |
| 323 | F | 98.4 | Very high | 97.3 | Very high | 80 Ų | 80 | 63.3 Ų | 63.3 | 35% | 0.351 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -61.7 | -43.7 | 169.8 | -179.8 | -107.6 | 0 | 0 | 0 | 112.2 | L319 R321 Y325 I326 C327 A409 A412 | L319-F323 VanDerWaalsContact O-CB 3.25Å; L319-F323 WeakPolarHBondContact O-CB 3.31Å; L319-F323 PolarHBondContact O-N 2.97Å; R321-F323 VanDerWaalsContact C-N 3.33Å; R321-F323 PolarHBondContact O-N 3.5Å; F323-Y325 PolarHBondContact O-N 3.38Å; F323-I326 PolarHBondContact O-N 3.06Å; F323-C327 VanDerWaalsContact CZ-SG 3.57Å; F323-C327 WeakPolarHBondContact O-CB 3.46Å; F323-C327 PolarHBondContact O-N 3.02Å; F323-C327 PolarHBondContact O-SG 3.37Å; F323-A409 HydrophobicContact CD1-CB 4.14Å; F323-A409 HydrophobicContact CE1-CB 4.32Å; F323-A412 HydrophobicContact CD1-CB 3.92Å; F323-A412 HydrophobicContact CE1-CB 4.01Å |
| 324 | G | 98.3 | Very high | 97.3 | Very high | 21 Ų | 21 | 68.3 Ų | 68.3 | 22% | 0.216 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -57.5 | -47.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | A320 R321 C327 E328 | A320-G324 PolarHBondContact O-N 3.3Å; R321-G324 WeakPolarHBondContact O-CA 3.2Å; R321-G324 PolarHBondContact O-N 3.45Å; R321-G324 VanDerWaalsContact O-N 3.11Å; G324-C327 WeakPolarHBondContact O-CB 3.45Å; G324-C327 PolarHBondContact O-N 3Å; G324-E328 PolarHBondContact O-N 3.22Å |
| 325 | Y | 98.4 | Very high | 97.4 | Very high | 147 Ų | 147 | 69.6 Ų | 69.6 | 58% | 0.576 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -58.9 | -48.6 | 175.8 | 178.3 | -89.9 | 0 | 0 | 0 | 111.6 | R321 D322 F323 C327 E328 T329 | R321-Y325 PolarHBondContact O-N 2.95Å; D322-Y325 PolarHBondContact O-N 2.86Å; F323-Y325 PolarHBondContact O-N 3.38Å; Y325-C327 VanDerWaalsContact C-N 3.32Å; Y325-C327 PolarHBondContact O-N 3.48Å; Y325-E328 PolarHBondContact O-N 3.22Å; Y325-T329 HydrophobicContact CD1-CG2 4.47Å; Y325-T329 HydrophobicContact CD2-CG2 4.21Å; Y325-T329 HydrophobicContact CE1-CG2 4.05Å; Y325-T329 WeakPolarHBondContact CE1-OG1 3.47Å; Y325-T329 HydrophobicContact CE2-CG2 3.78Å; Y325-T329 PolarHBondContact O-N 2.74Å; Y325-T329 PolarHBondContact O-OG1 2.89Å |
| 326 | I | 98.3 | Very high | 97.5 | Very high | 94 Ų | 94 | 71.8 Ų | 71.8 | 48% | 0.482 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63.5 | -37.4 | 178.6 | -66.8 | 166.4 | 0 | 0 | 0 | 111.6 | D322 F323 E328 E330 F331 | D322-I326 VanDerWaalsContact O-CG1 3.31Å; D322-I326 WeakPolarHBondContact O-CG1 3.37Å; D322-I326 PolarHBondContact O-N 2.81Å; F323-I326 PolarHBondContact O-N 3.06Å; I326-E328 PolarHBondContact O-N 2.74Å; I326-E330 HydrophobicContact CG2-CB 4.12Å; I326-E330 HydrophobicContact CG2-CG 4.1Å; I326-E330 WeakPolarHBondContact O-CB 3.42Å; I326-E330 PolarHBondContact O-N 3.36Å; I326-F331 PolarHBondContact O-N 2.93Å |
| 327 | C | 98.3 | Very high | 97.5 | Very high | 18 Ų | 18 | 71.9 Ų | 71.9 | 12% | 0.122 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -65.7 | -23.3 | 173 | -81.2 | 0 | 0 | 0 | 0 | 113.8 | F323 G324 Y325 F331 A412 A416 | F323-C327 VanDerWaalsContact CZ-SG 3.57Å; F323-C327 WeakPolarHBondContact O-CB 3.46Å; F323-C327 PolarHBondContact O-N 3.02Å; F323-C327 PolarHBondContact O-SG 3.37Å; G324-C327 WeakPolarHBondContact O-CB 3.45Å; G324-C327 PolarHBondContact O-N 3Å; Y325-C327 VanDerWaalsContact C-N 3.32Å; Y325-C327 PolarHBondContact O-N 3.48Å; C327-F331 WeakPolarHBondContact O-CB 3.4Å; C327-A412 HydrophobicContact CB-CB 4.32Å; C327-A416 HydrophobicContact CB-CB 4.19Å |
| 328 | E | 95.7 | Very high | 97.5 | Very high | 135 Ų | 135 | 72.9 Ų | 72.9 | 63% | 0.631 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -91.4 | -43.4 | 178.5 | -173 | 168.4 | -160.8 | 0 | 0 | 112.6 | G324 Y325 I326 | G324-E328 PolarHBondContact O-N 3.22Å; Y325-E328 PolarHBondContact O-N 3.22Å; I326-E328 PolarHBondContact O-N 2.74Å |
| 329 | T | 97.3 | Very high | 97.5 | Very high | 65 Ų | 65 | 77.1 Ų | 77.1 | 40% | 0.399 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -92.8 | -39.4 | -174.3 | 66.8 | 0 | 0 | 0 | 0 | 114.4 | Y325 | Y325-T329 HydrophobicContact CD1-CG2 4.47Å; Y325-T329 HydrophobicContact CD2-CG2 4.21Å; Y325-T329 HydrophobicContact CE1-CG2 4.05Å; Y325-T329 WeakPolarHBondContact CE1-OG1 3.47Å; Y325-T329 HydrophobicContact CE2-CG2 3.78Å; Y325-T329 PolarHBondContact O-N 2.74Å; Y325-T329 PolarHBondContact O-OG1 2.89Å |
| 330 | E | 97.8 | Very high | 97.4 | Very high | 129 Ų | 129 | 76.7 Ų | 76.7 | 60% | 0.603 | 38% | 0.377 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.5 | -18.9 | -170.5 | -49.1 | -51.2 | 121.8 | 0 | 0 | 113.6 | I326 P332 | I326-E330 HydrophobicContact CG2-CB 4.12Å; I326-E330 HydrophobicContact CG2-CG 4.1Å; I326-E330 WeakPolarHBondContact O-CB 3.42Å; I326-E330 PolarHBondContact O-N 3.36Å; E330-P332 WeakPolarHBondContact O-CD 3.43Å |
| 331 | F | 98 | Very high | 97.3 | Very high | 86 Ų | 86 | 77 Ų | 77 | 38% | 0.377 | 38% | 0.378 | S | S | . | . | trans | -69.1 | 121.3 | -177.1 | -176.2 | -106.7 | 0 | 0 | 0 | 111.3 | I326 C327 A333 A416 | I326-F331 PolarHBondContact O-N 2.93Å; C327-F331 WeakPolarHBondContact O-CB 3.4Å; F331-A333 HydrophobicContact CD1-CB 3.94Å; F331-A333 HydrophobicContact CE1-CB 4.14Å; F331-A333 PolarHBondContact O-N 3.35Å; F331-A416 HydrophobicContact CB-CB 4.39Å; F331-A416 HydrophobicContact CD1-CB 3.76Å; F331-A416 HydrophobicContact CE1-CB 4.2Å; F331-A416 HydrophobicContact CG-CB 4.01Å | ||
| 332 | P | 98.1 | Very high | 97 | Very high | 76 Ų | 76 | 77.2 Ų | 77.2 | 49% | 0.494 | 38% | 0.379 | S | S | . | . | trans | -81.1 | 47.7 | -168.5 | 34.2 | -38 | 0 | 0 | 0 | 113.5 | E330 K334 A335 V336 | E330-P332 WeakPolarHBondContact O-CD 3.43Å; P332-K334 VanDerWaalsContact C-N 3.29Å; P332-K334 PolarHBondContact O-N 3.19Å; P332-K334 VanDerWaalsContact O-N 3.13Å; P332-A335 HydrophobicContact CB-CB 4.38Å; P332-A335 PolarHBondContact O-N 3.41Å; P332-V336 HydrophobicContact CG-CG2 4.17Å; P332-V336 WeakPolarHBondContact O-CG2 3.4Å; P332-V336 PolarHBondContact O-N 3.06Å | ||
| 333 | A | 98.1 | Very high | 96.7 | Very high | 11 Ų | 11 | 79.2 Ų | 79.2 | 9% | 0.091 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -44.7 | -48.7 | -174.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | F331 S337 N419 | F331-A333 HydrophobicContact CD1-CB 3.94Å; F331-A333 HydrophobicContact CE1-CB 4.14Å; F331-A333 PolarHBondContact O-N 3.35Å; A333-S337 WeakPolarHBondContact O-CB 3.33Å; A333-S337 PolarHBondContact O-N 2.96Å; A333-S337 PolarHBondContact O-OG 2.96Å; A333-N419 HydrophobicContact CB-CB 4.15Å |
| 334 | K | 97.6 | Very high | 96.1 | Very high | 114 Ų | 114 | 78.2 Ų | 78.2 | 50% | 0.496 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -61.3 | -51.7 | 178.1 | -178.2 | -177.3 | 167.1 | -171 | 0 | 112 | P332 V336 S337 E338 E423 | P332-K334 VanDerWaalsContact C-N 3.29Å; P332-K334 PolarHBondContact O-N 3.19Å; P332-K334 VanDerWaalsContact O-N 3.13Å; K334-V336 VanDerWaalsContact C-N 3.32Å; K334-V336 PolarHBondContact O-N 3.49Å; K334-S337 PolarHBondContact O-N 2.88Å; K334-S337 VanDerWaalsContact O-N 3.14Å; K334-S337 PolarHBondContact O-OG 3.29Å; K334-E338 WeakPolarHBondContact CE-OE1 3.35Å; K334-E338 HydrophobicContact CG-CG 4.45Å; K334-E338 IonicContact NZ-OE1 2.64Å; K334-E338 PolarHBondContact O-N 3.08Å; K334-E423 HydrophobicContact CB-CB 4.47Å; K334-E423 HydrophobicContact CB-CG 4.04Å |
| 335 | A | 98 | Very high | 95.6 | Very high | 57 Ų | 57 | 81.7 Ų | 81.7 | 47% | 0.471 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -64.1 | -38 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112 | P332 E338 Y339 | P332-A335 HydrophobicContact CB-CB 4.38Å; P332-A335 PolarHBondContact O-N 3.41Å; A335-E338 PolarHBondContact O-N 3.15Å; A335-Y339 WeakPolarHBondContact O-CB 3.25Å; A335-Y339 PolarHBondContact O-N 3.42Å |
| 336 | V | 98.1 | Very high | 95.1 | Very high | 52 Ų | 52 | 78.6 Ų | 78.6 | 32% | 0.315 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.2 | -42.5 | 173.7 | 179.3 | 0 | 0 | 0 | 0 | 111 | P332 K334 Y339 L340 Y420 | P332-V336 HydrophobicContact CG-CG2 4.17Å; P332-V336 WeakPolarHBondContact O-CG2 3.4Å; P332-V336 PolarHBondContact O-N 3.06Å; K334-V336 VanDerWaalsContact C-N 3.32Å; K334-V336 PolarHBondContact O-N 3.49Å; V336-Y339 PolarHBondContact O-N 3.49Å; V336-L340 HydrophobicContact CG1-CD1 4.03Å; V336-L340 PolarHBondContact O-N 2.86Å; V336-Y420 HydrophobicContact CB-CD2 4.14Å; V336-Y420 HydrophobicContact CB-CE2 4.5Å; V336-Y420 HydrophobicContact CG1-CD2 3.83Å; V336-Y420 HydrophobicContact CG1-CE2 3.86Å |
| 337 | S | 97.3 | Very high | 94.5 | Very high | 1 Ų | 1 | 78.2 Ų | 78.2 | 1% | 0.007 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -66.2 | -39.6 | 175.6 | 76.1 | 0 | 0 | 0 | 0 | 113.6 | A333 K334 Y339 L340 N341 E423 | A333-S337 WeakPolarHBondContact O-CB 3.33Å; A333-S337 PolarHBondContact O-N 2.96Å; A333-S337 PolarHBondContact O-OG 2.96Å; K334-S337 PolarHBondContact O-N 2.88Å; K334-S337 VanDerWaalsContact O-N 3.14Å; K334-S337 PolarHBondContact O-OG 3.29Å; S337-Y339 VanDerWaalsContact C-N 3.28Å; S337-Y339 PolarHBondContact O-N 3.08Å; S337-L340 PolarHBondContact O-N 2.74Å; S337-N341 VanDerWaalsContact O-CB 3.28Å; S337-N341 WeakPolarHBondContact O-CB 3.4Å; S337-N341 PolarHBondContact O-N 3.34Å; S337-E423 VanDerWaalsContact OG-CB 3.23Å; S337-E423 WeakPolarHBondContact OG-CB 3.39Å |
| 338 | E | 95.8 | Very high | 94 | Very high | 83 Ų | 83 | 81.7 Ų | 81.7 | 39% | 0.388 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -69.1 | -28.5 | 177.2 | -76.3 | -177 | 179.9 | 0 | 0 | 111.7 | K334 A335 R342 | K334-E338 WeakPolarHBondContact CE-OE1 3.35Å; K334-E338 HydrophobicContact CG-CG 4.45Å; K334-E338 IonicContact NZ-OE1 2.64Å; K334-E338 PolarHBondContact O-N 3.08Å; A335-E338 PolarHBondContact O-N 3.15Å; E338-R342 WeakPolarHBondContact O-CD 3.44Å; E338-R342 VanDerWaalsContact O-CG 3.27Å; E338-R342 WeakPolarHBondContact O-CG 3.48Å; E338-R342 PolarHBondContact O-NE 2.82Å |
| 339 | Y | 96.4 | Very high | 93.7 | Very high | 148 Ų | 148 | 80 Ų | 80 | 58% | 0.58 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -73 | -51.6 | 172.2 | -179.4 | -96.4 | 0 | 0 | 0 | 111.7 | A335 V336 S337 R342 | A335-Y339 WeakPolarHBondContact O-CB 3.25Å; A335-Y339 PolarHBondContact O-N 3.42Å; V336-Y339 PolarHBondContact O-N 3.49Å; S337-Y339 VanDerWaalsContact C-N 3.28Å; S337-Y339 PolarHBondContact O-N 3.08Å; Y339-R342 WeakPolarHBondContact O-CB 3.14Å; Y339-R342 PolarHBondContact O-N 2.63Å |
