| 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 | 33.8 | Very low | 37 | Very low | 244 Ų | 244 | 132.5 Ų | 132.5 | 100% | 1.202 | 80% | 0.802 | S | S | * | * | 0 | 103.9 | 0 | -64.1 | 173.3 | 179.5 | 0 | 0 | 105.4 | |||||
| 2 | A | 35.1 | Very low | 36.6 | Very low | 82 Ų | 82 | 129.8 Ų | 129.8 | 68% | 0.678 | 79% | 0.793 | S | S | * | * | 107.9 | 103.4 | 82.2 | 0 | 0 | 0 | 0 | 0 | 106.5 | |||||
| 3 | L | 41.6 | Very low | 36.7 | Very low | 142 Ų | 142 | 129.3 Ų | 129.3 | 74% | 0.743 | 79% | 0.794 | S | S | * | * | 64.1 | 136.9 | 69.9 | -58.9 | 168.3 | 0 | 0 | 0 | 111.2 | |||||
| 4 | F | 40.3 | Very low | 36.9 | Very low | 156 Ų | 156 | 130.6 Ų | 130.6 | 68% | 0.684 | 79% | 0.791 | S | S | * | * | cis | -127.3 | -168.8 | -2.8 | -60.4 | -90.5 | 0 | 0 | 0 | 108.3 | ||||
| 5 | F | 46.1 | Very low | 36.8 | Very low | 179 Ų | 179 | 135.8 Ų | 135.8 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | cis | -138.5 | 145.2 | 7.6 | -84.2 | -70.3 | 0 | 0 | 0 | 108.1 | ||||
| 6 | S | 34.6 | Very low | 36.5 | Very low | 114 Ų | 114 | 140.4 Ų | 140.4 | 80% | 0.797 | 80% | 0.798 | S | S | * | * | 58.9 | 124.1 | 81.9 | -53.8 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 7 | G | 33.5 | Very low | 36.8 | Very low | 82 Ų | 82 | 147.2 Ų | 147.2 | 85% | 0.845 | 81% | 0.808 | S | S | * | * | trans | -133.6 | -175.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 8 | A | 33.2 | Very low | 36.6 | Very low | 92 Ų | 92 | 147.7 Ų | 147.7 | 76% | 0.76 | 81% | 0.808 | S | S | * | * | trans | -147.7 | 121 | 167.1 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 9 | V | 35.8 | Very low | 36.8 | Very low | 127 Ų | 127 | 152.8 Ų | 152.8 | 77% | 0.77 | 81% | 0.814 | S | S | * | * | 51.3 | 94.5 | 69.6 | -171.5 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 10 | T | 37.8 | Very low | 36.5 | Very low | 144 Ų | 144 | 148.4 Ų | 148.4 | 88% | 0.883 | 81% | 0.807 | S | S | * | * | trans | -129.3 | 81 | 151.5 | 52.9 | 0 | 0 | 0 | 0 | 109.3 | S12 | T10-S12 PolarHBondContact O-N 3.04Š| ||
| 11 | S | 34.9 | Very low | 36.8 | Very low | 96 Ų | 96 | 148.2 Ų | 148.2 | 67% | 0.671 | 81% | 0.805 | S | S | * | * | trans | -82.5 | 99.5 | 179.8 | 54.1 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 12 | S | 32.4 | Very low | 36.8 | Very low | 100 Ų | 100 | 145.9 Ų | 145.9 | 70% | 0.699 | 79% | 0.791 | S | S | * | * | trans | 66.2 | 165.5 | 150.9 | -39.9 | 0 | 0 | 0 | 0 | 116.9 | T10 | T10-S12 PolarHBondContact O-N 3.04Š| ||
| 13 | P | 38.7 | Very low | 37.3 | Very low | 123 Ų | 123 | 147.1 Ų | 147.1 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | -132.4 | 138.9 | 71.5 | 33.6 | -18.4 | 0 | 0 | 0 | 115.3 | K15 | P13-K15 PolarHBondContact O-N 3.39Š| |||
| 14 | I | 39.2 | Very low | 36.8 | Very low | 147 Ų | 147 | 146.5 Ų | 146.5 | 75% | 0.754 | 80% | 0.801 | S | S | * | * | trans | -55.3 | 115.4 | 153.1 | -69 | 158.6 | 0 | 0 | 0 | 108.1 | R16 | I14-R16 VanDerWaalsContact C-N 3.32Å; I14-R16 PolarHBondContact O-N 2.81Å | ||
| 15 | K | 34.9 | Very low | 36.6 | Very low | 209 Ų | 209 | 148.3 Ų | 148.3 | 91% | 0.909 | 81% | 0.812 | S | S | * | * | trans | -77.9 | 85.3 | 174.4 | -153.4 | 170.2 | -172.1 | 175.9 | 0 | 109.7 | P13 | P13-K15 PolarHBondContact O-N 3.39Š| ||
| 16 | R | 32.6 | Very low | 35.7 | Very low | 210 Ų | 210 | 144.2 Ų | 144.2 | 79% | 0.792 | 81% | 0.805 | S | S | * | * | trans | -50.3 | 140.2 | 166.5 | -83.4 | -178.4 | 164.3 | 115.1 | -5.1 | 109.4 | I14 L18 | I14-R16 VanDerWaalsContact C-N 3.32Å; I14-R16 PolarHBondContact O-N 2.81Å; R16-L18 PolarHBondContact O-N 3.06Å; R16-L18 VanDerWaalsContact O-N 3.11Å | ||
| 17 | R | 41.9 | Very low | 36.1 | Very low | 256 Ų | 256 | 145 Ų | 145 | 97% | 0.966 | 81% | 0.808 | S | S | * | * | trans | -62 | 113.2 | 162.1 | -64.8 | -178.7 | -166.9 | -105.3 | 2.4 | 107.4 | ||||
| 18 | L | 33.3 | Very low | 36.6 | Very low | 155 Ų | 155 | 147.6 Ų | 147.6 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | trans | -131.9 | 117.7 | 167.9 | -135.4 | 154.3 | 0 | 0 | 0 | 107.8 | R16 G20 | R16-L18 PolarHBondContact O-N 3.06Å; R16-L18 VanDerWaalsContact O-N 3.11Å; L18-G20 PolarHBondContact O-N 2.85Å | ||
| 19 | R | 39.6 | Very low | 37.3 | Very low | 245 Ų | 245 | 149.6 Ų | 149.6 | 93% | 0.925 | 81% | 0.805 | S | S | * | * | trans | -77.9 | 108.4 | -175.2 | -172.5 | -173.9 | -165 | -165.1 | 5.8 | 107.8 | ||||
| 20 | G | 31.9 | Very low | 37.6 | Very low | 65 Ų | 65 | 148 Ų | 148 | 67% | 0.67 | 80% | 0.799 | S | S | * | * | trans | -147.6 | 110.1 | 175 | 0 | 0 | 0 | 0 | 0 | 108.8 | L18 | L18-G20 PolarHBondContact O-N 2.85Š| ||
| 21 | N | 41.3 | Very low | 37.9 | Very low | 144 Ų | 144 | 148.2 Ų | 148.2 | 77% | 0.77 | 79% | 0.794 | S | S | * | * | trans | -65.5 | 136.6 | 170.6 | -62.8 | -17.8 | 0 | 0 | 0 | 108.2 | ||||
| 22 | H | 34.9 | Very low | 38.3 | Very low | 195 Ų | 195 | 151.9 Ų | 151.9 | 90% | 0.903 | 81% | 0.805 | S | S | * | * | -174.2 | 146.2 | 129.6 | -87.5 | -56.5 | 0 | 0 | 0 | 108.5 | |||||
| 23 | S | 45.1 | Very low | 38.7 | Very low | 109 Ų | 109 | 150.4 Ų | 150.4 | 76% | 0.762 | 79% | 0.794 | S | S | * | * | trans | -81.6 | 126.9 | -168.2 | 51.2 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 24 | C | 31.8 | Very low | 39.2 | Very low | 129 Ų | 129 | 150.4 Ų | 150.4 | 87% | 0.872 | 79% | 0.794 | S | S | * | * | trans | -155.1 | 119.2 | 151 | -90.2 | 0 | 0 | 0 | 0 | 107.9 | S26 | C24-S26 PolarHBondContact O-N 2.72Š| ||
| 25 | H | 34.9 | Very low | 39.4 | Very low | 194 Ų | 194 | 150.5 Ų | 150.5 | 90% | 0.898 | 80% | 0.797 | S | S | * | * | trans | -78 | 116.9 | 173.5 | -81.3 | -90.4 | 0 | 0 | 0 | 109.6 | ||||
| 26 | S | 28.7 | Very low | 39.9 | Very low | 93 Ų | 93 | 144 Ų | 144 | 65% | 0.65 | 78% | 0.778 | S | S | * | * | trans | -83.1 | 126.5 | 168 | 178.4 | 0 | 0 | 0 | 0 | 108.6 | C24 D28 | C24-S26 PolarHBondContact O-N 2.72Å; S26-D28 PolarHBondContact O-N 3.34Å | ||
| 27 | P | 41 | Very low | 40.5 | Very low | 131 Ų | 131 | 139.3 Ų | 139.3 | 85% | 0.851 | 78% | 0.777 | S | S | * | * | trans | -85.2 | 55.6 | -178.5 | 36.8 | -36.3 | 0 | 0 | 0 | 110.7 | ||||
| 28 | D | 44.8 | Very low | 40.7 | Very low | 135 Ų | 135 | 135.1 Ų | 135.1 | 72% | 0.722 | 76% | 0.762 | S | S | * | * | trans | -131.8 | 144.4 | 176.6 | -112.2 | -38.6 | 0 | 0 | 0 | 110.1 | S26 | S26-D28 PolarHBondContact O-N 3.34Š| ||
| 29 | V | 48.5 | Very low | 41.4 | Very low | 135 Ų | 135 | 131.2 Ų | 131.2 | 82% | 0.818 | 75% | 0.745 | S | S | * | * | S | Bend | trans | 70.3 | 87.7 | -174.3 | -165.5 | 0 | 0 | 0 | 0 | 115.1 | ||
| 30 | S | 41.4 | Very low | 41.4 | Very low | 92 Ų | 92 | 121.5 Ų | 121.5 | 64% | 0.643 | 71% | 0.714 | S | S | * | * | trans | 170.9 | -3.5 | 134.7 | -77.7 | 0 | 0 | 0 | 0 | 115.7 | L32 S33 | S30-L32 PolarHBondContact O-N 3.43Å; S30-S33 PolarHBondContact O-N 3.49Å | ||
| 31 | L | 44.5 | Very low | 42 | Very low | 149 Ų | 149 | 128 Ų | 128 | 78% | 0.78 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | 7 | -170.4 | -60.2 | 179.9 | 0 | 0 | 0 | 117.2 | ||
| 32 | L | 42.7 | Very low | 42.1 | Very low | 174 Ų | 174 | 123.5 Ų | 123.5 | 91% | 0.911 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.6 | 15.3 | -179.2 | -64.2 | 178.4 | 0 | 0 | 0 | 113.6 | S30 | S30-L32 PolarHBondContact O-N 3.43Š|