| 340 | L | 95.3 | Very high | 93.4 | Very high | 50 Ų | 50 | 77 Ų | 77 | 26% | 0.262 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -71.3 | -34.6 | -175.3 | -69.2 | 175.6 | 0 | 0 | 0 | 113.3 | V336 S337 R342 Q343 H344 Y420 | V336-L340 HydrophobicContact CG1-CD1 4.03Å; V336-L340 PolarHBondContact O-N 2.86Å; S337-L340 PolarHBondContact O-N 2.74Å; L340-R342 PolarHBondContact O-N 2.59Å; L340-Q343 WeakPolarHBondContact O-CB 3.22Å; L340-Q343 PolarHBondContact O-N 3.36Å; L340-H344 PolarHBondContact O-CD2 3.45Å; L340-Y420 HydrophobicContact CD1-CE2 3.9Å; L340-Y420 WeakPolarHBondContact CD1-OH 3.36Å |
| 341 | N | 94.3 | Very high | 93.1 | Very high | 10 Ų | 10 | 76.5 Ų | 76.5 | 5% | 0.053 | 40% | 0.395 | C | S | . | . | G | 310 helix | trans | -63.8 | -24.4 | 176.4 | -79.6 | -1.6 | 0 | 0 | 0 | 113.4 | S337 Q343 H344 A424 | S337-N341 VanDerWaalsContact O-CB 3.28Å; S337-N341 WeakPolarHBondContact O-CB 3.4Å; S337-N341 PolarHBondContact O-N 3.34Å; N341-Q343 PolarHBondContact O-N 2.79Å; N341-H344 PolarHBondContact O-N 3.18Å; N341-A424 PolarHBondContact ND2-O 2.8Å |
| 342 | R | 91.1 | Very high | 92.9 | Very high | 171 Ų | 171 | 75.2 Ų | 75.2 | 65% | 0.645 | 40% | 0.397 | S | S | * | . | G | 310 helix | trans | -64.6 | -17.7 | 174.2 | -64.7 | 166 | -157.4 | -162.4 | 2.7 | 113 | E338 Y339 L340 H344 | E338-R342 WeakPolarHBondContact O-CD 3.44Å; E338-R342 VanDerWaalsContact O-CG 3.27Å; E338-R342 WeakPolarHBondContact O-CG 3.48Å; E338-R342 PolarHBondContact O-NE 2.82Å; Y339-R342 WeakPolarHBondContact O-CB 3.14Å; Y339-R342 PolarHBondContact O-N 2.63Å; L340-R342 PolarHBondContact O-N 2.59Å; R342-H344 VanDerWaalsContact C-N 3.33Å |
| 343 | Q | 89.9 | Confident | 92.7 | Very high | 116 Ų | 116 | 74.4 Ų | 74.4 | 54% | 0.542 | 38% | 0.384 | S | S | . | . | G | 310 helix | trans | -86.5 | -3.9 | 176.3 | -55.4 | -179.7 | -13 | 0 | 0 | 112.6 | L340 N341 | L340-Q343 WeakPolarHBondContact O-CB 3.22Å; L340-Q343 PolarHBondContact O-N 3.36Å; N341-Q343 PolarHBondContact O-N 2.79Å |
| 344 | H | 87.3 | Confident | 92.6 | Very high | 59 Ų | 59 | 76.4 Ų | 76.4 | 27% | 0.273 | 39% | 0.39 | S | S | . | . | trans | -126.6 | 60.5 | -175 | -59.9 | -58.2 | 0 | 0 | 0 | 111.2 | L340 N341 R342 L350 R353 M431 | L340-H344 PolarHBondContact O-CD2 3.45Å; N341-H344 PolarHBondContact O-N 3.18Å; R342-H344 VanDerWaalsContact C-N 3.33Å; H344-L350 WeakPolarHBondContact O-CD2 3.39Å; H344-R353 HydrophobicContact CB-CG 4.3Å; H344-R353 PolarHBondContact CD2-NE 3.5Å; H344-R353 VanDerWaalsContact CD2-NE 3.34Å; H344-R353 PolarHBondContact NE2-NE 3.49Å; H344-R353 VanDerWaalsContact NE2-NE 3.12Å; H344-R353 PolarHBondContact NE2-NH2 2.85Å; H344-M431 VanDerWaalsContact O-CE 3.26Å; H344-M431 WeakPolarHBondContact O-CE 3.48Å | ||
| 345 | T | 85.9 | Confident | 92.5 | Very high | 93 Ų | 93 | 74.4 Ų | 74.4 | 57% | 0.571 | 39% | 0.385 | S | S | * | . | trans | -94.3 | -13.4 | -177.1 | 47.2 | 0 | 0 | 0 | 0 | 114.8 | P347 M431 | T345-P347 WeakPolarHBondContact O-CD 3.24Å; T345-M431 HydrophobicContact CG2-CE 3.98Å | ||
| 346 | D | 87.7 | Confident | 92.5 | Very high | 83 Ų | 83 | 76.1 Ų | 76.1 | 44% | 0.444 | 39% | 0.385 | S | S | . | . | trans | -64.8 | 119.2 | -178.9 | -167.6 | -57.4 | 0 | 0 | 0 | 111.2 | S348 D349 L350 | D346-S348 PolarHBondContact O-N 3.16Å; D346-S348 VanDerWaalsContact O-N 3.17Å; D346-S348 WeakPolarHBondContact OD1-CB 3.22Å; D346-S348 PolarHBondContact OD1-N 2.82Å; D346-S348 PolarHBondContact OD1-OG 2.92Å; D346-D349 HydrophobicContact CB-CB 4.5Å; D346-D349 PolarHBondContact O-N 3.42Å; D346-L350 WeakPolarHBondContact O-CG 3.4Å; D346-L350 PolarHBondContact O-N 2.94Å | ||
| 347 | P | 86.4 | Confident | 92.4 | Very high | 85 Ų | 85 | 73.9 Ų | 73.9 | 55% | 0.552 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58 | -28.1 | -178.1 | -24.9 | 34.7 | 0 | 0 | 0 | 114.9 | T345 | T345-P347 WeakPolarHBondContact O-CD 3.24Š|
| 348 | S | 88.1 | Confident | 92.5 | Very high | 91 Ų | 91 | 77.7 Ų | 77.7 | 64% | 0.636 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.3 | -40.4 | -178.8 | 67.5 | 0 | 0 | 0 | 0 | 111.9 | D346 | D346-S348 PolarHBondContact O-N 3.16Å; D346-S348 VanDerWaalsContact O-N 3.17Å; D346-S348 WeakPolarHBondContact OD1-CB 3.22Å; D346-S348 PolarHBondContact OD1-N 2.82Å; D346-S348 PolarHBondContact OD1-OG 2.92Å |
| 349 | D | 89.9 | Confident | 92.6 | Very high | 100 Ų | 100 | 76.3 Ų | 76.3 | 54% | 0.535 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.7 | -18.5 | -179.7 | -87.3 | -28.6 | 0 | 0 | 0 | 113.9 | D346 H351 S352 R353 | D346-D349 HydrophobicContact CB-CB 4.5Å; D346-D349 PolarHBondContact O-N 3.42Å; D349-H351 PolarHBondContact O-N 3.37Å; D349-H351 VanDerWaalsContact O-N 3.11Å; D349-S352 WeakPolarHBondContact O-CB 3.34Å; D349-S352 PolarHBondContact O-N 3.39Å; D349-S352 VanDerWaalsContact O-N 3.11Å; D349-R353 WeakPolarHBondContact O-CB 3.25Å; D349-R353 PolarHBondContact O-N 2.95Å |
| 350 | L | 90 | Very high | 92.7 | Very high | 3 Ų | 3 | 72.2 Ų | 72.2 | 2% | 0.016 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -52.7 | -38.3 | -176.3 | -68.5 | -175.8 | 0 | 0 | 0 | 113.2 | H344 D346 K354 M428 M431 F432 | H344-L350 WeakPolarHBondContact O-CD2 3.39Å; D346-L350 WeakPolarHBondContact O-CG 3.4Å; D346-L350 PolarHBondContact O-N 2.94Å; L350-K354 WeakPolarHBondContact O-CB 3.3Å; L350-K354 PolarHBondContact O-N 2.84Å; L350-M428 HydrophobicContact CB-CE 4.15Å; L350-M428 HydrophobicContact CD2-CE 3.87Å; L350-M428 WeakPolarHBondContact O-CE 3.44Å; L350-M431 HydrophobicContact CD1-CB 4.38Å; L350-M431 HydrophobicContact CD2-CE 4.14Å; L350-F432 HydrophobicContact CB-CE1 3.88Å; L350-F432 HydrophobicContact CB-CE2 4.03Å; L350-F432 HydrophobicContact CB-CZ 3.51Å; L350-F432 HydrophobicContact CD1-CD1 4.49Å; L350-F432 HydrophobicContact CD1-CE1 4.43Å |
| 351 | H | 91.8 | Very high | 92.8 | Very high | 117 Ų | 117 | 73 Ų | 73 | 54% | 0.542 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -71.6 | -45.8 | -179.9 | -170.2 | 73.9 | 0 | 0 | 0 | 111.9 | D349 R353 K354 N355 F432 | D349-H351 PolarHBondContact O-N 3.37Å; D349-H351 VanDerWaalsContact O-N 3.11Å; H351-R353 VanDerWaalsContact C-N 3.33Å; H351-R353 PolarHBondContact O-N 3.44Å; H351-K354 PolarHBondContact O-N 3.34Å; H351-N355 PolarHBondContact CD2-ND2 3.22Å; H351-N355 VanDerWaalsContact CD2-ND2 3.31Å; H351-N355 PolarHBondContact NE2-ND2 3.15Å; H351-N355 VanDerWaalsContact O-CG 3.23Å; H351-N355 PolarHBondContact O-N 3.49Å; H351-N355 PolarHBondContact O-ND2 2.96Å; H351-F432 HydrophobicContact CB-CZ 4.44Å |
| 352 | S | 93.9 | Very high | 93 | Very high | 60 Ų | 60 | 77 Ų | 77 | 42% | 0.42 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -56.8 | -47.3 | 173.5 | -178.3 | 0 | 0 | 0 | 0 | 111.2 | D349 K354 N355 M356 | D349-S352 WeakPolarHBondContact O-CB 3.34Å; D349-S352 PolarHBondContact O-N 3.39Å; D349-S352 VanDerWaalsContact O-N 3.11Å; S352-K354 PolarHBondContact O-N 3.28Å; S352-N355 PolarHBondContact O-N 3.35Å; S352-M356 PolarHBondContact O-N 3.32Å |
| 353 | R | 94.6 | Very high | 93.4 | Very high | 58 Ų | 58 | 74.2 Ų | 74.2 | 22% | 0.219 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -65.6 | -38.9 | -179.6 | -174.6 | 56.7 | 164.1 | 157.5 | -5.6 | 112.9 | H344 D349 H351 M356 L357 M428 | H344-R353 HydrophobicContact CB-CG 4.3Å; H344-R353 PolarHBondContact CD2-NE 3.5Å; H344-R353 VanDerWaalsContact CD2-NE 3.34Å; H344-R353 PolarHBondContact NE2-NE 3.49Å; H344-R353 VanDerWaalsContact NE2-NE 3.12Å; H344-R353 PolarHBondContact NE2-NH2 2.85Å; D349-R353 WeakPolarHBondContact O-CB 3.25Å; D349-R353 PolarHBondContact O-N 2.95Å; H351-R353 VanDerWaalsContact C-N 3.33Å; H351-R353 PolarHBondContact O-N 3.44Å; R353-M356 HydrophobicContact CB-CE 4.44Å; R353-M356 PolarHBondContact O-N 3.2Å; R353-L357 WeakPolarHBondContact O-CG 3.15Å; R353-L357 PolarHBondContact O-N 3Å; R353-L357 VanDerWaalsContact O-N 3.12Å; R353-M428 HydrophobicContact CB-CE 3.94Å; R353-M428 HydrophobicContact CB-SD 4.38Å; R353-M428 HydrophobicContact CG-CE 4.05Å; R353-M428 HydrophobicContact CG-SD 4.03Å |
| 354 | K | 94.8 | Very high | 93.8 | Very high | 53 Ų | 53 | 69.4 Ų | 69.4 | 23% | 0.23 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -62.4 | -44.1 | 172.8 | -178.1 | 169.5 | 178.2 | 172.6 | 0 | 111.7 | L350 H351 S352 M356 L357 L358 L425 M428 D429 F432 | L350-K354 WeakPolarHBondContact O-CB 3.3Å; L350-K354 PolarHBondContact O-N 2.84Å; H351-K354 PolarHBondContact O-N 3.34Å; S352-K354 PolarHBondContact O-N 3.28Å; K354-M356 PolarHBondContact O-N 3Å; K354-L357 PolarHBondContact O-N 2.84Å; K354-L358 HydrophobicContact CG-CD1 4.2Å; K354-L358 WeakPolarHBondContact O-CG 3.37Å; K354-L358 PolarHBondContact O-N 2.91Å; K354-L425 HydrophobicContact CG-CD2 3.89Å; K354-M428 HydrophobicContact CB-CE 4.07Å; K354-M428 HydrophobicContact CB-SD 3.98Å; K354-D429 IonicContact NZ-OD1 2.7Å; K354-D429 PolarHBondContact NZ-OD1 3.21Å; K354-D429 IonicContact NZ-OD2 3.42Å; K354-F432 HydrophobicContact CB-CE2 4.29Å; K354-F432 HydrophobicContact CD-CE2 3.91Å |
| 355 | N | 96.3 | Very high | 94.2 | Very high | 72 Ų | 72 | 70.9 Ų | 70.9 | 39% | 0.385 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.7 | -38.9 | 179.3 | -65 | -12.6 | 0 | 0 | 0 | 111.8 | H351 S352 L358 A359 | H351-N355 PolarHBondContact CD2-ND2 3.22Å; H351-N355 VanDerWaalsContact CD2-ND2 3.31Å; H351-N355 PolarHBondContact NE2-ND2 3.15Å; H351-N355 VanDerWaalsContact O-CG 3.23Å; H351-N355 PolarHBondContact O-N 3.49Å; H351-N355 PolarHBondContact O-ND2 2.96Å; S352-N355 PolarHBondContact O-N 3.35Å; N355-L358 PolarHBondContact O-N 3.03Å; N355-A359 WeakPolarHBondContact O-CB 3.32Å; N355-A359 PolarHBondContact O-N 3.12Å |
| 356 | M | 96.9 | Very high | 94.8 | Very high | 94 Ų | 94 | 71 Ų | 71 | 46% | 0.463 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -59.8 | -45.1 | 172.3 | -74.8 | -169.6 | -81.9 | 0 | 0 | 112.7 | S352 R353 K354 A359 T360 | S352-M356 PolarHBondContact O-N 3.32Å; R353-M356 HydrophobicContact CB-CE 4.44Å; R353-M356 PolarHBondContact O-N 3.2Å; K354-M356 PolarHBondContact O-N 3Å; M356-A359 PolarHBondContact O-N 3.03Å; M356-T360 WeakPolarHBondContact O-CB 3.34Å; M356-T360 PolarHBondContact O-N 2.91Å; M356-T360 PolarHBondContact O-OG1 3.06Å |