| 33 | S | 41.1 | Very low | 42.9 | Very low | 68 Ų | 68 | 118.9 Ų | 118.9 | 48% | 0.476 | 69% | 0.688 | S | S | . | * | trans | -81.3 | 123 | 173.7 | -152.9 | 0 | 0 | 0 | 0 | 110.1 | S30 D35 S36 | S30-S33 PolarHBondContact O-N 3.49Å; S33-D35 PolarHBondContact O-N 3.06Å; S33-D35 VanDerWaalsContact O-N 3.09Å; S33-S36 PolarHBondContact O-N 3.41Å; S33-S36 PolarHBondContact O-OG 3.46Å | ||
| 34 | P | 48.2 | Very low | 43.2 | Very low | 123 Ų | 123 | 119.2 Ų | 119.2 | 80% | 0.799 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.2 | -15 | -172.1 | 26.4 | -35 | 0 | 0 | 0 | 114.4 | ||
| 35 | D | 44.7 | Very low | 44.1 | Very low | 150 Ų | 150 | 121.2 Ų | 121.2 | 80% | 0.802 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.1 | -1 | -176.7 | -58.8 | -40.7 | 0 | 0 | 0 | 113.8 | S33 S37 | S33-D35 PolarHBondContact O-N 3.06Å; S33-D35 VanDerWaalsContact O-N 3.09Å; D35-S37 PolarHBondContact O-N 3.32Å |
| 36 | S | 45.8 | Very low | 44.6 | Very low | 73 Ų | 73 | 114.9 Ų | 114.9 | 51% | 0.51 | 68% | 0.681 | S | S | . | * | trans | -80.4 | 106 | 176.6 | 65.8 | 0 | 0 | 0 | 0 | 111.2 | S33 Y38 | S33-S36 PolarHBondContact O-N 3.41Å; S33-S36 PolarHBondContact O-OG 3.46Å; S36-Y38 PolarHBondContact O-N 3.1Å | ||
| 37 | S | 44.8 | Very low | 45.5 | Very low | 111 Ų | 111 | 114.2 Ų | 114.2 | 78% | 0.776 | 69% | 0.689 | S | S | * | * | trans | -67.2 | 98.4 | 170.7 | 57.2 | 0 | 0 | 0 | 0 | 110.6 | D35 V39 | D35-S37 PolarHBondContact O-N 3.32Å; S37-V39 PolarHBondContact O-N 2.93Å | ||
| 38 | Y | 46 | Very low | 46 | Very low | 167 Ų | 167 | 111.9 Ų | 111.9 | 66% | 0.655 | 68% | 0.68 | S | S | * | * | trans | -70.3 | 122.6 | 175.4 | -166.6 | -91.5 | 0 | 0 | 0 | 110.3 | S36 C40 | S36-Y38 PolarHBondContact O-N 3.1Å; Y38-C40 PolarHBondContact O-N 3.27Å | ||
| 39 | V | 46.8 | Very low | 46.2 | Very low | 73 Ų | 73 | 109.5 Ų | 109.5 | 44% | 0.442 | 67% | 0.672 | S | S | . | * | trans | -87.8 | 103.2 | 174.7 | 179.3 | 0 | 0 | 0 | 0 | 108 | S37 Y41 P49 | S37-V39 PolarHBondContact O-N 2.93Å; V39-Y41 HydrophobicContact CG1-CD2 4.49Å; V39-Y41 HydrophobicContact CG1-CE2 4.11Å; V39-Y41 PolarHBondContact O-N 2.85Å; V39-P49 HydrophobicContact CG1-CB 3.81Å | ||
| 40 | C | 41.2 | Very low | 46.1 | Very low | 41 Ų | 41 | 106.4 Ų | 106.4 | 28% | 0.277 | 66% | 0.655 | S | S | . | * | B | Isolated β-bridge | trans | -72.2 | 118.5 | 167.5 | -64.7 | 0 | 0 | 0 | 0 | 108.8 | Y38 | Y38-C40 PolarHBondContact O-N 3.27Å |
| 41 | Y | 43.3 | Very low | 46.3 | Very low | 201 Ų | 201 | 108.1 Ų | 108.1 | 79% | 0.788 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -82.6 | 123.5 | 162.6 | -68 | -87.1 | 0 | 0 | 0 | 108 | V39 | V39-Y41 HydrophobicContact CG1-CD2 4.49Å; V39-Y41 HydrophobicContact CG1-CE2 4.11Å; V39-Y41 PolarHBondContact O-N 2.85Å |
| 42 | P | 43.7 | Very low | 46.2 | Very low | 50 Ų | 50 | 104.3 Ų | 104.3 | 33% | 0.325 | 65% | 0.651 | S | S | . | * | P | Polyproline II helix | trans | -59.2 | 156.9 | 160.3 | -15.5 | 29.9 | 0 | 0 | 0 | 109.5 | A46 | P42-A46 HydrophobicContact CB-CB 4.1Š|
| 43 | S | 51.9 | Low | 46.1 | Very low | 99 Ų | 99 | 108 Ų | 108 | 69% | 0.692 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 156.8 | 169.1 | 38.1 | 0 | 0 | 0 | 0 | 111.1 | D45 A46 | S43-D45 PolarHBondContact O-N 2.81Å; S43-A46 PolarHBondContact O-N 3.28Å |
| 44 | A | 51.8 | Low | 46.4 | Very low | 115 Ų | 115 | 114.2 Ų | 114.2 | 95% | 0.95 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.1 | 2.8 | -153.1 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||
| 45 | D | 49.5 | Very low | 45.9 | Very low | 171 Ų | 171 | 112.1 Ų | 112.1 | 91% | 0.914 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.4 | 5.7 | -172.9 | -139.9 | 14.5 | 0 | 0 | 0 | 113.9 | S43 | S43-D45 PolarHBondContact O-N 2.81Š|
| 46 | A | 46.1 | Very low | 45.8 | Very low | 62 Ų | 62 | 111.3 Ų | 111.3 | 51% | 0.512 | 66% | 0.657 | S | S | . | * | S | Bend | trans | -123.9 | 112 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | P42 S43 | P42-A46 HydrophobicContact CB-CB 4.1Å; S43-A46 PolarHBondContact O-N 3.28Å |
| 47 | G | 48 | Very low | 46.2 | Very low | 79 Ų | 79 | 118.8 Ų | 118.8 | 81% | 0.814 | 67% | 0.674 | S | S | * | * | trans | -73.2 | 153.6 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 48 | A | 51.1 | Low | 46.3 | Very low | 81 Ų | 81 | 118.2 Ų | 118.2 | 67% | 0.669 | 66% | 0.662 | S | S | * | * | S | Bend | trans | 77 | 125.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||
| 49 | P | 49.5 | Very low | 46.6 | Very low | 85 Ų | 85 | 115.2 Ų | 115.2 | 55% | 0.552 | 66% | 0.656 | S | S | * | * | trans | -74.3 | 127.2 | 178 | 29.6 | -33.3 | 0 | 0 | 0 | 111.6 | V39 | V39-P49 HydrophobicContact CG1-CB 3.81Š| ||
| 50 | C | 46.7 | Very low | 46.5 | Very low | 70 Ų | 70 | 117.8 Ų | 117.8 | 47% | 0.473 | 67% | 0.673 | S | S | . | * | B | Isolated β-bridge | trans | -95.6 | 131.5 | 179 | 36.4 | 0 | 0 | 0 | 0 | 112 | C52 | C50-C52 VanDerWaalsContact C-N 3.34Å; C50-C52 PolarHBondContact O-N 3.38Å |
| 51 | C | 44.3 | Very low | 46.7 | Very low | 128 Ų | 128 | 121.5 Ų | 121.5 | 87% | 0.865 | 69% | 0.69 | S | S | * | * | trans | -77.4 | 76.9 | -177.1 | -56.4 | 0 | 0 | 0 | 0 | 112.1 | R53 | C51-R53 PolarHBondContact O-N 3.23Š| ||
| 52 | C | 42.6 | Very low | 47.2 | Very low | 69 Ų | 69 | 112.8 Ų | 112.8 | 47% | 0.466 | 66% | 0.661 | S | S | . | * | trans | -69.4 | 95.5 | -176.9 | -63.2 | 0 | 0 | 0 | 0 | 113.3 | C50 R54 | C50-C52 VanDerWaalsContact C-N 3.34Å; C50-C52 PolarHBondContact O-N 3.38Å; C52-R54 PolarHBondContact O-N 2.9Å | ||
| 53 | R | 40.4 | Very low | 47.7 | Very low | 251 Ų | 251 | 118.1 Ų | 118.1 | 95% | 0.947 | 68% | 0.676 | S | S | * | * | trans | -70.7 | 86 | 164.9 | -79.6 | -173 | 166.2 | -164 | -3.4 | 111.2 | C51 S55 | C51-R53 PolarHBondContact O-N 3.23Å; R53-S55 PolarHBondContact O-N 3.49Å | ||
| 54 | R | 46.9 | Very low | 47.8 | Very low | 200 Ų | 200 | 119.7 Ų | 119.7 | 76% | 0.755 | 67% | 0.668 | S | S | * | * | trans | -70.3 | 124.1 | 165.9 | -78.1 | -170.3 | 172.7 | -167.9 | -1.2 | 110 | C52 | C52-R54 PolarHBondContact O-N 2.9Š| ||
| 55 | S | 37.9 | Very low | 47.8 | Very low | 78 Ų | 78 | 118.4 Ų | 118.4 | 55% | 0.545 | 65% | 0.645 | S | S | . | * | trans | -72.5 | 128.8 | 168.1 | 53.3 | 0 | 0 | 0 | 0 | 109.1 | R53 R57 | R53-S55 PolarHBondContact O-N 3.49Å; S55-R57 PolarHBondContact O-N 3.32Å | ||
| 56 | P | 44.3 | Very low | 48.2 | Very low | 134 Ų | 134 | 113.6 Ų | 113.6 | 87% | 0.87 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.3 | 19.2 | -169.6 | -23.5 | 34.8 | 0 | 0 | 0 | 117.4 | ||
| 57 | R | 52.9 | Low | 48.8 | Very low | 229 Ų | 229 | 113.7 Ų | 113.7 | 86% | 0.864 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135.5 | 9.1 | -161.8 | -78.2 | -171.2 | 171.7 | 146.5 | 0.7 | 117.1 | S55 | S55-R57 PolarHBondContact O-N 3.32Š|
| 58 | L | 47.1 | Very low | 49.4 | Very low | 100 Ų | 100 | 118.5 Ų | 118.5 | 52% | 0.524 | 62% | 0.617 | S | S | . | * | trans | -134.8 | 44.7 | -172.2 | -69.8 | 173 | 0 | 0 | 0 | 114.4 | Y90 | L58-Y90 HydrophobicContact CD2-CE2 4.29Š| ||
| 59 | L | 51.4 | Low | 49.8 | Very low | 103 Ų | 103 | 119.4 Ų | 119.4 | 54% | 0.539 | 61% | 0.611 | S | S | . | * | S | Bend | trans | -119.3 | -1.5 | 173.3 | -73.1 | 173.6 | 0 | 0 | 0 | 114.9 | ||
| 60 | T | 45.9 | Very low | 50.3 | Low | 127 Ų | 127 | 115.6 Ų | 115.6 | 78% | 0.779 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -88.8 | -13.3 | 179.5 | 57.4 | 0 | 0 | 0 | 0 | 114.4 | ||
| 61 | N | 45.9 | Very low | 51.1 | Low | 119 Ų | 119 | 117.2 Ų | 117.2 | 64% | 0.636 | 59% | 0.585 | S | S | * | * | S | Bend | trans | -127.7 | 13 | -170.3 | -59.4 | 7.9 | 0 | 0 | 0 | 113.2 | ||
| 62 | G | 53.8 | Low | 51.9 | Low | 19 Ų | 19 | 113.1 Ų | 113.1 | 20% | 0.196 | 56% | 0.558 | C | S | . | * | trans | -76.4 | 133 | 173 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 63 | Y | 52.5 | Low | 53.3 | Low | 162 Ų | 162 | 115.7 Ų | 115.7 | 64% | 0.635 | 57% | 0.566 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -82.5 | 135.2 | 164.2 | -68.8 | -90.3 | 0 | 0 | 0 | 107.6 | S89 | Y63-S89 PolarHBondContact O-N 2.84Å |
| 64 | Y | 55.1 | Low | 54.8 | Low | 132 Ų | 132 | 107.2 Ų | 107.2 | 52% | 0.518 | 54% | 0.539 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.7 | 111.9 | 173.8 | -62.6 | -89.1 | 0 | 0 | 0 | 107.1 | V66 V88 | Y64-V66 PolarHBondContact O-N 3.22Å; Y64-V66 VanDerWaalsContact O-N 3.14Å; Y64-V88 HydrophobicContact CD1-CG2 3.98Å; Y64-V88 HydrophobicContact CE1-CG2 3.8Å |
| 65 | D | 52.3 | Low | 56.1 | Low | 88 Ų | 88 | 107.2 Ų | 107.2 | 47% | 0.471 | 55% | 0.548 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.1 | 94.3 | 169.4 | -67.8 | -51.7 | 0 | 0 | 0 | 107.2 | S89 | D65-S89 WeakPolarHBondContact OD2-CB 3.21Å; D65-S89 PolarHBondContact OD2-OG 2.81Å |
| 66 | V | 57.2 | Low | 57.9 | Low | 70 Ų | 70 | 110.4 Ų | 110.4 | 42% | 0.424 | 56% | 0.559 | S | S | . | * | trans | -90.2 | 106.1 | -179.6 | -166.4 | 0 | 0 | 0 | 0 | 108.4 | Y64 F71 L81 | Y64-V66 PolarHBondContact O-N 3.22Å; Y64-V66 VanDerWaalsContact O-N 3.14Å; V66-F71 HydrophobicContact CB-CZ 4.44Å; V66-F71 HydrophobicContact CG1-CD2 4.26Å; V66-F71 HydrophobicContact CG1-CE1 4.13Å; V66-F71 HydrophobicContact CG1-CE2 3.49Å; V66-F71 VanDerWaalsContact CG1-CE2 3.49Å; V66-F71 HydrophobicContact CG1-CZ 3.43Å; V66-F71 VanDerWaalsContact CG1-CZ 3.43Å; V66-L81 HydrophobicContact CG1-CD2 4.23Å | ||
| 67 | T | 58.8 | Low | 59.3 | Low | 63 Ų | 63 | 106.4 Ų | 106.4 | 39% | 0.387 | 54% | 0.542 | S | S | . | . | trans | -81.2 | 161 | 172.6 | 64.8 | 0 | 0 | 0 | 0 | 110.6 | D69 S70 | T67-D69 WeakPolarHBondContact CB-OD1 3.47Å; T67-D69 PolarHBondContact O-N 3.11Å; T67-D69 VanDerWaalsContact OG1-CG 3.27Å; T67-D69 PolarHBondContact OG1-OD1 3.01Å; T67-D69 PolarHBondContact OG1-OD2 3.43Å; T67-S70 PolarHBondContact N-OG 3.14Å; T67-S70 WeakPolarHBondContact O-CB 3.49Å; T67-S70 PolarHBondContact O-N 3.01Å; T67-S70 PolarHBondContact O-OG 3.31Å; T67-S70 PolarHBondContact OG1-OG 2.94Å | ||
| 68 | E | 60.8 | Low | 60.2 | Low | 181 Ų | 181 | 100 Ų | 100 | 85% | 0.846 | 53% | 0.525 | S | S | * | . | G | 310 helix | trans | -59.6 | -33.4 | -178.2 | -61.5 | -177.8 | 169.8 | 0 | 0 | 112.1 | S70 F71 | E68-S70 PolarHBondContact O-N 3.25Å; E68-F71 PolarHBondContact O-N 3.29Å |
| 69 | D | 58.8 | Low | 61.3 | Low | 100 Ų | 100 | 99.9 Ų | 99.9 | 54% | 0.535 | 53% | 0.528 | S | S | . | . | G | 310 helix | trans | -72.5 | 3.2 | 172.9 | 48.7 | -53.2 | 0 | 0 | 0 | 115 | T67 R85 | T67-D69 WeakPolarHBondContact CB-OD1 3.47Å; T67-D69 PolarHBondContact O-N 3.11Å; T67-D69 VanDerWaalsContact OG1-CG 3.27Å; T67-D69 PolarHBondContact OG1-OD1 3.01Å; T67-D69 PolarHBondContact OG1-OD2 3.43Å; D69-R85 IonicContact OD2-NH1 3.02Å; D69-R85 PolarHBondContact OD2-NH1 3.4Å |
| 70 | S | 60.6 | Low | 62.1 | Low | 4 Ų | 4 | 96.8 Ų | 96.8 | 3% | 0.028 | 52% | 0.515 | C | S | . | . | G | 310 helix | trans | -88.7 | -11.1 | 171.3 | -55.4 | 0 | 0 | 0 | 0 | 113.8 | T67 E68 T82 | T67-S70 PolarHBondContact N-OG 3.14Å; T67-S70 WeakPolarHBondContact O-CB 3.49Å; T67-S70 PolarHBondContact O-N 3.01Å; T67-S70 PolarHBondContact O-OG 3.31Å; T67-S70 PolarHBondContact OG1-OG 2.94Å; E68-S70 PolarHBondContact O-N 3.25Å; S70-T82 PolarHBondContact O-N 3.09Å; S70-T82 PolarHBondContact O-OG1 3Å |
| 71 | F | 63.2 | Low | 63 | Low | 105 Ų | 105 | 95.6 Ų | 95.6 | 46% | 0.461 | 50% | 0.503 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.9 | 122.6 | -179.6 | -60.9 | -77 | 0 | 0 | 0 | 110.3 | V66 E68 V79 L81 | V66-F71 HydrophobicContact CB-CZ 4.44Å; V66-F71 HydrophobicContact CG1-CD2 4.26Å; V66-F71 HydrophobicContact CG1-CE1 4.13Å; V66-F71 HydrophobicContact CG1-CE2 3.49Å; V66-F71 VanDerWaalsContact CG1-CE2 3.49Å; V66-F71 HydrophobicContact CG1-CZ 3.43Å; V66-F71 VanDerWaalsContact CG1-CZ 3.43Å; E68-F71 PolarHBondContact O-N 3.29Å; F71-V79 HydrophobicContact CB-CG1 3.98Å; F71-V79 HydrophobicContact CD1-CG1 3.54Å; F71-V79 HydrophobicContact CE1-CG1 4.38Å; F71-V79 HydrophobicContact CG-CG1 4.11Å; F71-L81 HydrophobicContact CD1-CD2 3.6Å; F71-L81 HydrophobicContact CE1-CD2 3.59Å; F71-L81 HydrophobicContact CG-CD2 4.44Å; F71-L81 HydrophobicContact CZ-CD2 4.41Å |
| 72 | C | 60.8 | Low | 63.6 | Low | 42 Ų | 42 | 92.6 Ų | 92.6 | 28% | 0.284 | 49% | 0.489 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.1 | 132.6 | 163.4 | 39.3 | 0 | 0 | 0 | 0 | 109.4 | S80 T82 | C72-S80 PolarHBondContact N-O 3.01Å; C72-S80 PolarHBondContact O-N 3.18Å; C72-S80 PolarHBondContact O-OG 3.29Å; C72-S80 PolarHBondContact SG-O 3.21Å; C72-S80 PolarHBondContact SG-OG 3.39Å; C72-T82 PolarHBondContact SG-OG1 2.92Å; C72-T82 VanDerWaalsContact SG-OG1 3.41Å |
| 73 | L | 71.8 | Confident | 63.6 | Low | 122 Ų | 122 | 99.6 Ų | 99.6 | 64% | 0.639 | 52% | 0.522 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -94.6 | 115.1 | 170.7 | -172.1 | 75.7 | 0 | 0 | 0 | 107.3 | N78 V79 | L73-N78 WeakPolarHBondContact CA-O 3.2Å; L73-V79 HydrophobicContact CD1-CG2 3.57Å |
| 74 | D | 73.2 | Confident | 63.4 | Low | 73 Ų | 73 | 97 Ų | 97 | 39% | 0.39 | 53% | 0.527 | S | S | . | . | trans | -70.8 | 156 | 175.1 | -57.8 | -24.5 | 0 | 0 | 0 | 109.8 | D76 G77 N78 S80 | D74-D76 PolarHBondContact O-N 2.87Å; D74-G77 WeakPolarHBondContact O-CA 3.14Å; D74-G77 PolarHBondContact O-N 3.26Å; D74-N78 HydrophobicContact CB-CB 4.46Å; D74-N78 PolarHBondContact N-O 3.42Å; D74-S80 PolarHBondContact OD1-OG 3.14Å; D74-S80 VanDerWaalsContact OD1-OG 3.06Å | ||
| 75 | E | 74.6 | Confident | 63.2 | Low | 200 Ų | 200 | 99.3 Ų | 99.3 | 94% | 0.935 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | -23.5 | -179.6 | -64.4 | -71.6 | 141.3 | 0 | 0 | 113.5 | G77 | E75-G77 PolarHBondContact O-N 3.34Š|
| 76 | D | 74.9 | Confident | 63.2 | Low | 145 Ų | 145 | 98.7 Ų | 98.7 | 78% | 0.775 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.4 | 3.4 | 173.8 | -65.2 | -50.4 | 0 | 0 | 0 | 113.7 | D74 | D74-D76 PolarHBondContact O-N 2.87Š|
| 77 | G | 73.1 | Confident | 62.9 | Low | 50 Ų | 50 | 98.6 Ų | 98.6 | 52% | 0.515 | 54% | 0.537 | S | S | . | . | S | Bend | trans | 79.5 | 11.9 | -179 | 0 | 0 | 0 | 0 | 0 | 115 | D74 E75 | D74-G77 WeakPolarHBondContact O-CA 3.14Å; D74-G77 PolarHBondContact O-N 3.26Å; E75-G77 PolarHBondContact O-N 3.34Å |
| 78 | N | 71.4 | Confident | 62.7 | Low | 96 Ų | 96 | 99.2 Ų | 99.2 | 51% | 0.513 | 54% | 0.54 | S | S | . | . | trans | -85.5 | 133 | 177.5 | -63.7 | -61.7 | 0 | 0 | 0 | 110.6 | L73 D74 | L73-N78 WeakPolarHBondContact CA-O 3.2Å; D74-N78 HydrophobicContact CB-CB 4.46Å; D74-N78 PolarHBondContact N-O 3.42Å | ||