| 357 | L | 97.4 | Very high | 95.3 | Very high | 4 Ų | 4 | 71.8 Ų | 71.8 | 2% | 0.021 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -63.4 | -41 | 177.2 | -68.4 | 178.7 | 0 | 0 | 0 | 112.3 | R353 K354 K361 L421 A424 L425 M428 | R353-L357 WeakPolarHBondContact O-CG 3.15Å; R353-L357 PolarHBondContact O-N 3Å; R353-L357 VanDerWaalsContact O-N 3.12Å; K354-L357 PolarHBondContact O-N 2.84Å; L357-K361 WeakPolarHBondContact O-CB 3.47Å; L357-K361 PolarHBondContact O-N 2.75Å; L357-L421 HydrophobicContact CD2-CD2 3.62Å; L357-A424 HydrophobicContact CD1-CB 3.81Å; L357-A424 HydrophobicContact CD2-CB 4.42Å; L357-L425 HydrophobicContact CB-CD2 3.8Å; L357-L425 HydrophobicContact CB-CG 4.08Å; L357-L425 HydrophobicContact CD1-CD2 4.15Å; L357-L425 HydrophobicContact CD1-CG 4.27Å; L357-M428 HydrophobicContact CD1-CG 4.22Å; L357-M428 HydrophobicContact CD1-SD 3.59Å; L357-M428 VanDerWaalsContact CD1-SD 3.59Å |
| 358 | L | 98.1 | Very high | 95.8 | Very high | 81 Ų | 81 | 68.8 Ų | 68.8 | 42% | 0.424 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.3 | -47.9 | 176.2 | -72.2 | 169.3 | 0 | 0 | 0 | 111.6 | K354 N355 K361 Q362 L425 | K354-L358 HydrophobicContact CG-CD1 4.2Å; K354-L358 WeakPolarHBondContact O-CG 3.37Å; K354-L358 PolarHBondContact O-N 2.91Å; N355-L358 PolarHBondContact O-N 3.03Å; L358-K361 PolarHBondContact O-N 2.95Å; L358-Q362 PolarHBondContact O-N 3.11Å; L358-L425 HydrophobicContact CD2-CD1 3.74Å; L358-L425 HydrophobicContact CD2-CD2 4.09Å; L358-L425 HydrophobicContact CG-CD1 4.36Å; L358-L425 HydrophobicContact CG-CD2 3.96Å |
| 359 | A | 98.3 | Very high | 96.3 | Very high | 54 Ų | 54 | 67.5 Ų | 67.5 | 45% | 0.446 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -62.1 | -43.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | N355 M356 K361 Q362 L363 | N355-A359 WeakPolarHBondContact O-CB 3.32Å; N355-A359 PolarHBondContact O-N 3.12Å; M356-A359 PolarHBondContact O-N 3.03Å; A359-K361 PolarHBondContact O-N 3.38Å; A359-Q362 PolarHBondContact O-N 2.94Å; A359-L363 WeakPolarHBondContact O-CG 3.49Å; A359-L363 PolarHBondContact O-N 3.23Å |
| 360 | T | 98.5 | Very high | 96.7 | Very high | 63 Ų | 63 | 65.7 Ų | 65.7 | 39% | 0.387 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61 | -44.4 | 174.9 | -56.5 | 0 | 0 | 0 | 0 | 111.2 | M356 Q362 L363 C364 L421 | M356-T360 WeakPolarHBondContact O-CB 3.34Å; M356-T360 PolarHBondContact O-N 2.91Å; M356-T360 PolarHBondContact O-OG1 3.06Å; T360-Q362 VanDerWaalsContact C-N 3.33Å; T360-Q362 PolarHBondContact O-N 3.12Å; T360-L363 PolarHBondContact O-N 2.7Å; T360-C364 PolarHBondContact O-N 2.76Å; T360-C364 PolarHBondContact O-SG 3.05Å; T360-L421 HydrophobicContact CG2-CD1 3.88Å; T360-L421 HydrophobicContact CG2-CD2 4.35Å |
| 361 | K | 98 | Very high | 97 | Very high | 66 Ų | 66 | 66.1 Ų | 66.1 | 29% | 0.287 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.6 | -41.3 | 178.7 | -177.7 | 174.1 | 173.9 | 175.7 | 0 | 111.8 | L357 L358 A359 C364 K365 Q418 L421 T422 L425 | L357-K361 WeakPolarHBondContact O-CB 3.47Å; L357-K361 PolarHBondContact O-N 2.75Å; L358-K361 PolarHBondContact O-N 2.95Å; A359-K361 PolarHBondContact O-N 3.38Å; K361-C364 PolarHBondContact O-N 3.07Å; K361-K365 PolarHBondContact O-N 3.36Å; K361-Q418 HydrophobicContact CG-CG 4.4Å; K361-L421 HydrophobicContact CB-CB 4.3Å; K361-L421 HydrophobicContact CB-CD1 3.94Å; K361-T422 PolarHBondContact NZ-OG1 2.93Å; K361-L425 HydrophobicContact CD-CD1 4.45Å |
| 362 | Q | 98.3 | Very high | 97.2 | Very high | 94 Ų | 94 | 63.6 Ų | 63.6 | 44% | 0.439 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -63.9 | -47.3 | 178 | -178.8 | 58.5 | 24.1 | 0 | 0 | 111.8 | L358 A359 T360 C364 K365 E366 | L358-Q362 PolarHBondContact O-N 3.11Å; A359-Q362 PolarHBondContact O-N 2.94Å; T360-Q362 VanDerWaalsContact C-N 3.33Å; T360-Q362 PolarHBondContact O-N 3.12Å; Q362-C364 VanDerWaalsContact C-N 3.34Å; Q362-C364 PolarHBondContact O-N 2.72Å; Q362-K365 WeakPolarHBondContact O-CB 3.38Å; Q362-K365 PolarHBondContact O-N 3.39Å; Q362-K365 VanDerWaalsContact O-N 3.08Å; Q362-E366 WeakPolarHBondContact CG-OE1 3.44Å; Q362-E366 PolarHBondContact NE2-OE1 2.88Å; Q362-E366 WeakPolarHBondContact O-CG 3.3Å; Q362-E366 PolarHBondContact O-N 2.96Å |
| 363 | L | 98.4 | Very high | 97.3 | Very high | 112 Ų | 112 | 64.3 Ų | 64.3 | 59% | 0.586 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -62.2 | -39 | 176.5 | -68.6 | 171 | 0 | 0 | 0 | 112.5 | A359 T360 K365 F367 | A359-L363 WeakPolarHBondContact O-CG 3.49Å; A359-L363 PolarHBondContact O-N 3.23Å; T360-L363 PolarHBondContact O-N 2.7Å; L363-K365 VanDerWaalsContact C-N 3.31Å; L363-K365 PolarHBondContact O-N 2.98Å; L363-F367 PolarHBondContact O-N 3.36Å; L363-F367 VanDerWaalsContact O-N 3.15Å |
| 364 | C | 98.3 | Very high | 97.4 | Very high | 15 Ų | 15 | 62.8 Ų | 62.8 | 10% | 0.101 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.1 | -38.9 | 173 | -66.6 | 0 | 0 | 0 | 0 | 112.1 | T360 K361 Q362 T368 L414 Q418 | T360-C364 PolarHBondContact O-N 2.76Å; T360-C364 PolarHBondContact O-SG 3.05Å; K361-C364 PolarHBondContact O-N 3.07Å; Q362-C364 VanDerWaalsContact C-N 3.34Å; Q362-C364 PolarHBondContact O-N 2.72Å; C364-T368 WeakPolarHBondContact O-CB 3.43Å; C364-T368 PolarHBondContact O-N 3.11Å; C364-T368 VanDerWaalsContact O-N 3.11Å; C364-T368 PolarHBondContact O-OG1 2.91Å; C364-L414 HydrophobicContact CB-CD2 4.38Å; C364-Q418 HydrophobicContact CB-CG 3.8Å |
| 365 | K | 97.1 | Very high | 97.4 | Very high | 90 Ų | 90 | 63.8 Ų | 63.8 | 39% | 0.391 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -66.3 | -51.3 | 175.8 | 173 | 162.6 | 171.8 | 49.3 | 0 | 111.7 | K361 Q362 L363 F367 T368 D369 | K361-K365 PolarHBondContact O-N 3.36Å; Q362-K365 WeakPolarHBondContact O-CB 3.38Å; Q362-K365 PolarHBondContact O-N 3.39Å; Q362-K365 VanDerWaalsContact O-N 3.08Å; L363-K365 VanDerWaalsContact C-N 3.31Å; L363-K365 PolarHBondContact O-N 2.98Å; K365-F367 VanDerWaalsContact C-N 3.31Å; K365-F367 PolarHBondContact O-N 2.81Å; K365-T368 CarbonylContact O-C 3.24Å; K365-T368 WeakPolarHBondContact O-CA 3.48Å; K365-T368 WeakPolarHBondContact O-CB 3.46Å; K365-T368 PolarHBondContact O-N 3.04Å; K365-D369 WeakPolarHBondContact CE-OD2 3.08Å; K365-D369 VanDerWaalsContact CG-OD2 3.31Å; K365-D369 WeakPolarHBondContact CG-OD2 3.43Å; K365-D369 IonicContact NZ-OD1 2.64Å; K365-D369 PolarHBondContact NZ-OD1 3.38Å; K365-D369 IonicContact NZ-OD2 3.22Å; K365-D369 PolarHBondContact NZ-OD2 2.87Å; K365-D369 VanDerWaalsContact O-CG 3.28Å; K365-D369 PolarHBondContact O-N 3.16Å |
| 366 | E | 98.1 | Very high | 97.4 | Very high | 95 Ų | 95 | 60.8 Ų | 60.8 | 44% | 0.444 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -56 | -43.8 | -179 | -72.9 | 167.7 | -170.9 | 0 | 0 | 112.4 | Q362 D369 L370 | Q362-E366 WeakPolarHBondContact CG-OE1 3.44Å; Q362-E366 PolarHBondContact NE2-OE1 2.88Å; Q362-E366 WeakPolarHBondContact O-CG 3.3Å; Q362-E366 PolarHBondContact O-N 2.96Å; E366-D369 PolarHBondContact O-N 3.08Å; E366-L370 PolarHBondContact O-N 3.44Å |
| 367 | F | 98.3 | Very high | 97.1 | Very high | 101 Ų | 101 | 57.5 Ų | 57.5 | 44% | 0.443 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -69 | -35 | 176.2 | -176.5 | -128.4 | 0 | 0 | 0 | 112.8 | L363 K365 L370 L371 I410 L414 | L363-F367 PolarHBondContact O-N 3.36Å; L363-F367 VanDerWaalsContact O-N 3.15Å; K365-F367 VanDerWaalsContact C-N 3.31Å; K365-F367 PolarHBondContact O-N 2.81Å; F367-L370 PolarHBondContact O-N 3.46Å; F367-L371 HydrophobicContact CD1-CD1 4.43Å; F367-L371 HydrophobicContact CE1-CD1 4Å; F367-L371 HydrophobicContact CE2-CD1 4.37Å; F367-L371 HydrophobicContact CE2-CD2 4.4Å; F367-L371 HydrophobicContact CE2-CG 4.27Å; F367-L371 HydrophobicContact CZ-CD1 3.96Å; F367-L371 HydrophobicContact CZ-CD2 4.46Å; F367-L371 HydrophobicContact CZ-CG 4.33Å; F367-L371 WeakPolarHBondContact O-CG 3.22Å; F367-L371 PolarHBondContact O-N 2.97Å; F367-L371 VanDerWaalsContact O-N 3.09Å; F367-I410 HydrophobicContact CE1-CG2 3.98Å; F367-L414 HydrophobicContact CD1-CD1 3.62Å; F367-L414 HydrophobicContact CE1-CD1 4.08Å |
| 368 | T | 97.8 | Very high | 96.9 | Very high | 21 Ų | 21 | 58.5 Ų | 58.5 | 13% | 0.129 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -67 | -42 | 173.9 | -56.4 | 0 | 0 | 0 | 0 | 111.5 | C364 K365 L370 L371 A372 C411 | C364-T368 WeakPolarHBondContact O-CB 3.43Å; C364-T368 PolarHBondContact O-N 3.11Å; C364-T368 VanDerWaalsContact O-N 3.11Å; C364-T368 PolarHBondContact O-OG1 2.91Å; K365-T368 CarbonylContact O-C 3.24Å; K365-T368 WeakPolarHBondContact O-CA 3.48Å; K365-T368 WeakPolarHBondContact O-CB 3.46Å; K365-T368 PolarHBondContact O-N 3.04Å; T368-L370 VanDerWaalsContact C-N 3.3Å; T368-L370 PolarHBondContact O-N 3.33Å; T368-L371 PolarHBondContact O-N 3.2Å; T368-A372 WeakPolarHBondContact O-CB 3.45Å; T368-A372 PolarHBondContact O-N 3.29Å; T368-C411 HydrophobicContact CG2-CB 4.25Å |
| 369 | D | 97.5 | Very high | 96.4 | Very high | 64 Ų | 64 | 55.6 Ų | 55.6 | 34% | 0.342 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -65.5 | -32.8 | 177.5 | -66.6 | -22.3 | 0 | 0 | 0 | 111.6 | K365 E366 Q373 | K365-D369 WeakPolarHBondContact CE-OD2 3.08Å; K365-D369 VanDerWaalsContact CG-OD2 3.31Å; K365-D369 WeakPolarHBondContact CG-OD2 3.43Å; K365-D369 IonicContact NZ-OD1 2.64Å; K365-D369 PolarHBondContact NZ-OD1 3.38Å; K365-D369 IonicContact NZ-OD2 3.22Å; K365-D369 PolarHBondContact NZ-OD2 2.87Å; K365-D369 VanDerWaalsContact O-CG 3.28Å; K365-D369 PolarHBondContact O-N 3.16Å; E366-D369 PolarHBondContact O-N 3.08Å; D369-Q373 WeakPolarHBondContact O-CG 3.28Å; D369-Q373 PolarHBondContact O-N 3.41Å; D369-Q373 PolarHBondContact O-NE2 3.16Å |
| 370 | L | 97.6 | Very high | 95.8 | Very high | 63 Ų | 63 | 57.8 Ų | 57.8 | 33% | 0.33 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -66.7 | -45.6 | 170.4 | 177.1 | 62.8 | 0 | 0 | 0 | 112 | E366 F367 T368 A372 Q373 L387 I391 | E366-L370 PolarHBondContact O-N 3.44Å; F367-L370 PolarHBondContact O-N 3.46Å; T368-L370 VanDerWaalsContact C-N 3.3Å; T368-L370 PolarHBondContact O-N 3.33Å; L370-A372 VanDerWaalsContact C-N 3.3Å; L370-A372 PolarHBondContact O-N 2.79Å; L370-Q373 WeakPolarHBondContact O-CB 3.39Å; L370-Q373 PolarHBondContact O-N 2.86Å; L370-L387 HydrophobicContact CD1-CD1 4.18Å; L370-L387 HydrophobicContact CD1-CD2 3.79Å; L370-I391 HydrophobicContact CD1-CG2 4.45Å |
| 371 | L | 97.5 | Very high | 95.1 | Very high | 12 Ų | 12 | 57.5 Ų | 57.5 | 6% | 0.063 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -65 | -34.4 | 177.7 | -68.8 | 175.8 | 0 | 0 | 0 | 112.1 | F367 T368 Q373 D374 L395 A407 I410 | F367-L371 HydrophobicContact CD1-CD1 4.43Å; F367-L371 HydrophobicContact CE1-CD1 4Å; F367-L371 HydrophobicContact CE2-CD1 4.37Å; F367-L371 HydrophobicContact CE2-CD2 4.4Å; F367-L371 HydrophobicContact CE2-CG 4.27Å; F367-L371 HydrophobicContact CZ-CD1 3.96Å; F367-L371 HydrophobicContact CZ-CD2 4.46Å; F367-L371 HydrophobicContact CZ-CG 4.33Å; F367-L371 WeakPolarHBondContact O-CG 3.22Å; F367-L371 PolarHBondContact O-N 2.97Å; F367-L371 VanDerWaalsContact O-N 3.09Å; T368-L371 PolarHBondContact O-N 3.2Å; L371-Q373 PolarHBondContact O-N 3.2Å; L371-D374 WeakPolarHBondContact O-CB 3.36Å; L371-D374 PolarHBondContact O-N 2.87Å; L371-D374 VanDerWaalsContact O-N 3.1Å; L371-L395 HydrophobicContact CD2-CD2 3.77Å; L371-A407 HydrophobicContact CD2-CB 4.34Å; L371-I410 HydrophobicContact CD1-CB 4.12Å; L371-I410 HydrophobicContact CD1-CG2 3.59Å |
| 372 | A | 95.6 | Very high | 94.6 | Very high | 63 Ų | 63 | 59.4 Ų | 59.4 | 52% | 0.521 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.4 | -13.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | T368 L370 R375 | T368-A372 WeakPolarHBondContact O-CB 3.45Å; T368-A372 PolarHBondContact O-N 3.29Å; L370-A372 VanDerWaalsContact C-N 3.3Å; L370-A372 PolarHBondContact O-N 2.79Å; A372-R375 PolarHBondContact O-NH1 2.95Å; A372-R375 PolarHBondContact O-NH2 2.87Å |
| 373 | Q | 96.1 | Very high | 94.3 | Very high | 75 Ų | 75 | 57.3 Ų | 57.3 | 35% | 0.35 | 30% | 0.302 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.9 | -1.6 | 173.8 | -69.8 | 168.4 | 77.2 | 0 | 0 | 113.7 | D369 L370 L371 R375 I386 L387 | D369-Q373 WeakPolarHBondContact O-CG 3.28Å; D369-Q373 PolarHBondContact O-N 3.41Å; D369-Q373 PolarHBondContact O-NE2 3.16Å; L370-Q373 WeakPolarHBondContact O-CB 3.39Å; L370-Q373 PolarHBondContact O-N 2.86Å; L371-Q373 PolarHBondContact O-N 3.2Å; Q373-R375 VanDerWaalsContact C-NH1 3.31Å; Q373-R375 WeakPolarHBondContact O-CG 3.23Å; Q373-R375 PolarHBondContact O-N 3.43Å; Q373-R375 PolarHBondContact O-NH1 2.87Å; Q373-I386 HydrophobicContact CB-CD1 4.06Å; Q373-I386 HydrophobicContact CB-CG1 4.46Å; Q373-I386 HydrophobicContact CG-CD1 4.09Å; Q373-L387 HydrophobicContact CB-CD1 3.93Å; Q373-L387 HydrophobicContact CB-CD2 3.77Å; Q373-L387 HydrophobicContact CB-CG 3.91Å |
| 374 | D | 96.3 | Very high | 94 | Very high | 27 Ų | 27 | 57.5 Ų | 57.5 | 14% | 0.144 | 31% | 0.308 | C | S | . | . | trans | -57.5 | 128.9 | 173.5 | -175.5 | 12.5 | 0 | 0 | 0 | 111.2 | L371 T376 Q392 L395 S399 | L371-D374 WeakPolarHBondContact O-CB 3.36Å; L371-D374 PolarHBondContact O-N 2.87Å; L371-D374 VanDerWaalsContact O-N 3.1Å; D374-T376 VanDerWaalsContact CG-OG1 3.26Å; D374-T376 WeakPolarHBondContact OD1-CB 3.26Å; D374-T376 PolarHBondContact OD1-N 2.86Å; D374-T376 PolarHBondContact OD1-OG1 3.31Å; D374-T376 PolarHBondContact OD2-OG1 2.82Å; D374-T376 VanDerWaalsContact OD2-OG1 3.08Å; D374-Q392 PolarHBondContact OD1-NE2 3.2Å; D374-L395 HydrophobicContact CB-CD1 4.23Å; D374-S399 PolarHBondContact OD2-OG 3.43Å | ||
| 375 | R | 95.7 | Very high | 93.8 | Very high | 74 Ų | 74 | 60.4 Ų | 60.4 | 28% | 0.279 | 33% | 0.326 | S | S | . | . | trans | -116.1 | 29.5 | 175.8 | -57.2 | -59.4 | 170.7 | -111.4 | 4.6 | 112.4 | A372 Q373 P383 T384 I386 | A372-R375 PolarHBondContact O-NH1 2.95Å; A372-R375 PolarHBondContact O-NH2 2.87Å; Q373-R375 VanDerWaalsContact C-NH1 3.31Å; Q373-R375 WeakPolarHBondContact O-CG 3.23Å; Q373-R375 PolarHBondContact O-N 3.43Å; Q373-R375 PolarHBondContact O-NH1 2.87Å; R375-P383 HydrophobicContact CB-CB 4.22Å; R375-P383 HydrophobicContact CB-CG 3.86Å; R375-P383 HydrophobicContact CG-CB 4.49Å; R375-P383 WeakPolarHBondContact O-CG 3.4Å; R375-T384 WeakPolarHBondContact CG-O 3.45Å; R375-I386 HydrophobicContact CG-CD1 4.49Å; R375-I386 HydrophobicContact CG-CG1 3.92Å | ||
| 376 | T | 95.1 | Very high | 93.7 | Very high | 9 Ų | 9 | 60.8 Ų | 60.8 | 6% | 0.055 | 33% | 0.332 | C | S | . | . | trans | -58.3 | 127.3 | 172.4 | -59 | 0 | 0 | 0 | 0 | 111 | D374 I378 Q392 T396 L400 | D374-T376 VanDerWaalsContact CG-OG1 3.26Å; D374-T376 WeakPolarHBondContact OD1-CB 3.26Å; D374-T376 PolarHBondContact OD1-N 2.86Å; D374-T376 PolarHBondContact OD1-OG1 3.31Å; D374-T376 PolarHBondContact OD2-OG1 2.82Å; D374-T376 VanDerWaalsContact OD2-OG1 3.08Å; T376-I378 VanDerWaalsContact C-N 3.34Å; T376-I378 HydrophobicContact CG2-CD1 3.77Å; T376-I378 HydrophobicContact CG2-CG1 3.86Å; T376-I378 PolarHBondContact O-N 2.86Å; T376-Q392 PolarHBondContact OG1-NE2 2.78Å; T376-T396 HydrophobicContact CG2-CG2 4.25Å; T376-T396 VanDerWaalsContact OG1-CA 3.25Å; T376-T396 WeakPolarHBondContact OG1-CA 3.37Å; T376-T396 PolarHBondContact OG1-N 2.78Å; T376-L400 HydrophobicContact CG2-CG 4.32Å | ||
| 377 | P | 92.2 | Very high | 93.7 | Very high | 24 Ų | 24 | 57.4 Ų | 57.4 | 16% | 0.156 | 32% | 0.317 | C | S | . | . | trans | -77.7 | 78.2 | -178.8 | 30.9 | -35.6 | 0 | 0 | 0 | 112 | M213 R255 S381 | M213-P377 HydrophobicContact CE-CG 3.8Å; R255-P377 WeakPolarHBondContact CD-O 3.49Å; R255-P377 PolarHBondContact NH1-O 3.43Å; P377-S381 WeakPolarHBondContact CA-O 3.42Å; P377-S381 WeakPolarHBondContact CB-O 3.37Å | ||
| 378 | I | 92.1 | Very high | 93.6 | Very high | 25 Ų | 25 | 59.4 Ų | 59.4 | 13% | 0.128 | 33% | 0.327 | C | S | . | . | trans | -89.8 | 149 | 173.6 | -58.5 | -59.4 | 0 | 0 | 0 | 110.9 | E313 V317 T376 N380 S381 L400 | E313-I378 HydrophobicContact CG-CG2 4.39Å; V317-I378 HydrophobicContact CG2-CG2 4.5Å; T376-I378 VanDerWaalsContact C-N 3.34Å; T376-I378 HydrophobicContact CG2-CD1 3.77Å; T376-I378 HydrophobicContact CG2-CG1 3.86Å; T376-I378 PolarHBondContact O-N 2.86Å; I378-N380 PolarHBondContact O-N 2.74Å; I378-S381 PolarHBondContact O-N 3.29Å; I378-S381 PolarHBondContact O-OG 3.07Å; I378-L400 HydrophobicContact CD1-CD2 4.07Å | ||
| 379 | G | 88.6 | Confident | 93.5 | Very high | 21 Ų | 21 | 61.1 Ų | 61.1 | 22% | 0.216 | 34% | 0.339 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 56.3 | -123.5 | -177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | R255 E313 R382 | R255-G379 PolarHBondContact NH1-O 3.22Å; R255-G379 VanDerWaalsContact NH2-N 3.17Å; R255-G379 PolarHBondContact NH2-O 2.85Å; E313-G379 WeakPolarHBondContact OE2-CA 3.27Å; E313-G379 PolarHBondContact OE2-N 2.7Å; G379-R382 PolarHBondContact O-NH1 3.47Å; G379-R382 PolarHBondContact O-NH2 2.66Å |
| 380 | N | 85.4 | Confident | 93.5 | Very high | 100 Ų | 100 | 60.3 Ų | 60.3 | 54% | 0.535 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.8 | 1.1 | 177.3 | -71.3 | -0.3 | 0 | 0 | 0 | 113.7 | I378 | I378-N380 PolarHBondContact O-N 2.74Š|
| 381 | S | 84.1 | Confident | 93.5 | Very high | 57 Ų | 57 | 61.3 Ų | 61.3 | 40% | 0.399 | 35% | 0.35 | S | S | . | . | trans | -73.9 | 137.8 | 176.6 | 78.3 | 0 | 0 | 0 | 0 | 110.8 | P377 I378 P383 | P377-S381 WeakPolarHBondContact CA-O 3.42Å; P377-S381 WeakPolarHBondContact CB-O 3.37Å; I378-S381 PolarHBondContact O-N 3.29Å; I378-S381 PolarHBondContact O-OG 3.07Å; S381-P383 VanDerWaalsContact C-CD 3.44Å | ||
| 382 | R | 86.6 | Confident | 93.5 | Very high | 105 Ų | 105 | 61.3 Ų | 61.3 | 40% | 0.396 | 35% | 0.35 | S | S | . | . | trans | -133.7 | 56.4 | 173.8 | -57.8 | -66.6 | 177.8 | -85.5 | -10.7 | 110.2 | T226 G379 | T226-R382 PolarHBondContact O-NH2 3.28Å; T226-R382 PolarHBondContact OG1-NE 3.13Å; T226-R382 PolarHBondContact OG1-NH2 3.02Å; G379-R382 PolarHBondContact O-NH1 3.47Å; G379-R382 PolarHBondContact O-NH2 2.66Å | ||
| 383 | P | 91.8 | Very high | 93.6 | Very high | 50 Ų | 50 | 58.8 Ų | 58.8 | 33% | 0.325 | 33% | 0.329 | S | S | . | . | P | Polyproline II helix | trans | -70.3 | 151.9 | -178.7 | 31.9 | -35.9 | 0 | 0 | 0 | 111.5 | R375 S381 | R375-P383 HydrophobicContact CB-CB 4.22Å; R375-P383 HydrophobicContact CB-CG 3.86Å; R375-P383 HydrophobicContact CG-CB 4.49Å; R375-P383 WeakPolarHBondContact O-CG 3.4Å; S381-P383 VanDerWaalsContact C-CD 3.44Å |
| 384 | T | 92.9 | Very high | 93.7 | Very high | 116 Ų | 116 | 59.1 Ų | 59.1 | 71% | 0.712 | 34% | 0.338 | S | S | * | . | P | Polyproline II helix | trans | -68 | 133.6 | 168.7 | -47 | 0 | 0 | 0 | 0 | 109.8 | R375 | R375-T384 WeakPolarHBondContact CG-O 3.45Š|
| 385 | P | 92.9 | Very high | 93.7 | Very high | 76 Ų | 76 | 58.9 Ų | 58.9 | 49% | 0.494 | 34% | 0.337 | S | S | . | . | P | Polyproline II helix | trans | -53.9 | 137.2 | 168.1 | -29.4 | 38.1 | 0 | 0 | 0 | 112.9 | Q392 | P385-Q392 HydrophobicContact CB-CG 4.27Š|
| 386 | I | 96.2 | Very high | 93.8 | Very high | 98 Ų | 98 | 56.3 Ų | 56.3 | 50% | 0.503 | 33% | 0.329 | S | S | . | . | trans | -121.8 | -12.3 | 174.1 | 65.6 | 173.6 | 0 | 0 | 0 | 113.2 | Q373 R375 | Q373-I386 HydrophobicContact CB-CD1 4.06Å; Q373-I386 HydrophobicContact CB-CG1 4.46Å; Q373-I386 HydrophobicContact CG-CD1 4.09Å; R375-I386 HydrophobicContact CG-CD1 4.49Å; R375-I386 HydrophobicContact CG-CG1 3.92Å | ||
| 387 | L | 96.9 | Very high | 93.9 | Very high | 25 Ų | 25 | 59.6 Ų | 59.6 | 13% | 0.131 | 34% | 0.344 | C | S | . | . | S | Bend | trans | -95.4 | 153.6 | 178.5 | -68.8 | 175.7 | 0 | 0 | 0 | 110.8 | L370 Q373 I391 Q392 L395 | L370-L387 HydrophobicContact CD1-CD1 4.18Å; L370-L387 HydrophobicContact CD1-CD2 3.79Å; Q373-L387 HydrophobicContact CB-CD1 3.93Å; Q373-L387 HydrophobicContact CB-CD2 3.77Å; Q373-L387 HydrophobicContact CB-CG 3.91Å; L387-I391 HydrophobicContact CD1-CG2 4.34Å; L387-Q392 HydrophobicContact CB-CB 4.22Å; L387-L395 HydrophobicContact CD1-CD1 3.55Å |
| 388 | E | 96.9 | Very high | 94.2 | Very high | 143 Ų | 143 | 61.8 Ų | 61.8 | 67% | 0.668 | 35% | 0.351 | S | S | * | . | trans | -45.9 | 134.8 | 173.8 | -80.7 | -60.3 | 147.5 | 0 | 0 | 112.4 | G390 I391 Q392 | E388-G390 PolarHBondContact O-N 2.74Å; E388-I391 HydrophobicContact CB-CB 4.5Å; E388-I391 HydrophobicContact CB-CG1 4.22Å; E388-I391 PolarHBondContact O-N 3.28Å; E388-Q392 PolarHBondContact O-N 2.95Å | ||