| 79 | V | 72.1 | Confident | 62.3 | Low | 97 Ų | 97 | 92.8 Ų | 92.8 | 59% | 0.588 | 52% | 0.515 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89.6 | 110.5 | 174.3 | -179.8 | 0 | 0 | 0 | 0 | 109 | F71 L73 | F71-V79 HydrophobicContact CB-CG1 3.98Å; F71-V79 HydrophobicContact CD1-CG1 3.54Å; F71-V79 HydrophobicContact CE1-CG1 4.38Å; F71-V79 HydrophobicContact CG-CG1 4.11Å; L73-V79 HydrophobicContact CD1-CG2 3.57Å |
| 80 | S | 67.4 | Low | 61.7 | Low | 37 Ų | 37 | 94.5 Ų | 94.5 | 26% | 0.259 | 52% | 0.515 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105 | 152.7 | 174.4 | 57.7 | 0 | 0 | 0 | 0 | 110.5 | C72 D74 | C72-S80 PolarHBondContact N-O 3.01Å; C72-S80 PolarHBondContact O-N 3.18Å; C72-S80 PolarHBondContact O-OG 3.29Å; C72-S80 PolarHBondContact SG-O 3.21Å; C72-S80 PolarHBondContact SG-OG 3.39Å; D74-S80 PolarHBondContact OD1-OG 3.14Å; D74-S80 VanDerWaalsContact OD1-OG 3.06Å |
| 81 | L | 65.1 | Low | 61.2 | Low | 103 Ų | 103 | 101.7 Ų | 101.7 | 54% | 0.539 | 55% | 0.546 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.5 | 126.9 | 174.9 | -74.1 | 172.6 | 0 | 0 | 0 | 109.2 | V66 F71 D83 | V66-L81 HydrophobicContact CG1-CD2 4.23Å; F71-L81 HydrophobicContact CD1-CD2 3.6Å; F71-L81 HydrophobicContact CE1-CD2 3.59Å; F71-L81 HydrophobicContact CG-CD2 4.44Å; F71-L81 HydrophobicContact CZ-CD2 4.41Å; L81-D83 PolarHBondContact O-N 2.98Å |
| 82 | T | 57.7 | Low | 61 | Low | 55 Ų | 55 | 102.4 Ų | 102.4 | 34% | 0.337 | 55% | 0.551 | S | S | . | * | trans | -77.6 | 123.9 | -177.2 | -18.5 | 0 | 0 | 0 | 0 | 110.8 | S70 C72 C84 | S70-T82 PolarHBondContact O-N 3.09Å; S70-T82 PolarHBondContact O-OG1 3Å; C72-T82 PolarHBondContact SG-OG1 2.92Å; C72-T82 VanDerWaalsContact SG-OG1 3.41Å; T82-C84 PolarHBondContact O-N 3.22Å | ||
| 83 | D | 54.2 | Low | 60.4 | Low | 166 Ų | 166 | 106.8 Ų | 106.8 | 89% | 0.888 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.6 | -6.1 | -175.7 | -96.8 | -23.8 | 0 | 0 | 0 | 115.9 | L81 | L81-D83 PolarHBondContact O-N 2.98Š|
| 84 | C | 49.2 | Very low | 59.3 | Low | 109 Ų | 109 | 107.5 Ų | 107.5 | 74% | 0.736 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.1 | -13.2 | -163.8 | -64.7 | 0 | 0 | 0 | 0 | 115.8 | T82 | T82-C84 PolarHBondContact O-N 3.22Š|
| 85 | R | 50.1 | Low | 58.2 | Low | 180 Ų | 180 | 109.5 Ų | 109.5 | 68% | 0.679 | 59% | 0.59 | S | S | * | * | trans | -151.3 | 24.1 | -170.1 | -141.2 | -176.8 | -177.9 | -173.2 | 1.9 | 118.9 | D69 S87 | D69-R85 IonicContact OD2-NH1 3.02Å; D69-R85 PolarHBondContact OD2-NH1 3.4Å; R85-S87 PolarHBondContact O-N 2.59Å | ||
| 86 | T | 53.3 | Low | 57.2 | Low | 75 Ų | 75 | 110 Ų | 110 | 46% | 0.46 | 58% | 0.583 | S | S | . | * | trans | -72.3 | 98.6 | 173.3 | 60.1 | 0 | 0 | 0 | 0 | 111.6 | V88 | T86-V88 PolarHBondContact O-N 3.46Š| ||
| 87 | S | 50.3 | Low | 56.2 | Low | 68 Ų | 68 | 108.5 Ų | 108.5 | 48% | 0.476 | 58% | 0.579 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -77 | 115.2 | 171.9 | 51.2 | 0 | 0 | 0 | 0 | 111 | R85 | R85-S87 PolarHBondContact O-N 2.59Å |
| 88 | V | 54.5 | Low | 55.3 | Low | 75 Ų | 75 | 114 Ų | 114 | 46% | 0.455 | 59% | 0.589 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -89.1 | 109.1 | 175.1 | -178.3 | 0 | 0 | 0 | 0 | 109.1 | Y64 T86 | Y64-V88 HydrophobicContact CD1-CG2 3.98Å; Y64-V88 HydrophobicContact CE1-CG2 3.8Å; T86-V88 PolarHBondContact O-N 3.46Å |
| 89 | S | 51.9 | Low | 54.7 | Low | 46 Ų | 46 | 120.2 Ų | 120.2 | 32% | 0.322 | 61% | 0.605 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -90.1 | 115.7 | 177.1 | 57.7 | 0 | 0 | 0 | 0 | 110.6 | Y63 D65 K91 | Y63-S89 PolarHBondContact O-N 2.84Å; D65-S89 WeakPolarHBondContact OD2-CB 3.21Å; D65-S89 PolarHBondContact OD2-OG 2.81Å; S89-K91 PolarHBondContact O-N 3.08Å |
| 90 | Y | 46.8 | Very low | 53.8 | Low | 136 Ų | 136 | 126.7 Ų | 126.7 | 53% | 0.533 | 62% | 0.619 | S | S | . | * | trans | -90.3 | 102.6 | 177.3 | -176.7 | -112.9 | 0 | 0 | 0 | 110.4 | L58 E92 | L58-Y90 HydrophobicContact CD2-CE2 4.29Å; Y90-E92 HydrophobicContact CD1-CB 3.91Å; Y90-E92 HydrophobicContact CE1-CB 3.52Å; Y90-E92 PolarHBondContact O-N 3.45Å; Y90-E92 VanDerWaalsContact O-N 3.08Å | ||
| 91 | K | 50.7 | Low | 53.4 | Low | 156 Ų | 156 | 136.4 Ų | 136.4 | 68% | 0.678 | 65% | 0.65 | S | S | * | * | trans | -77.1 | 90.7 | 169.9 | -172.4 | 171.3 | -177 | 171.7 | 0 | 109.9 | S89 N93 | S89-K91 PolarHBondContact O-N 3.08Å; K91-N93 PolarHBondContact O-N 3.17Å | ||
| 92 | E | 58.2 | Low | 53.3 | Low | 120 Ų | 120 | 142.9 Ų | 142.9 | 56% | 0.561 | 67% | 0.667 | S | S | * | * | trans | -68.4 | 112.9 | 172.4 | 67.6 | 176 | -177.7 | 0 | 0 | 111.2 | Y90 L94 | Y90-E92 HydrophobicContact CD1-CB 3.91Å; Y90-E92 HydrophobicContact CE1-CB 3.52Å; Y90-E92 PolarHBondContact O-N 3.45Å; Y90-E92 VanDerWaalsContact O-N 3.08Å; E92-L94 HydrophobicContact CG-CD2 4.12Å; E92-L94 HydrophobicContact CG-CG 4.22Å; E92-L94 PolarHBondContact O-N 3.14Å; E92-L94 VanDerWaalsContact O-N 3.14Å | ||
| 93 | N | 47.1 | Very low | 53.5 | Low | 133 Ų | 133 | 149.3 Ų | 149.3 | 71% | 0.711 | 69% | 0.691 | S | S | * | * | trans | -73.8 | 103 | 163.6 | -84.1 | -39.9 | 0 | 0 | 0 | 107.8 | K91 V95 | K91-N93 PolarHBondContact O-N 3.17Å; N93-V95 PolarHBondContact O-N 3.14Å | ||
| 94 | L | 49.6 | Very low | 53.5 | Low | 138 Ų | 138 | 146.9 Ų | 146.9 | 72% | 0.723 | 68% | 0.684 | S | S | * | * | trans | -67.8 | 52.6 | 176 | -69.8 | 175.6 | 0 | 0 | 0 | 113.2 | E92 R96 | E92-L94 HydrophobicContact CG-CD2 4.12Å; E92-L94 HydrophobicContact CG-CG 4.22Å; E92-L94 PolarHBondContact O-N 3.14Å; E92-L94 VanDerWaalsContact O-N 3.14Å; L94-R96 PolarHBondContact O-N 3.02Å | ||
| 95 | V | 50.5 | Low | 54 | Low | 115 Ų | 115 | 152.3 Ų | 152.3 | 70% | 0.697 | 69% | 0.689 | S | S | * | * | trans | -63.7 | 106.3 | 162.3 | -178.7 | 0 | 0 | 0 | 0 | 106.3 | N93 V97 | N93-V95 PolarHBondContact O-N 3.14Å; V95-V97 VanDerWaalsContact C-N 3.29Å; V95-V97 WeakPolarHBondContact O-CG2 3.21Å; V95-V97 PolarHBondContact O-N 3.34Å | ||
| 96 | R | 54.2 | Low | 54.4 | Low | 209 Ų | 209 | 148.1 Ų | 148.1 | 79% | 0.789 | 69% | 0.687 | S | S | * | * | trans | -61.7 | 82 | -176.4 | -77.3 | 173.5 | 66.6 | 161.8 | 1.8 | 111.8 | L94 F98 | L94-R96 PolarHBondContact O-N 3.02Å; R96-F98 HydrophobicContact CB-CD2 4.04Å; R96-F98 HydrophobicContact CG-CD2 4.08Å; R96-F98 HydrophobicContact CG-CE2 4.41Å; R96-F98 PolarHBondContact O-N 3.17Å | ||
| 97 | V | 53.9 | Low | 54.7 | Low | 115 Ų | 115 | 147.2 Ų | 147.2 | 70% | 0.697 | 69% | 0.687 | S | S | * | * | trans | -76.2 | 36.5 | 168.1 | -160.6 | 0 | 0 | 0 | 0 | 111.1 | V95 R99 | V95-V97 VanDerWaalsContact C-N 3.29Å; V95-V97 WeakPolarHBondContact O-CG2 3.21Å; V95-V97 PolarHBondContact O-N 3.34Å; V97-R99 PolarHBondContact O-N 2.96Å | ||
| 98 | F | 52.4 | Low | 55.1 | Low | 166 Ų | 166 | 149.8 Ų | 149.8 | 73% | 0.728 | 70% | 0.695 | S | S | * | * | trans | -73.1 | 80.1 | 163.9 | -70.6 | -72.4 | 0 | 0 | 0 | 108.5 | R96 R100 | R96-F98 HydrophobicContact CB-CD2 4.04Å; R96-F98 HydrophobicContact CG-CD2 4.08Å; R96-F98 HydrophobicContact CG-CE2 4.41Å; R96-F98 PolarHBondContact O-N 3.17Å; F98-R100 PolarHBondContact O-N 2.63Å | ||
| 99 | R | 60.3 | Low | 55.3 | Low | 225 Ų | 225 | 151.1 Ų | 151.1 | 85% | 0.849 | 70% | 0.703 | S | S | * | * | trans | -59.9 | 94.2 | 161.8 | -75.2 | -173.3 | 176.1 | -177.7 | 0.4 | 107.4 | V97 R101 | V97-R99 PolarHBondContact O-N 2.96Å; R99-R101 VanDerWaalsContact C-N 3.3Å; R99-R101 PolarHBondContact O-N 3.05Å | ||