| 389 | P | 95.9 | Very high | 94.4 | Very high | 56 Ų | 56 | 60.8 Ų | 60.8 | 36% | 0.364 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -52.8 | -36 | -171.7 | -31.6 | 37.3 | 0 | 0 | 0 | 115.1 | M212 S393 | M212-P389 HydrophobicContact CE-CB 3.82Å; M212-P389 HydrophobicContact CE-CG 3.92Å; M212-P389 HydrophobicContact SD-CB 4.3Å; P389-S393 WeakPolarHBondContact O-CB 3.45Å; P389-S393 PolarHBondContact O-N 3.1Å |
| 390 | G | 97.6 | Very high | 94.8 | Very high | 47 Ų | 47 | 60.7 Ų | 60.7 | 49% | 0.485 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -65.9 | -45 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | E388 S393 C394 | E388-G390 PolarHBondContact O-N 2.74Å; G390-S393 PolarHBondContact O-N 3.03Å; G390-C394 PolarHBondContact O-N 2.87Å; G390-C394 VanDerWaalsContact O-N 3.15Å; G390-C394 PolarHBondContact O-SG 3.01Å; G390-C394 VanDerWaalsContact O-SG 3.39Å |
| 391 | I | 97.6 | Very high | 95.4 | Very high | 84 Ų | 84 | 58.6 Ų | 58.6 | 43% | 0.431 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -69.1 | -46.6 | 178.9 | -56.6 | -57.9 | 0 | 0 | 0 | 110.3 | L370 L387 E388 S393 C394 L395 | L370-I391 HydrophobicContact CD1-CG2 4.45Å; L387-I391 HydrophobicContact CD1-CG2 4.34Å; E388-I391 HydrophobicContact CB-CB 4.5Å; E388-I391 HydrophobicContact CB-CG1 4.22Å; E388-I391 PolarHBondContact O-N 3.28Å; I391-S393 VanDerWaalsContact C-N 3.29Å; I391-S393 PolarHBondContact O-N 3.45Å; I391-C394 PolarHBondContact O-N 3.4Å; I391-L395 HydrophobicContact CG2-CD1 4.01Å; I391-L395 HydrophobicContact CG2-CG 4.44Å; I391-L395 WeakPolarHBondContact O-CG 3.05Å; I391-L395 PolarHBondContact O-N 3.1Å |
| 392 | Q | 97.4 | Very high | 96 | Very high | 12 Ų | 12 | 56.3 Ų | 56.3 | 6% | 0.056 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.9 | -35.2 | 176.4 | -173 | 59 | 69.5 | 0 | 0 | 111.6 | D374 T376 P385 L387 E388 T396 | D374-Q392 PolarHBondContact OD1-NE2 3.2Å; T376-Q392 PolarHBondContact OG1-NE2 2.78Å; P385-Q392 HydrophobicContact CB-CG 4.27Å; L387-Q392 HydrophobicContact CB-CB 4.22Å; E388-Q392 PolarHBondContact O-N 2.95Å; Q392-T396 PolarHBondContact NE2-OG1 2.87Å; Q392-T396 WeakPolarHBondContact O-CB 3.47Å; Q392-T396 PolarHBondContact O-N 3.33Å; Q392-T396 PolarHBondContact O-OG1 1.95Å |
| 393 | S | 97.1 | Very high | 96.5 | Very high | 11 Ų | 11 | 51.5 Ų | 51.5 | 8% | 0.077 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.4 | -44.5 | 174.5 | -173.5 | 0 | 0 | 0 | 0 | 112 | V208 P389 G390 I391 T396 H397 | V208-S393 PolarHBondContact O-OG 2.89Å; P389-S393 WeakPolarHBondContact O-CB 3.45Å; P389-S393 PolarHBondContact O-N 3.1Å; G390-S393 PolarHBondContact O-N 3.03Å; I391-S393 VanDerWaalsContact C-N 3.29Å; I391-S393 PolarHBondContact O-N 3.45Å; S393-T396 WeakPolarHBondContact O-CB 3.48Å; S393-T396 PolarHBondContact O-N 3.01Å; S393-H397 PolarHBondContact O-N 3.01Å |
| 394 | C | 97.7 | Very high | 96.7 | Very high | 82 Ų | 82 | 49.5 Ų | 49.5 | 55% | 0.554 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -63.8 | -45.6 | 176.7 | -71 | 0 | 0 | 0 | 0 | 112.7 | G390 I391 H397 F398 | G390-C394 PolarHBondContact O-N 2.87Å; G390-C394 VanDerWaalsContact O-N 3.15Å; G390-C394 PolarHBondContact O-SG 3.01Å; G390-C394 VanDerWaalsContact O-SG 3.39Å; I391-C394 PolarHBondContact O-N 3.4Å; C394-H397 PolarHBondContact O-N 3.49Å; C394-F398 PolarHBondContact O-N 3.45Å; C394-F398 VanDerWaalsContact O-N 3.11Å |
| 395 | L | 97.9 | Very high | 97 | Very high | 21 Ų | 21 | 46.1 Ų | 46.1 | 11% | 0.11 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -64.1 | -41.1 | 175 | -66.4 | 174.5 | 0 | 0 | 0 | 111.3 | L371 D374 L387 I391 H397 F398 S399 | L371-L395 HydrophobicContact CD2-CD2 3.77Å; D374-L395 HydrophobicContact CB-CD1 4.23Å; L387-L395 HydrophobicContact CD1-CD1 3.55Å; I391-L395 HydrophobicContact CG2-CD1 4.01Å; I391-L395 HydrophobicContact CG2-CG 4.44Å; I391-L395 WeakPolarHBondContact O-CG 3.05Å; I391-L395 PolarHBondContact O-N 3.1Å; L395-H397 PolarHBondContact O-N 3.36Å; L395-F398 PolarHBondContact O-N 3.39Å; L395-F398 VanDerWaalsContact O-N 3.16Å; L395-S399 WeakPolarHBondContact O-CB 3.27Å; L395-S399 PolarHBondContact O-N 2.9Å; L395-S399 PolarHBondContact O-OG 3.1Å |
| 396 | T | 97.3 | Very high | 97.2 | Very high | 20 Ų | 20 | 42.7 Ų | 42.7 | 12% | 0.123 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -56.9 | -46.6 | 173.4 | -60.3 | 0 | 0 | 0 | 0 | 111.5 | T376 Q392 S393 F398 L400 | T376-T396 HydrophobicContact CG2-CG2 4.25Å; T376-T396 VanDerWaalsContact OG1-CA 3.25Å; T376-T396 WeakPolarHBondContact OG1-CA 3.37Å; T376-T396 PolarHBondContact OG1-N 2.78Å; Q392-T396 PolarHBondContact NE2-OG1 2.87Å; Q392-T396 WeakPolarHBondContact O-CB 3.47Å; Q392-T396 PolarHBondContact O-N 3.33Å; Q392-T396 PolarHBondContact O-OG1 1.95Å; S393-T396 WeakPolarHBondContact O-CB 3.48Å; S393-T396 PolarHBondContact O-N 3.01Å; T396-F398 PolarHBondContact O-N 3.28Å; T396-L400 HydrophobicContact CG2-CD1 3.65Å; T396-L400 HydrophobicContact CG2-CG 4.26Å; T396-L400 VanDerWaalsContact O-CB 3.22Å; T396-L400 WeakPolarHBondContact O-CB 3.42Å; T396-L400 WeakPolarHBondContact O-CD1 3.34Å; T396-L400 WeakPolarHBondContact O-CG 3.33Å; T396-L400 PolarHBondContact O-N 3.24Å |
| 397 | H | 97.3 | Very high | 97.3 | Very high | 79 Ų | 79 | 38.3 Ų | 38.3 | 37% | 0.366 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -58 | -49.7 | 175.7 | -165.9 | 127.7 | 0 | 0 | 0 | 111.2 | L211 S393 C394 L395 L400 I401 | L211-H397 HydrophobicContact CD1-CB 4.28Å; S393-H397 PolarHBondContact O-N 3.01Å; C394-H397 PolarHBondContact O-N 3.49Å; L395-H397 PolarHBondContact O-N 3.36Å; H397-L400 PolarHBondContact O-N 3.01Å; H397-I401 WeakPolarHBondContact O-CG1 3.35Å; H397-I401 PolarHBondContact O-N 2.91Å |
| 398 | F | 97.9 | Very high | 97.3 | Very high | 69 Ų | 69 | 40.2 Ų | 40.2 | 30% | 0.303 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -64.9 | -48.8 | -177.3 | 179.3 | -118.3 | 0 | 0 | 0 | 113 | C394 L395 T396 L400 I401 T402 G406 A407 I410 | C394-F398 PolarHBondContact O-N 3.45Å; C394-F398 VanDerWaalsContact O-N 3.11Å; L395-F398 PolarHBondContact O-N 3.39Å; L395-F398 VanDerWaalsContact O-N 3.16Å; T396-F398 PolarHBondContact O-N 3.28Å; F398-L400 VanDerWaalsContact C-N 3.27Å; F398-L400 PolarHBondContact O-N 3.32Å; F398-I401 WeakPolarHBondContact O-CG1 3.47Å; F398-I401 PolarHBondContact O-N 3.35Å; F398-T402 HydrophobicContact CD2-CG2 4.02Å; F398-T402 HydrophobicContact CE2-CG2 3.72Å; F398-T402 HydrophobicContact CZ-CG2 4.18Å; F398-T402 WeakPolarHBondContact O-CB 3.49Å; F398-T402 WeakPolarHBondContact O-CG2 3.42Å; F398-T402 PolarHBondContact O-N 3.05Å; F398-T402 PolarHBondContact O-OG1 3.36Å; F398-G406 VanDerWaalsContact CE1-C 3.44Å; F398-A407 HydrophobicContact CE1-CB 4.4Å; F398-I410 HydrophobicContact CE1-CD1 3.76Å; F398-I410 HydrophobicContact CZ-CD1 3.7Å |
| 399 | S | 97.5 | Very high | 97.4 | Very high | 4 Ų | 4 | 33.9 Ų | 33.9 | 3% | 0.028 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.3 | -30.2 | 177.5 | -73.7 | 0 | 0 | 0 | 0 | 111.9 | D374 L395 H403 G404 | D374-S399 PolarHBondContact OD2-OG 3.43Å; L395-S399 WeakPolarHBondContact O-CB 3.27Å; L395-S399 PolarHBondContact O-N 2.9Å; L395-S399 PolarHBondContact O-OG 3.1Å; S399-H403 PolarHBondContact O-N 3Å; S399-H403 VanDerWaalsContact O-N 3.12Å; S399-G404 PolarHBondContact O-N 2.95Å |
| 400 | L | 96.9 | Very high | 97.5 | Very high | 20 Ų | 20 | 34.1 Ų | 34.1 | 11% | 0.105 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -73.2 | -47.5 | 172.5 | -71.5 | 173 | 0 | 0 | 0 | 113.6 | R255 P260 T376 I378 T396 H397 F398 T402 H403 | R255-L400 HydrophobicContact CB-CD2 4.14Å; R255-L400 VanDerWaalsContact CD-CD2 3.46Å; R255-L400 HydrophobicContact CG-CD2 3.94Å; P260-L400 HydrophobicContact CG-CB 3.78Å; P260-L400 HydrophobicContact CG-CD1 4.38Å; T376-L400 HydrophobicContact CG2-CG 4.32Å; I378-L400 HydrophobicContact CD1-CD2 4.07Å; T396-L400 HydrophobicContact CG2-CD1 3.65Å; T396-L400 HydrophobicContact CG2-CG 4.26Å; T396-L400 VanDerWaalsContact O-CB 3.22Å; T396-L400 WeakPolarHBondContact O-CB 3.42Å; T396-L400 WeakPolarHBondContact O-CD1 3.34Å; T396-L400 WeakPolarHBondContact O-CG 3.33Å; T396-L400 PolarHBondContact O-N 3.24Å; H397-L400 PolarHBondContact O-N 3.01Å; F398-L400 VanDerWaalsContact C-N 3.27Å; F398-L400 PolarHBondContact O-N 3.32Å; L400-T402 PolarHBondContact O-N 2.92Å; L400-H403 PolarHBondContact O-CD2 2.85Å; L400-H403 PolarHBondContact O-N 3.07Å |
| 401 | I | 96.7 | Very high | 97.5 | Very high | 55 Ų | 55 | 33.1 Ų | 33.1 | 28% | 0.282 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -72.2 | -17.6 | 179.7 | 65.9 | 175.1 | 0 | 0 | 0 | 113.7 | P260 H397 F398 H403 | P260-I401 HydrophobicContact CB-CG2 3.82Å; P260-I401 HydrophobicContact CG-CG2 3.44Å; P260-I401 VanDerWaalsContact CG-CG2 3.44Å; H397-I401 WeakPolarHBondContact O-CG1 3.35Å; H397-I401 PolarHBondContact O-N 2.91Å; F398-I401 WeakPolarHBondContact O-CG1 3.47Å; F398-I401 PolarHBondContact O-N 3.35Å; I401-H403 PolarHBondContact O-CE1 3.04Å |
| 402 | T | 97.4 | Very high | 97.6 | Very high | 9 Ų | 9 | 29.6 Ų | 29.6 | 6% | 0.055 | 17% | 0.168 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -101.4 | 2.8 | 173.5 | 63.1 | 0 | 0 | 0 | 0 | 113.3 | L308 F398 L400 G404 F405 G406 | L308-T402 HydrophobicContact CD1-CG2 3.8Å; F398-T402 HydrophobicContact CD2-CG2 4.02Å; F398-T402 HydrophobicContact CE2-CG2 3.72Å; F398-T402 HydrophobicContact CZ-CG2 4.18Å; F398-T402 WeakPolarHBondContact O-CB 3.49Å; F398-T402 WeakPolarHBondContact O-CG2 3.42Å; F398-T402 PolarHBondContact O-N 3.05Å; F398-T402 PolarHBondContact O-OG1 3.36Å; L400-T402 PolarHBondContact O-N 2.92Å; T402-G404 PolarHBondContact O-N 2.88Å; T402-G404 VanDerWaalsContact O-N 3.11Å; T402-F405 VanDerWaalsContact O-CB 3.3Å; T402-F405 WeakPolarHBondContact O-CB 3.12Å; T402-F405 PolarHBondContact O-N 2.95Å; T402-G406 WeakPolarHBondContact OG1-CA 3.4Å; T402-G406 PolarHBondContact OG1-N 3Å |
| 403 | H | 97 | Very high | 97.6 | Very high | 5 Ų | 5 | 31.4 Ų | 31.4 | 2% | 0.023 | 19% | 0.185 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 54.4 | 30.8 | 177.3 | -50.1 | 90.5 | 0 | 0 | 0 | 113.9 | R256 E261 L308 T309 E313 A316 S399 L400 I401 | R256-H403 PolarHBondContact NH1-NE2 2.76Å; R256-H403 PolarHBondContact NH2-CD2 3.44Å; R256-H403 VanDerWaalsContact NH2-CD2 3.28Å; E261-H403 WeakPolarHBondContact CG-NE2 3.47Å; E261-H403 IonicContact OE1-CE1 3.72Å; E261-H403 PolarHBondContact OE1-CE1 2.77Å; E261-H403 IonicContact OE1-NE2 3.3Å; E261-H403 PolarHBondContact OE1-NE2 3.04Å; E261-H403 IonicContact OE2-CE1 3.05Å; E261-H403 IonicContact OE2-NE2 3.53Å; E261-H403 PolarHBondContact OE2-NE2 3.01Å; L308-H403 PolarHBondContact O-ND1 2.76Å; T309-H403 WeakPolarHBondContact CA-CE1 3.49Å; T309-H403 PolarHBondContact N-CE1 3.07Å; T309-H403 VanDerWaalsContact N-CE1 3.35Å; T309-H403 PolarHBondContact OG1-CE1 3.5Å; E313-H403 HydrophobicContact CG-CB 4.02Å; A316-H403 HydrophobicContact CB-CB 3.84Å; A316-H403 WeakPolarHBondContact CB-O 3.45Å; S399-H403 PolarHBondContact O-N 3Å; S399-H403 VanDerWaalsContact O-N 3.12Å; L400-H403 PolarHBondContact O-CD2 2.85Å; L400-H403 PolarHBondContact O-N 3.07Å; I401-H403 PolarHBondContact O-CE1 3.04Å |
| 404 | G | 96.4 | Very high | 97.7 | Very high | 7 Ų | 7 | 32.1 Ų | 32.1 | 7% | 0.072 | 19% | 0.188 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 89.5 | -2.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 116.1 | S399 T402 P408 | S399-G404 PolarHBondContact O-N 2.95Å; T402-G404 PolarHBondContact O-N 2.88Å; T402-G404 VanDerWaalsContact O-N 3.11Å; G404-P408 WeakPolarHBondContact O-CD 3.23Å |
| 405 | F | 98.2 | Very high | 97.7 | Very high | 45 Ų | 45 | 30.7 Ų | 30.7 | 20% | 0.197 | 18% | 0.176 | C | C | . | . | trans | -73.9 | -39.2 | 177.1 | 171.7 | -96 | 0 | 0 | 0 | 113.1 | L308 A316 L319 A320 T402 A409 | L308-F405 HydrophobicContact CD1-CD1 4.38Å; L308-F405 HydrophobicContact CD2-CD1 4.13Å; L308-F405 HydrophobicContact CD2-CG 4.44Å; A316-F405 HydrophobicContact CB-CB 4.05Å; L319-F405 HydrophobicContact CB-CD2 4.31Å; L319-F405 HydrophobicContact CB-CE2 4.5Å; L319-F405 HydrophobicContact CD2-CD2 4.14Å; L319-F405 HydrophobicContact CD2-CE2 4.02Å; L319-F405 HydrophobicContact CG-CD2 4.1Å; L319-F405 HydrophobicContact CG-CE2 3.85Å; A320-F405 HydrophobicContact CB-CD2 3.7Å; A320-F405 HydrophobicContact CB-CE2 4.27Å; A320-F405 HydrophobicContact CB-CG 4.45Å; T402-F405 VanDerWaalsContact O-CB 3.3Å; T402-F405 WeakPolarHBondContact O-CB 3.12Å; T402-F405 PolarHBondContact O-N 2.95Å; F405-A409 HydrophobicContact CD1-CB 4.12Å; F405-A409 HydrophobicContact CD2-CB 4.37Å; F405-A409 HydrophobicContact CE1-CB 3.64Å; F405-A409 HydrophobicContact CE2-CB 3.9Å; F405-A409 HydrophobicContact CG-CB 4.45Å; F405-A409 HydrophobicContact CZ-CB 3.51Å; F405-A409 VanDerWaalsContact O-CB 3.28Å; F405-A409 WeakPolarHBondContact O-CB 3.48Å; F405-A409 PolarHBondContact O-N 3.13Å | ||
| 406 | G | 97.8 | Very high | 97.7 | Very high | 5 Ų | 5 | 30 Ų | 30 | 5% | 0.052 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62.2 | -59 | -159.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | F398 T402 A409 I410 | F398-G406 VanDerWaalsContact CE1-C 3.44Å; T402-G406 WeakPolarHBondContact OG1-CA 3.4Å; T402-G406 PolarHBondContact OG1-N 3Å; G406-A409 PolarHBondContact O-N 2.95Å; G406-I410 WeakPolarHBondContact O-CG1 3.48Å; G406-I410 PolarHBondContact O-N 2.85Å; G406-I410 VanDerWaalsContact O-N 3.08Å |
| 407 | A | 97.5 | Very high | 97.7 | Very high | 6 Ų | 6 | 32.3 Ų | 32.3 | 5% | 0.05 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.9 | -45.5 | -176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | L371 F398 A409 I410 C411 | L371-A407 HydrophobicContact CD2-CB 4.34Å; F398-A407 HydrophobicContact CE1-CB 4.4Å; A407-A409 VanDerWaalsContact C-N 3.33Å; A407-A409 PolarHBondContact O-N 3.38Å; A407-I410 PolarHBondContact O-N 2.94Å; A407-C411 PolarHBondContact O-N 2.69Å; A407-C411 PolarHBondContact O-SG 3.45Å |
| 408 | P | 97.7 | Very high | 97.8 | Very high | 65 Ų | 65 | 29.9 Ų | 29.9 | 42% | 0.422 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -60.3 | -36.5 | 174.2 | -26 | 36.3 | 0 | 0 | 0 | 114 | A320 G404 C411 A412 | A320-P408 HydrophobicContact CB-CB 4.09Å; G404-P408 WeakPolarHBondContact O-CD 3.23Å; P408-C411 PolarHBondContact O-N 3.31Å; P408-A412 WeakPolarHBondContact O-CB 3.33Å; P408-A412 PolarHBondContact O-N 3.2Å |
| 409 | A | 98.4 | Very high | 97.8 | Very high | 10 Ų | 10 | 29.7 Ų | 29.7 | 8% | 0.083 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -67.7 | -35.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | F323 F405 G406 A407 A412 A413 | F323-A409 HydrophobicContact CD1-CB 4.14Å; F323-A409 HydrophobicContact CE1-CB 4.32Å; F405-A409 HydrophobicContact CD1-CB 4.12Å; F405-A409 HydrophobicContact CD2-CB 4.37Å; F405-A409 HydrophobicContact CE1-CB 3.64Å; F405-A409 HydrophobicContact CE2-CB 3.9Å; F405-A409 HydrophobicContact CG-CB 4.45Å; F405-A409 HydrophobicContact CZ-CB 3.51Å; F405-A409 VanDerWaalsContact O-CB 3.28Å; F405-A409 WeakPolarHBondContact O-CB 3.48Å; F405-A409 PolarHBondContact O-N 3.13Å; G406-A409 PolarHBondContact O-N 2.95Å; A407-A409 VanDerWaalsContact C-N 3.33Å; A407-A409 PolarHBondContact O-N 3.38Å; A409-A412 PolarHBondContact O-N 2.85Å; A409-A413 PolarHBondContact O-N 3.31Å; A409-A413 VanDerWaalsContact O-N 3.15Å |
| 410 | I | 98.5 | Very high | 97.8 | Very high | 61 Ų | 61 | 30.7 Ų | 30.7 | 31% | 0.313 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -65 | -46.2 | 171.4 | -67.7 | 170.3 | 0 | 0 | 0 | 110.2 | F367 L371 F398 G406 A407 A412 A413 L414 | F367-I410 HydrophobicContact CE1-CG2 3.98Å; L371-I410 HydrophobicContact CD1-CB 4.12Å; L371-I410 HydrophobicContact CD1-CG2 3.59Å; F398-I410 HydrophobicContact CE1-CD1 3.76Å; F398-I410 HydrophobicContact CZ-CD1 3.7Å; G406-I410 WeakPolarHBondContact O-CG1 3.48Å; G406-I410 PolarHBondContact O-N 2.85Å; G406-I410 VanDerWaalsContact O-N 3.08Å; A407-I410 PolarHBondContact O-N 2.94Å; I410-A412 VanDerWaalsContact C-N 3.34Å; I410-A412 PolarHBondContact O-N 3.43Å; I410-A413 PolarHBondContact O-N 3.31Å; I410-L414 HydrophobicContact CG2-CD1 3.75Å; I410-L414 HydrophobicContact CG2-CG 4.34Å; I410-L414 WeakPolarHBondContact O-CG 3.29Å; I410-L414 PolarHBondContact O-N 2.99Å |
| 411 | C | 98.3 | Very high | 97.9 | Very high | 26 Ų | 26 | 30 Ų | 30 | 18% | 0.176 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58.6 | -43.1 | 176 | -63.5 | 0 | 0 | 0 | 0 | 112 | T368 A407 P408 A413 L414 T415 | T368-C411 HydrophobicContact CG2-CB 4.25Å; A407-C411 PolarHBondContact O-N 2.69Å; A407-C411 PolarHBondContact O-SG 3.45Å; P408-C411 PolarHBondContact O-N 3.31Å; C411-A413 PolarHBondContact O-N 2.94Å; C411-L414 PolarHBondContact O-N 3.4Å; C411-T415 PolarHBondContact O-N 3.28Å; C411-T415 PolarHBondContact O-OG1 3.02Å; C411-T415 VanDerWaalsContact O-OG1 3.08Å |
| 412 | A | 98.4 | Very high | 98 | Very high | 10 Ų | 10 | 29 Ų | 29 | 8% | 0.083 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -57.7 | -48.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | F323 C327 P408 A409 I410 L414 T415 A416 | F323-A412 HydrophobicContact CD1-CB 3.92Å; F323-A412 HydrophobicContact CE1-CB 4.01Å; C327-A412 HydrophobicContact CB-CB 4.32Å; P408-A412 WeakPolarHBondContact O-CB 3.33Å; P408-A412 PolarHBondContact O-N 3.2Å; A409-A412 PolarHBondContact O-N 2.85Å; I410-A412 VanDerWaalsContact C-N 3.34Å; I410-A412 PolarHBondContact O-N 3.43Å; A412-L414 VanDerWaalsContact C-N 3.33Å; A412-L414 PolarHBondContact O-N 3.44Å; A412-T415 PolarHBondContact O-N 2.71Å; A412-A416 PolarHBondContact O-N 3.21Å |
| 413 | A | 98.4 | Very high | 98 | Very high | 49 Ų | 49 | 31 Ų | 31 | 41% | 0.405 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -64.2 | -37.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | A409 I410 C411 A416 L417 | A409-A413 PolarHBondContact O-N 3.31Å; A409-A413 VanDerWaalsContact O-N 3.15Å; I410-A413 PolarHBondContact O-N 3.31Å; C411-A413 PolarHBondContact O-N 2.94Å; A413-A416 PolarHBondContact O-N 3.27Å; A413-L417 WeakPolarHBondContact O-CB 3.15Å; A413-L417 PolarHBondContact O-N 3.48Å |
| 414 | L | 98.4 | Very high | 98 | Very high | 27 Ų | 27 | 30.8 Ų | 30.8 | 14% | 0.141 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -70.8 | -30 | 174.9 | -68.9 | 170.9 | 0 | 0 | 0 | 112.8 | C364 F367 I410 C411 A412 L417 Q418 | C364-L414 HydrophobicContact CB-CD2 4.38Å; F367-L414 HydrophobicContact CD1-CD1 3.62Å; F367-L414 HydrophobicContact CE1-CD1 4.08Å; I410-L414 HydrophobicContact CG2-CD1 3.75Å; I410-L414 HydrophobicContact CG2-CG 4.34Å; I410-L414 WeakPolarHBondContact O-CG 3.29Å; I410-L414 PolarHBondContact O-N 2.99Å; C411-L414 PolarHBondContact O-N 3.4Å; A412-L414 VanDerWaalsContact C-N 3.33Å; A412-L414 PolarHBondContact O-N 3.44Å; L414-L417 HydrophobicContact CD2-CD2 4.38Å; L414-Q418 WeakPolarHBondContact O-CB 3.49Å; L414-Q418 VanDerWaalsContact O-CG 3.24Å; L414-Q418 WeakPolarHBondContact O-CG 3.34Å; L414-Q418 PolarHBondContact O-N 2.99Å; L414-Q418 PolarHBondContact O-NE2 3.2Å |
| 415 | T | 97.1 | Very high | 98 | Very high | 52 Ų | 52 | 31.3 Ų | 31.3 | 32% | 0.319 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -68.6 | -45.9 | 171.8 | -64.5 | 0 | 0 | 0 | 0 | 110.9 | C411 A412 L417 Q418 N419 | C411-T415 PolarHBondContact O-N 3.28Å; C411-T415 PolarHBondContact O-OG1 3.02Å; C411-T415 VanDerWaalsContact O-OG1 3.08Å; A412-T415 PolarHBondContact O-N 2.71Å; T415-L417 VanDerWaalsContact C-N 3.29Å; T415-L417 PolarHBondContact O-N 3.45Å; T415-Q418 PolarHBondContact O-N 3.22Å; T415-Q418 VanDerWaalsContact O-N 3.17Å; T415-N419 WeakPolarHBondContact O-CB 3.33Å; T415-N419 VanDerWaalsContact O-CG 3.31Å; T415-N419 PolarHBondContact O-N 2.95Å |
| 416 | A | 98.4 | Very high | 97.9 | Very high | 6 Ų | 6 | 34.1 Ų | 34.1 | 5% | 0.05 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -57.3 | -42.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | C327 F331 A412 A413 N419 Y420 | C327-A416 HydrophobicContact CB-CB 4.19Å; F331-A416 HydrophobicContact CB-CB 4.39Å; F331-A416 HydrophobicContact CD1-CB 3.76Å; F331-A416 HydrophobicContact CE1-CB 4.2Å; F331-A416 HydrophobicContact CG-CB 4.01Å; A412-A416 PolarHBondContact O-N 3.21Å; A413-A416 PolarHBondContact O-N 3.27Å; A416-N419 PolarHBondContact O-N 3.07Å; A416-Y420 PolarHBondContact O-N 3.07Å |