| 100 | R | 52.7 | Low | 55.8 | Low | 234 Ų | 234 | 152.9 Ų | 152.9 | 88% | 0.883 | 72% | 0.715 | S | S | * | * | trans | -57.7 | 87.7 | -177.5 | -172.1 | 178.7 | -173.4 | 176.2 | 3.7 | 110 | F98 R102 | F98-R100 PolarHBondContact O-N 2.63Å; R100-R102 PolarHBondContact O-N 2.92Å | ||
| 101 | R | 59.3 | Low | 56.5 | Low | 241 Ų | 241 | 152.1 Ų | 152.1 | 91% | 0.909 | 72% | 0.72 | S | S | * | * | trans | -56.8 | 113 | 169.1 | -74.4 | -168.1 | 177 | -158.6 | 1.3 | 106.5 | R99 K103 | R99-R101 VanDerWaalsContact C-N 3.3Å; R99-R101 PolarHBondContact O-N 3.05Å; R101-K103 PolarHBondContact O-N 3.15Å | ||
| 102 | R | 61.9 | Low | 57 | Low | 238 Ų | 238 | 150.3 Ų | 150.3 | 90% | 0.898 | 72% | 0.717 | S | S | * | * | trans | -66.2 | 104.3 | 172.6 | -71.1 | -172.9 | 177 | -164.4 | -0.3 | 106.8 | R100 | R100-R102 PolarHBondContact O-N 2.92Š| ||
| 103 | K | 63.2 | Low | 57.2 | Low | 191 Ų | 191 | 147 Ų | 147 | 83% | 0.83 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 124.6 | 169.3 | -169.6 | 170 | -176.9 | 174.6 | 0 | 106.8 | R101 R105 | R101-K103 PolarHBondContact O-N 3.15Å; K103-R105 PolarHBondContact O-N 3.15Å |
| 104 | P | 54.3 | Low | 58 | Low | 115 Ų | 115 | 142.3 Ų | 142.3 | 75% | 0.747 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -58 | 129.5 | 175.9 | 24.5 | -32.5 | 0 | 0 | 0 | 107.7 | S106 | P104-S106 PolarHBondContact O-N 3.21Š|
| 105 | R | 59.8 | Low | 58.8 | Low | 223 Ų | 223 | 139.6 Ų | 139.6 | 84% | 0.842 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 122.9 | 176.5 | -76.1 | 179.1 | 166.8 | 168 | -6.9 | 107.6 | K103 A107 L108 | K103-R105 PolarHBondContact O-N 3.15Å; R105-A107 PolarHBondContact O-N 3.28Å; R105-L108 PolarHBondContact O-N 3.45Å |
| 106 | S | 58.8 | Low | 59.5 | Low | 91 Ų | 91 | 136.7 Ų | 136.7 | 64% | 0.636 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.6 | -14.2 | 179.2 | 43.4 | 0 | 0 | 0 | 0 | 114.2 | P104 L108 V109 S110 | P104-S106 PolarHBondContact O-N 3.21Å; S106-L108 PolarHBondContact O-N 2.75Å; S106-L108 VanDerWaalsContact O-N 3.1Å; S106-V109 WeakPolarHBondContact O-CB 3.1Å; S106-V109 PolarHBondContact O-N 3.31Å; S106-S110 PolarHBondContact O-N 2.75Å |
| 107 | A | 58.5 | Low | 59.9 | Low | 56 Ų | 56 | 132.6 Ų | 132.6 | 46% | 0.463 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -50 | -31.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | R105 V109 L111 | R105-A107 PolarHBondContact O-N 3.28Å; A107-V109 VanDerWaalsContact C-N 3.34Å; A107-L111 WeakPolarHBondContact O-CG 3.4Å; A107-L111 PolarHBondContact O-N 3.13Å |
| 108 | L | 58.2 | Low | 60.4 | Low | 122 Ų | 122 | 130.4 Ų | 130.4 | 64% | 0.639 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -70 | -30.9 | 175.5 | -66.6 | -178.5 | 0 | 0 | 0 | 112.7 | R105 S106 L112 | R105-L108 PolarHBondContact O-N 3.45Å; S106-L108 PolarHBondContact O-N 2.75Å; S106-L108 VanDerWaalsContact O-N 3.1Å; L108-L112 WeakPolarHBondContact O-CB 3.29Å; L108-L112 VanDerWaalsContact O-CG 3.24Å; L108-L112 WeakPolarHBondContact O-CG 3.44Å; L108-L112 PolarHBondContact O-N 3.11Å |
| 109 | V | 59.6 | Low | 60.8 | Low | 104 Ų | 104 | 125.4 Ų | 125.4 | 63% | 0.63 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -69.9 | -42.6 | 176.2 | -177.5 | 0 | 0 | 0 | 0 | 109.9 | S106 A107 L111 L112 S113 | S106-V109 WeakPolarHBondContact O-CB 3.1Å; S106-V109 PolarHBondContact O-N 3.31Å; A107-V109 VanDerWaalsContact C-N 3.34Å; V109-L111 VanDerWaalsContact C-N 3.34Å; V109-L111 PolarHBondContact O-N 3Å; V109-L112 PolarHBondContact O-N 3.23Å; V109-S113 PolarHBondContact O-N 3.01Å |
| 110 | S | 61.6 | Low | 60.8 | Low | 83 Ų | 83 | 120.6 Ų | 120.6 | 58% | 0.58 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -67.5 | -29.7 | 176 | -51 | 0 | 0 | 0 | 0 | 113.9 | S106 S113 | S106-S110 PolarHBondContact O-N 2.75Å; S110-S113 PolarHBondContact O-OG 3.18Å; S110-S113 VanDerWaalsContact O-OG 3.12Å |
| 111 | L | 62.3 | Low | 61.3 | Low | 119 Ų | 119 | 113.1 Ų | 113.1 | 62% | 0.623 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -74.4 | -39.4 | 172 | -72.4 | 171.9 | 0 | 0 | 0 | 111.6 | A107 V109 V115 | A107-L111 WeakPolarHBondContact O-CG 3.4Å; A107-L111 PolarHBondContact O-N 3.13Å; V109-L111 VanDerWaalsContact C-N 3.34Å; V109-L111 PolarHBondContact O-N 3Å; L111-V115 WeakPolarHBondContact O-CG2 3.41Å; L111-V115 PolarHBondContact O-N 3.39Å |
| 112 | L | 61.6 | Low | 61.4 | Low | 119 Ų | 119 | 109 Ų | 109 | 62% | 0.623 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -73.7 | -27.7 | 177.9 | -71.7 | 170.5 | 0 | 0 | 0 | 112.9 | L108 V109 S116 | L108-L112 WeakPolarHBondContact O-CB 3.29Å; L108-L112 VanDerWaalsContact O-CG 3.24Å; L108-L112 WeakPolarHBondContact O-CG 3.44Å; L108-L112 PolarHBondContact O-N 3.11Å; V109-L112 PolarHBondContact O-N 3.23Å; L112-S116 WeakPolarHBondContact O-CB 3.25Å; L112-S116 PolarHBondContact O-N 2.94Å |
| 113 | S | 62.7 | Low | 61.3 | Low | 49 Ų | 49 | 101.7 Ų | 101.7 | 34% | 0.343 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -66.5 | -50.4 | 174.5 | 67 | 0 | 0 | 0 | 0 | 111.4 | V109 S110 V115 S116 E117 | V109-S113 PolarHBondContact O-N 3.01Å; S110-S113 PolarHBondContact O-OG 3.18Å; S110-S113 VanDerWaalsContact O-OG 3.12Å; S113-V115 VanDerWaalsContact C-N 3.31Å; S113-V115 PolarHBondContact O-N 3.09Å; S113-S116 CarbonylContact O-C 3.55Å; S113-S116 WeakPolarHBondContact O-CA 3Å; S113-S116 WeakPolarHBondContact O-CB 3.33Å; S113-S116 PolarHBondContact O-N 2.86Å; S113-E117 WeakPolarHBondContact O-CG 3.41Å; S113-E117 PolarHBondContact O-N 3.39Å |
| 114 | G | 63.3 | Low | 61 | Low | 35 Ų | 35 | 97.5 Ų | 97.5 | 36% | 0.361 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.5 | -33.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | S118 | G114-S118 PolarHBondContact O-N 3.14Å; G114-S118 VanDerWaalsContact O-N 3.16Å; G114-S118 PolarHBondContact O-OG 2.57Å |
| 115 | V | 65.1 | Low | 61.4 | Low | 81 Ų | 81 | 98.8 Ų | 98.8 | 49% | 0.491 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -69.2 | -41.3 | 170.2 | 173.8 | 0 | 0 | 0 | 0 | 111 | L111 S113 S118 C119 | L111-V115 WeakPolarHBondContact O-CG2 3.41Å; L111-V115 PolarHBondContact O-N 3.39Å; S113-V115 VanDerWaalsContact C-N 3.31Å; S113-V115 PolarHBondContact O-N 3.09Å; V115-S118 PolarHBondContact O-OG 3.36Å; V115-S118 VanDerWaalsContact O-OG 3.05Å; V115-C119 VanDerWaalsContact O-CB 3.25Å; V115-C119 WeakPolarHBondContact O-CB 3.18Å; V115-C119 PolarHBondContact O-N 3.24Å; V115-C119 PolarHBondContact O-SG 3.28Å |
| 116 | S | 65.4 | Low | 61.2 | Low | 55 Ų | 55 | 94.5 Ų | 94.5 | 39% | 0.385 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.9 | -45.4 | 177.2 | -169.2 | 0 | 0 | 0 | 0 | 111.9 | L112 S113 C119 Q120 | L112-S116 WeakPolarHBondContact O-CB 3.25Å; L112-S116 PolarHBondContact O-N 2.94Å; S113-S116 CarbonylContact O-C 3.55Å; S113-S116 WeakPolarHBondContact O-CA 3Å; S113-S116 WeakPolarHBondContact O-CB 3.33Å; S113-S116 PolarHBondContact O-N 2.86Å; S116-C119 PolarHBondContact O-N 3.24Å; S116-Q120 WeakPolarHBondContact O-CB 3.46Å; S116-Q120 VanDerWaalsContact O-CG 3.25Å; S116-Q120 WeakPolarHBondContact O-CG 3.33Å; S116-Q120 PolarHBondContact O-N 3.36Å |
| 117 | E | 63.8 | Low | 61.2 | Low | 123 Ų | 123 | 93.2 Ų | 93.2 | 58% | 0.575 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -60.8 | -48.2 | 177.8 | -70.9 | 158 | -148.1 | 0 | 0 | 111.6 | S113 Q120 S121 | S113-E117 WeakPolarHBondContact O-CG 3.41Å; S113-E117 PolarHBondContact O-N 3.39Å; E117-Q120 PolarHBondContact O-N 3.46Å; E117-S121 PolarHBondContact O-N 2.95Å |