| 417 | L | 98.5 | Very high | 97.7 | Very high | 68 Ų | 68 | 34.8 Ų | 34.8 | 36% | 0.356 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -64.4 | -44.9 | 173.9 | -178.9 | 62.1 | 0 | 0 | 0 | 112.4 | A413 L414 T415 N419 Y420 L421 | A413-L417 WeakPolarHBondContact O-CB 3.15Å; A413-L417 PolarHBondContact O-N 3.48Å; L414-L417 HydrophobicContact CD2-CD2 4.38Å; T415-L417 VanDerWaalsContact C-N 3.29Å; T415-L417 PolarHBondContact O-N 3.45Å; L417-N419 VanDerWaalsContact C-N 3.3Å; L417-N419 PolarHBondContact O-N 3.15Å; L417-Y420 HydrophobicContact CD1-CD1 4Å; L417-Y420 WeakPolarHBondContact O-CB 3.33Å; L417-Y420 PolarHBondContact O-N 3.07Å; L417-L421 HydrophobicContact CG-CD1 4.2Å; L417-L421 VanDerWaalsContact O-CG 3.32Å; L417-L421 WeakPolarHBondContact O-CG 3.21Å; L417-L421 PolarHBondContact O-N 3.4Å |
| 418 | Q | 97.9 | Very high | 97.4 | Very high | 29 Ų | 29 | 34.6 Ų | 34.6 | 14% | 0.136 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.8 | -32.8 | 177 | -77.3 | 175 | 87.8 | 0 | 0 | 112.7 | K361 C364 L414 T415 L421 T422 | K361-Q418 HydrophobicContact CG-CG 4.4Å; C364-Q418 HydrophobicContact CB-CG 3.8Å; L414-Q418 WeakPolarHBondContact O-CB 3.49Å; L414-Q418 VanDerWaalsContact O-CG 3.24Å; L414-Q418 WeakPolarHBondContact O-CG 3.34Å; L414-Q418 PolarHBondContact O-N 2.99Å; L414-Q418 PolarHBondContact O-NE2 3.2Å; T415-Q418 PolarHBondContact O-N 3.22Å; T415-Q418 VanDerWaalsContact O-N 3.17Å; Q418-L421 PolarHBondContact O-N 3.33Å; Q418-T422 WeakPolarHBondContact O-CB 3.24Å; Q418-T422 PolarHBondContact O-N 2.99Å; Q418-T422 PolarHBondContact O-OG1 2.92Å |
| 419 | N | 98 | Very high | 97 | Very high | 64 Ų | 64 | 34.6 Ų | 34.6 | 34% | 0.342 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -65.5 | -46.5 | 172.1 | -72.4 | -11.8 | 0 | 0 | 0 | 110.6 | A333 T415 A416 L417 L421 T422 E423 | A333-N419 HydrophobicContact CB-CB 4.15Å; T415-N419 WeakPolarHBondContact O-CB 3.33Å; T415-N419 VanDerWaalsContact O-CG 3.31Å; T415-N419 PolarHBondContact O-N 2.95Å; A416-N419 PolarHBondContact O-N 3.07Å; L417-N419 VanDerWaalsContact C-N 3.3Å; L417-N419 PolarHBondContact O-N 3.15Å; N419-L421 PolarHBondContact O-N 3.14Å; N419-T422 WeakPolarHBondContact O-CB 3.45Å; N419-T422 PolarHBondContact O-N 2.93Å; N419-E423 PolarHBondContact O-N 3.34Å |
| 420 | Y | 98.4 | Very high | 96.5 | Very high | 26 Ų | 26 | 40.6 Ų | 40.6 | 10% | 0.102 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -57.5 | -47.6 | 171.8 | 155.6 | -93.8 | 0 | 0 | 0 | 112.4 | V336 L340 A416 L417 T422 E423 A424 | V336-Y420 HydrophobicContact CB-CD2 4.14Å; V336-Y420 HydrophobicContact CB-CE2 4.5Å; V336-Y420 HydrophobicContact CG1-CD2 3.83Å; V336-Y420 HydrophobicContact CG1-CE2 3.86Å; L340-Y420 HydrophobicContact CD1-CE2 3.9Å; L340-Y420 WeakPolarHBondContact CD1-OH 3.36Å; A416-Y420 PolarHBondContact O-N 3.07Å; L417-Y420 HydrophobicContact CD1-CD1 4Å; L417-Y420 WeakPolarHBondContact O-CB 3.33Å; L417-Y420 PolarHBondContact O-N 3.07Å; Y420-T422 PolarHBondContact O-N 3.38Å; Y420-E423 PolarHBondContact O-N 3.2Å; Y420-A424 WeakPolarHBondContact O-CB 3.34Å; Y420-A424 PolarHBondContact O-N 2.7Å |
| 421 | L | 98.3 | Very high | 95.9 | Very high | 5 Ų | 5 | 39.9 Ų | 39.9 | 3% | 0.026 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.5 | -33.1 | 178.4 | -68.4 | 169.7 | 0 | 0 | 0 | 111.5 | L357 T360 K361 L417 Q418 N419 L425 | L357-L421 HydrophobicContact CD2-CD2 3.62Å; T360-L421 HydrophobicContact CG2-CD1 3.88Å; T360-L421 HydrophobicContact CG2-CD2 4.35Å; K361-L421 HydrophobicContact CB-CB 4.3Å; K361-L421 HydrophobicContact CB-CD1 3.94Å; L417-L421 HydrophobicContact CG-CD1 4.2Å; L417-L421 VanDerWaalsContact O-CG 3.32Å; L417-L421 WeakPolarHBondContact O-CG 3.21Å; L417-L421 PolarHBondContact O-N 3.4Å; Q418-L421 PolarHBondContact O-N 3.33Å; N419-L421 PolarHBondContact O-N 3.14Å; L421-L425 WeakPolarHBondContact O-CB 3.44Å; L421-L425 WeakPolarHBondContact O-CD1 3.18Å; L421-L425 VanDerWaalsContact O-CG 3.25Å; L421-L425 WeakPolarHBondContact O-CG 3.43Å; L421-L425 PolarHBondContact O-N 3.34Å |
| 422 | T | 98.1 | Very high | 95.1 | Very high | 35 Ų | 35 | 41.8 Ų | 41.8 | 22% | 0.215 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -71.8 | -42.8 | 177.5 | -57.6 | 0 | 0 | 0 | 0 | 112.1 | K361 Q418 N419 Y420 L425 K426 | K361-T422 PolarHBondContact NZ-OG1 2.93Å; Q418-T422 WeakPolarHBondContact O-CB 3.24Å; Q418-T422 PolarHBondContact O-N 2.99Å; Q418-T422 PolarHBondContact O-OG1 2.92Å; N419-T422 WeakPolarHBondContact O-CB 3.45Å; N419-T422 PolarHBondContact O-N 2.93Å; Y420-T422 PolarHBondContact O-N 3.38Å; T422-L425 PolarHBondContact O-N 3.3Å; T422-K426 WeakPolarHBondContact O-CG 3.39Å; T422-K426 PolarHBondContact O-N 2.97Å; T422-K426 VanDerWaalsContact O-N 3.09Å |
| 423 | E | 97.9 | Very high | 94.3 | Very high | 50 Ų | 50 | 47.2 Ų | 47.2 | 23% | 0.234 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -68.1 | -36.2 | 173.1 | -64.8 | -57 | 122.6 | 0 | 0 | 112 | K334 S337 N419 Y420 L425 K426 G427 | K334-E423 HydrophobicContact CB-CB 4.47Å; K334-E423 HydrophobicContact CB-CG 4.04Å; S337-E423 VanDerWaalsContact OG-CB 3.23Å; S337-E423 WeakPolarHBondContact OG-CB 3.39Å; N419-E423 PolarHBondContact O-N 3.34Å; Y420-E423 PolarHBondContact O-N 3.2Å; E423-L425 PolarHBondContact O-N 2.99Å; E423-K426 PolarHBondContact O-N 3.16Å; E423-K426 WeakPolarHBondContact OE1-CD 3.41Å; E423-K426 WeakPolarHBondContact OE1-CE 3.42Å; E423-K426 IonicContact OE1-NZ 3.9Å; E423-K426 PolarHBondContact OE1-NZ 3.2Å; E423-G427 PolarHBondContact O-N 3.27Å |
| 424 | A | 97.5 | Very high | 93.3 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.4 | -46.1 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | N341 L357 Y420 G427 M428 | N341-A424 PolarHBondContact ND2-O 2.8Å; L357-A424 HydrophobicContact CD1-CB 3.81Å; L357-A424 HydrophobicContact CD2-CB 4.42Å; Y420-A424 WeakPolarHBondContact O-CB 3.34Å; Y420-A424 PolarHBondContact O-N 2.7Å; A424-G427 WeakPolarHBondContact O-CA 3.46Å; A424-G427 PolarHBondContact O-N 3.37Å; A424-G427 VanDerWaalsContact O-N 3.14Å; A424-M428 WeakPolarHBondContact O-CG 3.38Å; A424-M428 PolarHBondContact O-N 2.93Å |
| 425 | L | 96.9 | Very high | 91.9 | Very high | 18 Ų | 18 | 51.6 Ų | 51.6 | 9% | 0.094 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.9 | -45.6 | 174.5 | -73.3 | 165.1 | 0 | 0 | 0 | 112.2 | K354 L357 L358 K361 L421 T422 E423 G427 M428 D429 | K354-L425 HydrophobicContact CG-CD2 3.89Å; L357-L425 HydrophobicContact CB-CD2 3.8Å; L357-L425 HydrophobicContact CB-CG 4.08Å; L357-L425 HydrophobicContact CD1-CD2 4.15Å; L357-L425 HydrophobicContact CD1-CG 4.27Å; L358-L425 HydrophobicContact CD2-CD1 3.74Å; L358-L425 HydrophobicContact CD2-CD2 4.09Å; L358-L425 HydrophobicContact CG-CD1 4.36Å; L358-L425 HydrophobicContact CG-CD2 3.96Å; K361-L425 HydrophobicContact CD-CD1 4.45Å; L421-L425 WeakPolarHBondContact O-CB 3.44Å; L421-L425 WeakPolarHBondContact O-CD1 3.18Å; L421-L425 VanDerWaalsContact O-CG 3.25Å; L421-L425 WeakPolarHBondContact O-CG 3.43Å; L421-L425 PolarHBondContact O-N 3.34Å; T422-L425 PolarHBondContact O-N 3.3Å; E423-L425 PolarHBondContact O-N 2.99Å; L425-G427 PolarHBondContact O-N 2.96Å; L425-M428 PolarHBondContact O-N 3.47Å; L425-M428 VanDerWaalsContact O-N 3.09Å; L425-D429 PolarHBondContact O-N 3.22Å |
| 426 | K | 95.9 | Very high | 90.2 | Very high | 105 Ų | 105 | 54.6 Ų | 54.6 | 46% | 0.457 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -58 | -33.5 | 173.4 | -71.1 | 170.7 | -176.8 | 173.9 | 0 | 112.7 | T422 E423 K430 | T422-K426 WeakPolarHBondContact O-CG 3.39Å; T422-K426 PolarHBondContact O-N 2.97Å; T422-K426 VanDerWaalsContact O-N 3.09Å; E423-K426 PolarHBondContact O-N 3.16Å; E423-K426 WeakPolarHBondContact OE1-CD 3.41Å; E423-K426 WeakPolarHBondContact OE1-CE 3.42Å; E423-K426 IonicContact OE1-NZ 3.9Å; E423-K426 PolarHBondContact OE1-NZ 3.2Å; K426-K430 WeakPolarHBondContact O-CG 3.49Å |
| 427 | G | 93.2 | Very high | 88.5 | Confident | 18 Ų | 18 | 58.2 Ų | 58.2 | 19% | 0.186 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -69.3 | -44.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | E423 A424 L425 D429 K430 M431 | E423-G427 PolarHBondContact O-N 3.27Å; A424-G427 WeakPolarHBondContact O-CA 3.46Å; A424-G427 PolarHBondContact O-N 3.37Å; A424-G427 VanDerWaalsContact O-N 3.14Å; L425-G427 PolarHBondContact O-N 2.96Å; G427-D429 PolarHBondContact O-N 2.97Å; G427-K430 PolarHBondContact O-N 3.02Å; G427-M431 WeakPolarHBondContact O-CG 3.49Å; G427-M431 PolarHBondContact O-N 2.89Å |
| 428 | M | 90.6 | Very high | 86.5 | Confident | 3 Ų | 3 | 57.9 Ų | 57.9 | 2% | 0.015 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.1 | -41.3 | 178 | -66.3 | -155.7 | 69.5 | 0 | 0 | 112.7 | L350 R353 K354 L357 A424 L425 K430 M431 F432 | L350-M428 HydrophobicContact CB-CE 4.15Å; L350-M428 HydrophobicContact CD2-CE 3.87Å; L350-M428 WeakPolarHBondContact O-CE 3.44Å; R353-M428 HydrophobicContact CB-CE 3.94Å; R353-M428 HydrophobicContact CB-SD 4.38Å; R353-M428 HydrophobicContact CG-CE 4.05Å; R353-M428 HydrophobicContact CG-SD 4.03Å; K354-M428 HydrophobicContact CB-CE 4.07Å; K354-M428 HydrophobicContact CB-SD 3.98Å; L357-M428 HydrophobicContact CD1-CG 4.22Å; L357-M428 HydrophobicContact CD1-SD 3.59Å; L357-M428 VanDerWaalsContact CD1-SD 3.59Å; A424-M428 WeakPolarHBondContact O-CG 3.38Å; A424-M428 PolarHBondContact O-N 2.93Å; L425-M428 PolarHBondContact O-N 3.47Å; L425-M428 VanDerWaalsContact O-N 3.09Å; M428-K430 VanDerWaalsContact C-N 3.27Å; M428-K430 PolarHBondContact O-N 2.95Å; M428-M431 WeakPolarHBondContact O-CA 3.17Å; M428-M431 WeakPolarHBondContact O-CB 3.48Å; M428-M431 PolarHBondContact O-N 3.45Å; M428-F432 HydrophobicContact CE-CE2 4.4Å; M428-F432 WeakPolarHBondContact O-CD2 3.37Å; M428-F432 PolarHBondContact O-N 3.11Å |
| 429 | D | 89.9 | Confident | 84.4 | Confident | 64 Ų | 64 | 62.1 Ų | 62.1 | 34% | 0.342 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -61.1 | -36.5 | 179.6 | -72.3 | -30.9 | 0 | 0 | 0 | 112.2 | K354 L425 G427 M431 F432 L433 | K354-D429 IonicContact NZ-OD1 2.7Å; K354-D429 PolarHBondContact NZ-OD1 3.21Å; K354-D429 IonicContact NZ-OD2 3.42Å; L425-D429 PolarHBondContact O-N 3.22Å; G427-D429 PolarHBondContact O-N 2.97Å; D429-M431 VanDerWaalsContact C-N 3.32Å; D429-M431 PolarHBondContact O-N 2.96Å; D429-F432 PolarHBondContact O-N 3.43Å; D429-L433 VanDerWaalsContact O-CD1 3.28Å; D429-L433 WeakPolarHBondContact O-CD1 3.48Å; D429-L433 PolarHBondContact O-N 3.38Å |
| 430 | K | 88.4 | Confident | 82.2 | Confident | 137 Ų | 137 | 69 Ų | 69 | 60% | 0.596 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -62.9 | -38.1 | 172.4 | -65 | 169.2 | -174.9 | 176.1 | 0 | 112.2 | K426 G427 M428 L433 N434 | K426-K430 WeakPolarHBondContact O-CG 3.49Å; G427-K430 PolarHBondContact O-N 3.02Å; M428-K430 VanDerWaalsContact C-N 3.27Å; M428-K430 PolarHBondContact O-N 2.95Å; K430-L433 PolarHBondContact O-N 3.21Å; K430-N434 WeakPolarHBondContact O-CB 3.11Å; K430-N434 PolarHBondContact O-N 2.89Å |
| 431 | M | 85.9 | Confident | 79.9 | Confident | 46 Ų | 46 | 76.1 Ų | 76.1 | 23% | 0.227 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -69 | -39.6 | 179.1 | -61.9 | 170.5 | 71.8 | 0 | 0 | 111.4 | H344 T345 L350 G427 M428 D429 N434 N435 | H344-M431 VanDerWaalsContact O-CE 3.26Å; H344-M431 WeakPolarHBondContact O-CE 3.48Å; T345-M431 HydrophobicContact CG2-CE 3.98Å; L350-M431 HydrophobicContact CD1-CB 4.38Å; L350-M431 HydrophobicContact CD2-CE 4.14Å; G427-M431 WeakPolarHBondContact O-CG 3.49Å; G427-M431 PolarHBondContact O-N 2.89Å; M428-M431 WeakPolarHBondContact O-CA 3.17Å; M428-M431 WeakPolarHBondContact O-CB 3.48Å; M428-M431 PolarHBondContact O-N 3.45Å; D429-M431 VanDerWaalsContact C-N 3.32Å; D429-M431 PolarHBondContact O-N 2.96Å; M431-N434 PolarHBondContact O-N 3.34Å; M431-N435 PolarHBondContact O-N 3.36Å |
| 432 | F | 82 | Confident | 77.4 | Confident | 65 Ų | 65 | 80.9 Ų | 80.9 | 29% | 0.285 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -60.1 | -47 | 171.4 | -82.3 | -70.6 | 0 | 0 | 0 | 112.4 | L350 H351 K354 M428 D429 N434 N436 | L350-F432 HydrophobicContact CB-CE1 3.88Å; L350-F432 HydrophobicContact CB-CE2 4.03Å; L350-F432 HydrophobicContact CB-CZ 3.51Å; L350-F432 HydrophobicContact CD1-CD1 4.49Å; L350-F432 HydrophobicContact CD1-CE1 4.43Å; H351-F432 HydrophobicContact CB-CZ 4.44Å; K354-F432 HydrophobicContact CB-CE2 4.29Å; K354-F432 HydrophobicContact CD-CE2 3.91Å; M428-F432 HydrophobicContact CE-CE2 4.4Å; M428-F432 WeakPolarHBondContact O-CD2 3.37Å; M428-F432 PolarHBondContact O-N 3.11Å; D429-F432 PolarHBondContact O-N 3.43Å; F432-N434 PolarHBondContact O-N 3.32Å; F432-N436 WeakPolarHBondContact O-CB 3.41Å; F432-N436 PolarHBondContact O-N 3.28Å |
| 433 | L | 80.4 | Confident | 74.9 | Confident | 125 Ų | 125 | 84.4 Ų | 84.4 | 65% | 0.654 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -59.6 | -46.6 | 176.3 | -94 | 69.3 | 0 | 0 | 0 | 111.3 | D429 K430 N436 T437 | D429-L433 VanDerWaalsContact O-CD1 3.28Å; D429-L433 WeakPolarHBondContact O-CD1 3.48Å; D429-L433 PolarHBondContact O-N 3.38Å; K430-L433 PolarHBondContact O-N 3.21Å; L433-N436 PolarHBondContact O-N 2.95Å; L433-T437 PolarHBondContact O-N 3.4Å; L433-T437 PolarHBondContact O-OG1 3.31Å |
| 434 | N | 77.8 | Confident | 72.5 | Confident | 106 Ų | 106 | 85.5 Ų | 85.5 | 57% | 0.567 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -64.7 | -41.4 | -176.3 | -166.7 | 83.1 | 0 | 0 | 0 | 113.2 | K430 M431 F432 N436 T437 A438 | K430-N434 WeakPolarHBondContact O-CB 3.11Å; K430-N434 PolarHBondContact O-N 2.89Å; M431-N434 PolarHBondContact O-N 3.34Å; F432-N434 PolarHBondContact O-N 3.32Å; N434-N436 VanDerWaalsContact C-N 3.34Å; N434-T437 WeakPolarHBondContact CA-OG1 3.26Å; N434-T437 PolarHBondContact O-N 3.17Å; N434-T437 PolarHBondContact O-OG1 3.22Å; N434-A438 PolarHBondContact O-N 3.17Å |
| 435 | N | 68.6 | Low | 69.8 | Low | 62 Ų | 62 | 95.1 Ų | 95.1 | 33% | 0.332 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.8 | -39.6 | 174 | -80.2 | -4 | 0 | 0 | 0 | 111.8 | M431 T437 A438 N439 | M431-N435 PolarHBondContact O-N 3.36Å; N435-T437 VanDerWaalsContact C-N 3.32Å; N435-T437 PolarHBondContact O-N 3.12Å; N435-A438 PolarHBondContact O-N 3.29Å; N435-N439 PolarHBondContact O-N 3.43Å; N435-N439 VanDerWaalsContact O-N 3.09Å |
| 436 | N | 62.4 | Low | 66.8 | Low | 115 Ų | 115 | 97.3 Ų | 97.3 | 62% | 0.615 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -71.4 | -26.6 | -178.5 | -148.4 | 6.7 | 0 | 0 | 0 | 112.5 | F432 L433 N434 | F432-N436 WeakPolarHBondContact O-CB 3.41Å; F432-N436 PolarHBondContact O-N 3.28Å; L433-N436 PolarHBondContact O-N 2.95Å; N434-N436 VanDerWaalsContact C-N 3.34Å |
| 437 | T | 61.1 | Low | 64.5 | Low | 82 Ų | 82 | 99 Ų | 99 | 50% | 0.503 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -76.2 | -39 | 168.8 | 43.3 | 0 | 0 | 0 | 0 | 113.1 | L433 N434 N435 N439 R440 | L433-T437 PolarHBondContact O-N 3.4Å; L433-T437 PolarHBondContact O-OG1 3.31Å; N434-T437 WeakPolarHBondContact CA-OG1 3.26Å; N434-T437 PolarHBondContact O-N 3.17Å; N434-T437 PolarHBondContact O-OG1 3.22Å; N435-T437 VanDerWaalsContact C-N 3.32Å; N435-T437 PolarHBondContact O-N 3.12Å; T437-N439 VanDerWaalsContact C-N 3.33Å; T437-N439 PolarHBondContact O-N 3.15Å; T437-R440 PolarHBondContact O-N 3.47Å |
| 438 | A | 57.8 | Low | 61.8 | Low | 60 Ų | 60 | 101.8 Ų | 101.8 | 50% | 0.496 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -61 | -42.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | N434 N435 R440 H441 | N434-A438 PolarHBondContact O-N 3.17Å; N435-A438 PolarHBondContact O-N 3.29Å; A438-R440 PolarHBondContact O-N 3.19Å; A438-R440 VanDerWaalsContact O-N 3.11Å; A438-H441 PolarHBondContact O-N 3.23Å |
| 439 | N | 53.1 | Low | 59.5 | Low | 119 Ų | 119 | 107.1 Ų | 107.1 | 64% | 0.636 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.5 | 1.5 | -179.1 | -150.9 | 38.2 | 0 | 0 | 0 | 114.5 | N435 T437 | N435-N439 PolarHBondContact O-N 3.43Å; N435-N439 VanDerWaalsContact O-N 3.09Å; T437-N439 VanDerWaalsContact C-N 3.33Å; T437-N439 PolarHBondContact O-N 3.15Å |
| 440 | R | 51.8 | Low | 57 | Low | 207 Ų | 207 | 113.7 Ų | 113.7 | 78% | 0.781 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.7 | -15.8 | 174.4 | -86.1 | -176.7 | 159.5 | -163.8 | -6.4 | 114.4 | T437 A438 | T437-R440 PolarHBondContact O-N 3.47Å; A438-R440 PolarHBondContact O-N 3.19Å; A438-R440 VanDerWaalsContact O-N 3.11Å |
| 441 | H | 50.2 | Low | 54.5 | Low | 177 Ų | 177 | 113.9 Ų | 113.9 | 82% | 0.819 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -89.5 | -2.4 | -179.2 | -86.3 | -82.2 | 0 | 0 | 0 | 114.6 | A438 | A438-H441 PolarHBondContact O-N 3.23Š|
| 442 | T | 46.8 | Very low | 52 | Low | 104 Ų | 104 | 115.1 Ų | 115.1 | 64% | 0.638 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -99.5 | -4.8 | -175.9 | 51.7 | 0 | 0 | 0 | 0 | 114.5 | ||
| 443 | S | 45 | Very low | 50.1 | Low | 110 Ų | 110 | 119.6 Ų | 119.6 | 77% | 0.769 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -110 | 62.3 | -176.8 | -63.9 | 0 | 0 | 0 | 0 | 111.4 | ||
| 444 | G | 47.1 | Very low | 48.3 | Very low | 73 Ų | 73 | 123.8 Ų | 123.8 | 75% | 0.753 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -159.3 | -9 | -171.1 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||
| 445 | E | 41.2 | Very low | 46.6 | Very low | 202 Ų | 202 | 127.3 Ų | 127.3 | 94% | 0.944 | 74% | 0.74 | S | S | * | * | trans | -140.7 | 105.8 | -177.1 | -113.2 | 167.3 | -166.3 | 0 | 0 | 112.8 | ||||
| 446 | G | 34.5 | Very low | 45.3 | Very low | 63 Ų | 63 | 131.1 Ų | 131.1 | 65% | 0.649 | 76% | 0.756 | S | S | * | * | trans | -107.3 | 150.2 | 164.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | G448 | G446-G448 PolarHBondContact O-N 3.43Š| ||
| 447 | P | 47.4 | Very low | 44.3 | Very low | 142 Ų | 142 | 133.3 Ų | 133.3 | 92% | 0.922 | 76% | 0.76 | S | S | * | * | trans | -74.1 | 86.8 | -166 | 29.2 | -36.2 | 0 | 0 | 0 | 113.7 | S449 | P447-S449 PolarHBondContact O-N 3.43Š| ||
| 448 | G | 36.5 | Very low | 43.6 | Very low | 76 Ų | 76 | 137.8 Ų | 137.8 | 78% | 0.784 | 78% | 0.775 | S | S | * | * | trans | -83.4 | 80.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | G446 K450 | G446-G448 PolarHBondContact O-N 3.43Å; G448-K450 PolarHBondContact O-N 3.2Å | ||
| 449 | S | 41.2 | Very low | 43 | Very low | 114 Ų | 114 | 146.1 Ų | 146.1 | 80% | 0.797 | 79% | 0.793 | S | S | * | * | trans | -63.9 | 121.7 | 171.8 | 179.3 | 0 | 0 | 0 | 0 | 111.8 | P447 | P447-S449 PolarHBondContact O-N 3.43Š| ||
| 450 | K | 37.8 | Very low | 42.6 | Very low | 203 Ų | 203 | 153 Ų | 153 | 88% | 0.883 | 82% | 0.818 | S | S | * | * | trans | -161.4 | 109.1 | 156 | -115.1 | 163.6 | -171.9 | 174.5 | 0 | 113 | G448 | G448-K450 PolarHBondContact O-N 3.2Š| ||
| 451 | T | 35.4 | Very low | 42.2 | Very low | 141 Ų | 141 | 150.3 Ų | 150.3 | 87% | 0.865 | 82% | 0.819 | S | S | * | * | trans | -72.7 | 160.6 | 153.1 | 44.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 452 | G | 34.4 | Very low | 41.7 | Very low | 72 Ų | 72 | 148.8 Ų | 148.8 | 74% | 0.742 | 82% | 0.819 | S | S | * | * | trans | 148.6 | 120.6 | 169.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 453 | D | 42.4 | Very low | 41.4 | Very low | 159 Ų | 159 | 151.3 Ų | 151.3 | 85% | 0.85 | 83% | 0.829 | S | S | * | * | trans | -64.8 | 160.2 | -174.3 | -51.9 | -85.8 | 0 | 0 | 0 | 115.2 | ||||
| 454 | K | 41.7 | Very low | 41.2 | Very low | 213 Ų | 213 | 153.8 Ų | 153.8 | 93% | 0.926 | 83% | 0.833 | S | S | * | * | trans | -153.2 | 113.3 | 145.3 | -116 | 169.7 | -171.4 | 178.5 | 0 | 111.8 | ||||
| 455 | E | 42.3 | Very low | 40.9 | Very low | 179 Ų | 179 | 158.8 Ų | 158.8 | 84% | 0.836 | 84% | 0.838 | S | S | * | * | trans | -100.1 | 157.9 | 175.5 | -164.9 | 179 | -164.9 | 0 | 0 | 110.5 | ||||
| 456 | E | 40.5 | Very low | 40.9 | Very low | 143 Ų | 143 | 155.9 Ų | 155.9 | 67% | 0.668 | 83% | 0.831 | S | S | * | * | trans | 63.7 | 158.6 | 175.5 | -71.6 | -151.1 | 113 | 0 | 0 | 117.2 | ||||
| 457 | K | 42.3 | Very low | 41.3 | Very low | 161 Ų | 161 | 162.6 Ų | 162.6 | 70% | 0.7 | 84% | 0.844 | S | S | * | * | cis | -148.8 | 152.6 | 13.5 | -147 | 159.7 | -178.8 | 76.7 | 0 | 113.8 | ||||
| 458 | H | 45.9 | Very low | 40.8 | Very low | 175 Ų | 175 | 164.2 Ų | 164.2 | 81% | 0.81 | 84% | 0.838 | S | S | * | * | trans | -29.7 | 133 | 170.1 | -87.1 | -151.3 | 0 | 0 | 0 | 119.3 | ||||
| 459 | R | 44.9 | Very low | 41.2 | Very low | 235 Ų | 235 | 171.5 Ų | 171.5 | 89% | 0.887 | 84% | 0.842 | S | S | * | * | 169.7 | 157 | 113.7 | -98.9 | 175.8 | 166.9 | 158.8 | -2.9 | 110.3 | |||||
| 460 | K | 45.7 | Very low | 41.2 | Very low | 263 Ų | 263 | 176.7 Ų | 176.7 | 100% | 1.143 | 85% | 0.846 | S | S | * | * | cis | -142.2 | 0 | 13.5 | -163.5 | -176.5 | -179.6 | -173.8 | 0 | 111.4 |
Retrieved 460 of 460 residues in 125.1 ms
(Link to these results)