| 118 | S | 63.1 | Low | 61 | Low | 68 Ų | 68 | 95.4 Ų | 95.4 | 48% | 0.476 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.9 | -41.2 | 176.4 | 55.5 | 0 | 0 | 0 | 0 | 112.4 | G114 V115 S121 W122 | G114-S118 PolarHBondContact O-N 3.14Å; G114-S118 VanDerWaalsContact O-N 3.16Å; G114-S118 PolarHBondContact O-OG 2.57Å; V115-S118 PolarHBondContact O-OG 3.36Å; V115-S118 VanDerWaalsContact O-OG 3.05Å; S118-S121 PolarHBondContact O-OG 2.87Å; S118-W122 PolarHBondContact O-N 2.9Å |
| 119 | C | 60.5 | Low | 60.8 | Low | 62 Ų | 62 | 99.2 Ų | 99.2 | 42% | 0.419 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -67.8 | -35.4 | 174.6 | -71.2 | 0 | 0 | 0 | 0 | 113.3 | V115 S116 W122 L123 | V115-C119 VanDerWaalsContact O-CB 3.25Å; V115-C119 WeakPolarHBondContact O-CB 3.18Å; V115-C119 PolarHBondContact O-N 3.24Å; V115-C119 PolarHBondContact O-SG 3.28Å; S116-C119 PolarHBondContact O-N 3.24Å; C119-W122 PolarHBondContact O-N 2.72Å; C119-L123 WeakPolarHBondContact O-CB 3.32Å; C119-L123 VanDerWaalsContact O-CG 3.24Å; C119-L123 WeakPolarHBondContact O-CG 3.34Å; C119-L123 PolarHBondContact O-N 3.02Å |
| 120 | Q | 61 | Low | 60.5 | Low | 123 Ų | 123 | 97.3 Ų | 97.3 | 58% | 0.575 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.4 | -46.4 | 177.6 | -83 | 179.1 | 14.8 | 0 | 0 | 110.9 | S116 E117 W122 L123 D124 | S116-Q120 WeakPolarHBondContact O-CB 3.46Å; S116-Q120 VanDerWaalsContact O-CG 3.25Å; S116-Q120 WeakPolarHBondContact O-CG 3.33Å; S116-Q120 PolarHBondContact O-N 3.36Å; E117-Q120 PolarHBondContact O-N 3.46Å; Q120-W122 VanDerWaalsContact C-N 3.27Å; Q120-W122 PolarHBondContact O-N 3.23Å; Q120-L123 PolarHBondContact O-N 2.91Å; Q120-D124 WeakPolarHBondContact O-CB 3.35Å; Q120-D124 PolarHBondContact O-N 2.95Å |
| 121 | S | 62.8 | Low | 59.9 | Low | 77 Ų | 77 | 99.4 Ų | 99.4 | 54% | 0.538 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -58.5 | -37.8 | 177 | 71.5 | 0 | 0 | 0 | 0 | 113.1 | E117 S118 Q125 | E117-S121 PolarHBondContact O-N 2.95Å; S118-S121 PolarHBondContact O-OG 2.87Å; S121-Q125 WeakPolarHBondContact O-CB 3.24Å; S121-Q125 PolarHBondContact O-N 3.28Å |
| 122 | W | 61.1 | Low | 59.2 | Low | 156 Ų | 156 | 100.7 Ų | 100.7 | 59% | 0.591 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -76.7 | -36.4 | 179.6 | -161.9 | 92.1 | 0 | 0 | 0 | 112.8 | S118 C119 Q120 K126 | S118-W122 PolarHBondContact O-N 2.9Å; C119-W122 PolarHBondContact O-N 2.72Å; Q120-W122 VanDerWaalsContact C-N 3.27Å; Q120-W122 PolarHBondContact O-N 3.23Å; W122-K126 HydrophobicContact CD2-CD 4.17Å; W122-K126 HydrophobicContact CE3-CD 4.15Å; W122-K126 HydrophobicContact CH2-CD 3.86Å; W122-K126 HydrophobicContact CZ2-CD 3.86Å; W122-K126 HydrophobicContact CZ3-CD 3.98Å; W122-K126 WeakPolarHBondContact O-CB 3.37Å; W122-K126 PolarHBondContact O-N 2.75Å |
| 123 | L | 60.2 | Low | 58.6 | Low | 83 Ų | 83 | 97.7 Ų | 97.7 | 44% | 0.435 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -71.3 | -41 | 176.3 | -72.8 | 169.9 | 0 | 0 | 0 | 111.7 | C119 Q120 K126 V127 | C119-L123 WeakPolarHBondContact O-CB 3.32Å; C119-L123 VanDerWaalsContact O-CG 3.24Å; C119-L123 WeakPolarHBondContact O-CG 3.34Å; C119-L123 PolarHBondContact O-N 3.02Å; Q120-L123 PolarHBondContact O-N 2.91Å; L123-K126 PolarHBondContact O-N 3.06Å; L123-V127 HydrophobicContact CD2-CG2 4.01Å; L123-V127 WeakPolarHBondContact O-CA 3.32Å; L123-V127 VanDerWaalsContact O-CB 3.24Å; L123-V127 WeakPolarHBondContact O-CB 3.41Å; L123-V127 WeakPolarHBondContact O-CG2 3.34Å; L123-V127 PolarHBondContact O-N 2.8Å |
| 124 | D | 58.1 | Low | 57.8 | Low | 103 Ų | 103 | 101.4 Ų | 101.4 | 55% | 0.551 | 55% | 0.554 | S | S | * | * | I | π-helix | trans | -61.1 | -48.1 | 176.9 | -168.2 | 43.3 | 0 | 0 | 0 | 111.2 | Q120 K126 F128 R129 | Q120-D124 WeakPolarHBondContact O-CB 3.35Å; Q120-D124 PolarHBondContact O-N 2.95Å; D124-K126 PolarHBondContact O-N 3.39Å; D124-F128 PolarHBondContact O-N 2.98Å; D124-R129 PolarHBondContact O-N 3.48Å |
| 125 | Q | 62.9 | Low | 57 | Low | 143 Ų | 143 | 103.4 Ų | 103.4 | 67% | 0.668 | 58% | 0.575 | S | S | * | * | I | π-helix | trans | -66.9 | -30.1 | -179.5 | -168 | 170.9 | 7.2 | 0 | 0 | 114.1 | S121 | S121-Q125 WeakPolarHBondContact O-CB 3.24Å; S121-Q125 PolarHBondContact O-N 3.28Å |
| 126 | K | 55 | Low | 55.8 | Low | 132 Ų | 132 | 107.2 Ų | 107.2 | 57% | 0.574 | 59% | 0.592 | S | S | * | * | I | π-helix | trans | -101.4 | -32.1 | -177.9 | -82.8 | -173.1 | 173 | -178.8 | 0 | 116 | W122 L123 D124 | W122-K126 HydrophobicContact CD2-CD 4.17Å; W122-K126 HydrophobicContact CE3-CD 4.15Å; W122-K126 HydrophobicContact CH2-CD 3.86Å; W122-K126 HydrophobicContact CZ2-CD 3.86Å; W122-K126 HydrophobicContact CZ3-CD 3.98Å; W122-K126 WeakPolarHBondContact O-CB 3.37Å; W122-K126 PolarHBondContact O-N 2.75Å; L123-K126 PolarHBondContact O-N 3.06Å; D124-K126 PolarHBondContact O-N 3.39Å |
| 127 | V | 59.4 | Low | 54.4 | Low | 65 Ų | 65 | 114.5 Ų | 114.5 | 39% | 0.394 | 61% | 0.611 | S | S | . | * | I | π-helix | trans | -98.6 | -46.9 | -172.5 | -175 | 0 | 0 | 0 | 0 | 110.8 | L123 M131 | L123-V127 HydrophobicContact CD2-CG2 4.01Å; L123-V127 WeakPolarHBondContact O-CA 3.32Å; L123-V127 VanDerWaalsContact O-CB 3.24Å; L123-V127 WeakPolarHBondContact O-CB 3.41Å; L123-V127 WeakPolarHBondContact O-CG2 3.34Å; L123-V127 PolarHBondContact O-N 2.8Å; V127-M131 HydrophobicContact CG1-CE 4.17Å; V127-M131 WeakPolarHBondContact O-CB 3.31Å; V127-M131 PolarHBondContact O-N 3.02Å |
| 128 | F | 53.8 | Low | 53.2 | Low | 102 Ų | 102 | 117 Ų | 117 | 45% | 0.447 | 62% | 0.622 | S | S | . | * | I | π-helix | trans | -84.6 | -40.2 | -174.4 | -67.4 | -83.4 | 0 | 0 | 0 | 112.4 | D124 G130 M131 L132 | D124-F128 PolarHBondContact O-N 2.98Å; F128-G130 PolarHBondContact O-N 2.79Å; F128-M131 PolarHBondContact O-N 3.28Å; F128-M131 VanDerWaalsContact O-N 3.14Å; F128-L132 HydrophobicContact CD1-CD1 4.45Å; F128-L132 PolarHBondContact O-N 3.25Å |
| 129 | R | 53.9 | Low | 51.8 | Low | 202 Ų | 202 | 119.1 Ų | 119.1 | 76% | 0.762 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -62.9 | -26.2 | 175.4 | -149.7 | 179.4 | -152.2 | -101.1 | 2.8 | 113.9 | D124 | D124-R129 PolarHBondContact O-N 3.48Å |
| 130 | G | 52.2 | Low | 51 | Low | 63 Ų | 63 | 121.6 Ų | 121.6 | 65% | 0.649 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -84 | -23.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | F128 | F128-G130 PolarHBondContact O-N 2.79Å |
| 131 | M | 50.1 | Low | 49.7 | Very low | 128 Ų | 128 | 123.4 Ų | 123.4 | 63% | 0.631 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -102.9 | -24.2 | -172.4 | -173.9 | 160.9 | 48.2 | 0 | 0 | 113.6 | V127 F128 | V127-M131 HydrophobicContact CG1-CE 4.17Å; V127-M131 WeakPolarHBondContact O-CB 3.31Å; V127-M131 PolarHBondContact O-N 3.02Å; F128-M131 PolarHBondContact O-N 3.28Å; F128-M131 VanDerWaalsContact O-N 3.14Å |
| 132 | L | 47.8 | Very low | 48.7 | Very low | 145 Ų | 145 | 127.3 Ų | 127.3 | 76% | 0.759 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -100.5 | -0.1 | 170.4 | -73.7 | 147.2 | 0 | 0 | 0 | 112.5 | F128 T134 | F128-L132 HydrophobicContact CD1-CD1 4.45Å; F128-L132 PolarHBondContact O-N 3.25Å; L132-T134 VanDerWaalsContact C-N 3.31Å; L132-T134 PolarHBondContact O-N 3.17Å |
| 133 | G | 48.5 | Very low | 47.4 | Very low | 56 Ų | 56 | 127.6 Ų | 127.6 | 58% | 0.577 | 68% | 0.684 | S | S | * | * | trans | -83.9 | 27 | -175.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 134 | T | 45.1 | Very low | 46.5 | Very low | 128 Ų | 128 | 130.7 Ų | 130.7 | 79% | 0.785 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -120.8 | 97.3 | 173.1 | 48.9 | 0 | 0 | 0 | 0 | 109.9 | L132 | L132-T134 VanDerWaalsContact C-N 3.31Å; L132-T134 PolarHBondContact O-N 3.17Å |
| 135 | G | 46.9 | Very low | 45.4 | Very low | 77 Ų | 77 | 132.5 Ų | 132.5 | 79% | 0.794 | 71% | 0.71 | S | S | * | * | S | Bend | trans | 157.3 | -2.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||
| 136 | L | 39.4 | Very low | 44.6 | Very low | 160 Ų | 160 | 130.2 Ų | 130.2 | 84% | 0.838 | 71% | 0.708 | S | S | * | * | trans | -146.4 | 83.9 | 168.6 | -151.6 | 73.9 | 0 | 0 | 0 | 112.5 | Q138 | L136-Q138 PolarHBondContact O-N 3.02Š| ||
| 137 | R | 37.5 | Very low | 43.8 | Very low | 209 Ų | 209 | 131.1 Ų | 131.1 | 79% | 0.789 | 72% | 0.719 | S | S | * | * | trans | -71.5 | 110.6 | 163.9 | -179.1 | -177.7 | 176.5 | -137.5 | -5.1 | 107.6 | N139 | R137-N139 PolarHBondContact NH2-OD1 3.12Å; R137-N139 PolarHBondContact O-N 2.83Å; R137-N139 VanDerWaalsContact O-N 3.13Å | ||
| 138 | Q | 37.4 | Very low | 43 | Very low | 174 Ų | 174 | 136.1 Ų | 136.1 | 81% | 0.813 | 74% | 0.743 | S | S | * | * | trans | -63.9 | 111.2 | 169.4 | -66.3 | 174.2 | 0.1 | 0 | 0 | 108.9 | L136 | L136-Q138 PolarHBondContact O-N 3.02Š| ||
| 139 | N | 33 | Very low | 42.4 | Very low | 113 Ų | 113 | 138.5 Ų | 138.5 | 60% | 0.604 | 76% | 0.76 | S | S | * | * | trans | -106.3 | 117.4 | 155.3 | -90.6 | -1.6 | 0 | 0 | 0 | 106.1 | R137 | R137-N139 PolarHBondContact NH2-OD1 3.12Å; R137-N139 PolarHBondContact O-N 2.83Å; R137-N139 VanDerWaalsContact O-N 3.13Å | ||
| 140 | P | 44.6 | Very low | 41.9 | Very low | 114 Ų | 114 | 136.1 Ų | 136.1 | 74% | 0.74 | 76% | 0.762 | S | S | * | * | trans | -91.8 | 99.5 | 163.9 | 33 | -24.2 | 0 | 0 | 0 | 108.5 | ||||
| 141 | D | 33.2 | Very low | 41.2 | Very low | 161 Ų | 161 | 140.6 Ų | 140.6 | 86% | 0.861 | 77% | 0.771 | S | S | * | * | trans | -154.4 | 126.9 | 155.1 | -86.3 | -42.6 | 0 | 0 | 0 | 107.1 | ||||
| 142 | L | 42.1 | Very low | 40.8 | Very low | 160 Ų | 160 | 142.3 Ų | 142.3 | 84% | 0.838 | 78% | 0.781 | S | S | * | * | trans | -82 | 148.3 | 173.2 | -75.7 | 75.2 | 0 | 0 | 0 | 108.8 | ||||
| 143 | D | 35 | Very low | 40.1 | Very low | 161 Ų | 161 | 142.6 Ų | 142.6 | 86% | 0.861 | 78% | 0.784 | S | S | * | * | -168.9 | 156.2 | 124.4 | -92.8 | -27.7 | 0 | 0 | 0 | 111.3 | |||||
| 144 | L | 40.2 | Very low | 39.3 | Very low | 148 Ų | 148 | 149.1 Ų | 149.1 | 78% | 0.775 | 79% | 0.791 | S | S | * | * | trans | -37.1 | 148.7 | -179.3 | -91 | 52.8 | 0 | 0 | 0 | 116 | ||||
| 145 | D | 34.9 | Very low | 39.2 | Very low | 141 Ų | 141 | 148 Ų | 148 | 75% | 0.754 | 79% | 0.786 | S | S | * | * | -155.6 | 165.8 | 54.3 | -101.7 | -42.2 | 0 | 0 | 0 | 113.2 | |||||
| 146 | P | 47 | Very low | 38.7 | Very low | 95 Ų | 95 | 154.2 Ų | 154.2 | 62% | 0.617 | 79% | 0.785 | S | S | * | * | trans | -86.7 | -173.9 | 169.4 | 38.4 | -33.9 | 0 | 0 | 0 | 112.6 | ||||
| 147 | D | 38 | Very low | 38.2 | Very low | 151 Ų | 151 | 152.3 Ų | 152.3 | 81% | 0.807 | 78% | 0.78 | S | S | * | * | trans | 81.6 | 84.8 | 169.2 | -50.2 | -13.3 | 0 | 0 | 0 | 117.4 | ||||
| 148 | L | 43.2 | Very low | 38 | Very low | 171 Ų | 171 | 147.8 Ų | 147.8 | 90% | 0.895 | 78% | 0.78 | S | S | * | * | -155.9 | 114.5 | 125.8 | -151.2 | 66.9 | 0 | 0 | 0 | 112.4 | |||||
| 149 | D | 40 | Very low | 37.8 | Very low | 151 Ų | 151 | 148.2 Ų | 148.2 | 81% | 0.807 | 78% | 0.782 | S | S | * | * | trans | -66.7 | 132.7 | 168.1 | -62.6 | -56.8 | 0 | 0 | 0 | 110.6 | ||||
| 150 | L | 42.9 | Very low | 37.7 | Very low | 153 Ų | 153 | 152.1 Ų | 152.1 | 80% | 0.801 | 80% | 0.797 | S | S | * | * | trans | -149.4 | 80.7 | 159.4 | -157 | 71.4 | 0 | 0 | 0 | 111.4 | L152 | L150-L152 PolarHBondContact O-N 2.83Š| ||
| 151 | D | 37.5 | Very low | 37 | Very low | 156 Ų | 156 | 150 Ų | 150 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | trans | -54.8 | 126.9 | 161.1 | -72.7 | -48.3 | 0 | 0 | 0 | 110.1 | ||||
| 152 | L | 41.8 | Very low | 37 | Very low | 164 Ų | 164 | 147.5 Ų | 147.5 | 86% | 0.859 | 80% | 0.797 | S | S | * | * | trans | -146.5 | 110.4 | 164.4 | -138.8 | 76.4 | 0 | 0 | 0 | 111.1 | L150 | L150-L152 PolarHBondContact O-N 2.83Š| ||
| 153 | D | 32.9 | Very low | 36.3 | Very low | 151 Ų | 151 | 145.2 Ų | 145.2 | 81% | 0.807 | 80% | 0.795 | S | S | * | * | trans | -84.7 | 132.9 | -170.1 | -105.4 | -40.3 | 0 | 0 | 0 | 114.6 | ||||
| 154 | W | 32 | Very low | 36.4 | Very low | 194 Ų | 194 | 142.8 Ų | 142.8 | 74% | 0.735 | 79% | 0.788 | S | S | * | * | trans | 64.4 | 166.3 | 144.2 | -134.5 | -123.3 | 0 | 0 | 0 | 117.6 | R156 | W154-R156 HydrophobicContact CH2-CB 4.09Å; W154-R156 HydrophobicContact CZ2-CB 3.57Å; W154-R156 HydrophobicContact CZ2-CG 4.47Å | ||
| 155 | P | 42.9 | Very low | 35.9 | Very low | 103 Ų | 103 | 141.5 Ų | 141.5 | 67% | 0.669 | 79% | 0.79 | S | S | * | * | cis | -117.5 | 153.4 | 5.1 | 11.4 | 14.3 | 0 | 0 | 0 | 119.2 | V157 | P155-V157 PolarHBondContact O-N 3.27Š| ||
| 156 | R | 36.3 | Very low | 35.8 | Very low | 208 Ų | 208 | 146.7 Ų | 146.7 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | trans | -54.8 | 103.7 | 160 | -173.5 | -170 | -134.3 | 179.3 | 5.5 | 112.1 | W154 | W154-R156 HydrophobicContact CH2-CB 4.09Å; W154-R156 HydrophobicContact CZ2-CB 3.57Å; W154-R156 HydrophobicContact CZ2-CG 4.47Å | ||
| 157 | V | 29.2 | Very low | 35.5 | Very low | 121 Ų | 121 | 149.8 Ų | 149.8 | 73% | 0.733 | 81% | 0.809 | S | S | * | * | trans | -85.3 | 111 | 167.1 | 172.7 | 0 | 0 | 0 | 0 | 110 | P155 | P155-V157 PolarHBondContact O-N 3.27Š| ||
| 158 | S | 32.9 | Very low | 35.5 | Very low | 113 Ų | 113 | 146.6 Ų | 146.6 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | trans | -75.2 | 118 | 162.3 | 51.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 159 | Q | 33.5 | Very low | 35.4 | Very low | 183 Ų | 183 | 146.5 Ų | 146.5 | 86% | 0.855 | 79% | 0.787 | S | S | * | * | trans | -133.5 | 126.5 | 157.1 | -114 | -175.3 | 57.6 | 0 | 0 | 111.9 | G161 | Q159-G161 PolarHBondContact O-N 3.46Š| ||
| 160 | Q | 32 | Very low | 35.5 | Very low | 196 Ų | 196 | 143.3 Ų | 143.3 | 92% | 0.916 | 78% | 0.777 | S | S | * | * | trans | -67.5 | 116.7 | 178.5 | -159.2 | 80.3 | 9.7 | 0 | 0 | 109.4 | ||||
| 161 | G | 28.5 | Very low | 35.4 | Very low | 70 Ų | 70 | 141.9 Ų | 141.9 | 72% | 0.722 | 77% | 0.769 | S | S | * | * | trans | -131.9 | 113.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | Q159 S163 | Q159-G161 PolarHBondContact O-N 3.46Å; G161-S163 PolarHBondContact O-N 3.34Å | ||
| 162 | A | 33.3 | Very low | 35.6 | Very low | 107 Ų | 107 | 143.7 Ų | 143.7 | 88% | 0.884 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 124 | -173.1 | 0 | 0 | 0 | 0 | 0 | 112 | ||
| 163 | S | 28.4 | Very low | 35.6 | Very low | 113 Ų | 113 | 139.1 Ų | 139.1 | 79% | 0.79 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -90.7 | 127.6 | 169.4 | -175.2 | 0 | 0 | 0 | 0 | 109.9 | G161 | G161-S163 PolarHBondContact O-N 3.34Š|
| 164 | P | 36.4 | Very low | 35.9 | Very low | 109 Ų | 109 | 134.2 Ų | 134.2 | 71% | 0.708 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 133.8 | 179.7 | 30.4 | -33 | 0 | 0 | 0 | 112 | ||
| 165 | C | 31 | Very low | 36.3 | Very low | 121 Ų | 121 | 130.7 Ų | 130.7 | 82% | 0.818 | 73% | 0.731 | S | S | * | * | trans | 45.9 | 78.1 | 152.9 | -57.1 | 0 | 0 | 0 | 0 | 117.2 | L167 | C165-L167 PolarHBondContact O-N 3.1Š| ||
| 166 | R | 32.3 | Very low | 36.3 | Very low | 251 Ų | 251 | 131.5 Ų | 131.5 | 95% | 0.947 | 73% | 0.729 | S | S | * | * | trans | -68.5 | 113.9 | 150.4 | -142 | 178.3 | -174.7 | 166.8 | 1.4 | 107.2 | D168 | R166-D168 PolarHBondContact O-N 2.88Š| ||
| 167 | L | 40.7 | Very low | 36.6 | Very low | 159 Ų | 159 | 125.1 Ų | 125.1 | 83% | 0.832 | 72% | 0.721 | S | S | * | * | trans | -64.3 | 125.5 | 174.8 | -88.9 | 162.1 | 0 | 0 | 0 | 109 | C165 E169 | C165-L167 PolarHBondContact O-N 3.1Å; L167-E169 PolarHBondContact O-N 2.8Å; L167-E169 VanDerWaalsContact O-N 3.14Å | ||
| 168 | D | 37.4 | Very low | 37.3 | Very low | 85 Ų | 85 | 126.7 Ų | 126.7 | 46% | 0.455 | 73% | 0.725 | S | S | . | * | trans | -79.8 | 92.9 | -179 | -178.6 | 30 | 0 | 0 | 0 | 110.5 | R166 S170 | R166-D168 PolarHBondContact O-N 2.88Å; D168-S170 PolarHBondContact O-N 3.42Å; D168-S170 WeakPolarHBondContact OD1-CB 3.31Å; D168-S170 PolarHBondContact OD1-N 2.97Å; D168-S170 PolarHBondContact OD1-OG 3.05Å | ||
| 169 | E | 40.6 | Very low | 38 | Very low | 169 Ų | 169 | 128.2 Ų | 128.2 | 79% | 0.79 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.8 | -15.4 | 175.6 | -66 | 178.9 | 119.2 | 0 | 0 | 112.4 | L167 L171 W172 | L167-E169 PolarHBondContact O-N 2.8Å; L167-E169 VanDerWaalsContact O-N 3.14Å; E169-L171 VanDerWaalsContact C-N 3.33Å; E169-L171 PolarHBondContact O-N 3.1Å; E169-W172 PolarHBondContact O-N 3.46Å |
| 170 | S | 43.3 | Very low | 38.5 | Very low | 83 Ų | 83 | 126.6 Ų | 126.6 | 58% | 0.58 | 72% | 0.721 | S | S | * | * | H | α-helix | trans | -64.2 | -34 | 179.5 | -31.9 | 0 | 0 | 0 | 0 | 113.1 | D168 W172 A173 | D168-S170 PolarHBondContact O-N 3.42Å; D168-S170 WeakPolarHBondContact OD1-CB 3.31Å; D168-S170 PolarHBondContact OD1-N 2.97Å; D168-S170 PolarHBondContact OD1-OG 3.05Å; S170-W172 PolarHBondContact O-N 3.06Å; S170-A173 PolarHBondContact O-N 3.1Å; S170-A173 VanDerWaalsContact O-N 3.15Å |
| 171 | L | 40 | Very low | 39.1 | Very low | 124 Ų | 124 | 122.8 Ų | 122.8 | 65% | 0.649 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -64.9 | -22.3 | -176.3 | -105.1 | 163.2 | 0 | 0 | 0 | 113.8 | E169 | E169-L171 VanDerWaalsContact C-N 3.33Å; E169-L171 PolarHBondContact O-N 3.1Å |
| 172 | W | 41.3 | Very low | 39.9 | Very low | 194 Ų | 194 | 122.9 Ų | 122.9 | 74% | 0.735 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -93.8 | -19 | 176.6 | -64 | 99.7 | 0 | 0 | 0 | 113.5 | E169 S170 N176 | E169-W172 PolarHBondContact O-N 3.46Å; S170-W172 PolarHBondContact O-N 3.06Å; W172-N176 PolarHBondContact O-ND2 3.36Å |
| 173 | A | 43.3 | Very low | 40.4 | Very low | 67 Ų | 67 | 127.8 Ų | 127.8 | 55% | 0.554 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -71.1 | -43.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | S170 L175 N176 | S170-A173 PolarHBondContact O-N 3.1Å; S170-A173 VanDerWaalsContact O-N 3.15Å; A173-L175 VanDerWaalsContact C-N 3.31Å; A173-L175 PolarHBondContact O-N 2.75Å; A173-N176 PolarHBondContact O-N 2.71Å |
| 174 | G | 38.4 | Very low | 40.9 | Very low | 49 Ų | 49 | 127.4 Ų | 127.4 | 51% | 0.505 | 70% | 0.701 | S | S | . | * | H | α-helix | trans | -61.3 | -32.7 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | N176 A177 | G174-N176 VanDerWaalsContact C-N 3.26Å; G174-N176 PolarHBondContact O-N 3.35Å; G174-A177 PolarHBondContact O-N 3.01Å |
| 175 | L | 41.2 | Very low | 41.1 | Very low | 120 Ų | 120 | 130.9 Ų | 130.9 | 63% | 0.628 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -73.3 | -12.2 | -178.9 | -74.7 | 168.5 | 0 | 0 | 0 | 114.6 | A173 | A173-L175 VanDerWaalsContact C-N 3.31Å; A173-L175 PolarHBondContact O-N 2.75Å |
| 176 | N | 41.9 | Very low | 41.9 | Very low | 119 Ų | 119 | 130.8 Ų | 130.8 | 64% | 0.636 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -96.9 | -13.7 | 178.6 | -68.4 | -69.2 | 0 | 0 | 0 | 113.2 | W172 A173 G174 | W172-N176 PolarHBondContact O-ND2 3.36Å; A173-N176 PolarHBondContact O-N 2.71Å; G174-N176 VanDerWaalsContact C-N 3.26Å; G174-N176 PolarHBondContact O-N 3.35Å |
| 177 | A | 43.8 | Very low | 42.5 | Very low | 74 Ų | 74 | 127.3 Ų | 127.3 | 61% | 0.612 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -76 | -36.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | G174 L179 | G174-A177 PolarHBondContact O-N 3.01Å; A177-L179 PolarHBondContact O-N 2.81Å |
| 178 | D | 43.3 | Very low | 42.6 | Very low | 155 Ų | 155 | 124.4 Ų | 124.4 | 83% | 0.829 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | 4.7 | -178.2 | -76.4 | -19.1 | 0 | 0 | 0 | 114.4 | ||
| 179 | L | 47.2 | Very low | 42.9 | Very low | 144 Ų | 144 | 125.3 Ų | 125.3 | 75% | 0.754 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112 | 5.1 | -172 | -113.6 | 158.3 | 0 | 0 | 0 | 114.5 | A177 | A177-L179 PolarHBondContact O-N 2.81Š|
| 180 | D | 43.4 | Very low | 43.5 | Very low | 149 Ų | 149 | 122.6 Ų | 122.6 | 80% | 0.797 | 68% | 0.68 | S | S | * | * | trans | -115.9 | 21.9 | -179.2 | -131.3 | -4.3 | 0 | 0 | 0 | 113.1 | G182 | D180-G182 PolarHBondContact O-N 2.82Š| ||
| 181 | D | 45.9 | Very low | 43.5 | Very low | 117 Ų | 117 | 127.6 Ų | 127.6 | 63% | 0.626 | 69% | 0.694 | S | S | * | * | trans | -72.4 | 93.1 | 164.9 | -169.6 | 32.6 | 0 | 0 | 0 | 108.7 | R183 | D181-R183 PolarHBondContact O-N 3.24Å; D181-R183 IonicContact OD2-CZ 3.74Å; D181-R183 IonicContact OD2-NE 3.83Å; D181-R183 PolarHBondContact OD2-NE 3.07Å; D181-R183 IonicContact OD2-NH2 3.32Å | ||
| 182 | G | 45.4 | Very low | 43.8 | Very low | 72 Ų | 72 | 125.5 Ų | 125.5 | 74% | 0.742 | 70% | 0.695 | S | S | * | * | trans | -68.1 | 54.2 | -167.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | D180 S184 | D180-G182 PolarHBondContact O-N 2.82Å; G182-S184 PolarHBondContact O-N 3.33Å; G182-S184 VanDerWaalsContact O-N 3.11Å | ||
| 183 | R | 44 | Very low | 44.1 | Very low | 209 Ų | 209 | 122.2 Ų | 122.2 | 79% | 0.789 | 70% | 0.699 | S | S | * | * | trans | -78.7 | 89.8 | 173.5 | -62.9 | -172.8 | -171.3 | -138.3 | -1.6 | 111.1 | D181 F185 | D181-R183 PolarHBondContact O-N 3.24Å; D181-R183 IonicContact OD2-CZ 3.74Å; D181-R183 IonicContact OD2-NE 3.83Å; D181-R183 PolarHBondContact OD2-NE 3.07Å; D181-R183 IonicContact OD2-NH2 3.32Å; R183-F185 PolarHBondContact O-N 2.97Å; R183-F185 VanDerWaalsContact O-N 3.13Å | ||
| 184 | S | 38.2 | Very low | 44.5 | Very low | 105 Ų | 105 | 124.4 Ų | 124.4 | 73% | 0.734 | 71% | 0.707 | S | S | * | * | trans | -64.3 | 107.3 | 164.6 | 55.8 | 0 | 0 | 0 | 0 | 110.1 | G182 T186 | G182-S184 PolarHBondContact O-N 3.33Å; G182-S184 VanDerWaalsContact O-N 3.11Å; S184-T186 PolarHBondContact O-N 2.95Å; S184-T186 VanDerWaalsContact O-N 3.09Å | ||
| 185 | F | 41.5 | Very low | 44.9 | Very low | 183 Ų | 183 | 127.6 Ų | 127.6 | 80% | 0.803 | 72% | 0.719 | S | S | * | * | trans | -75.7 | 95 | 172.6 | -174.4 | -95.4 | 0 | 0 | 0 | 110 | R183 Y187 | R183-F185 PolarHBondContact O-N 2.97Å; R183-F185 VanDerWaalsContact O-N 3.13Å; F185-Y187 HydrophobicContact CE1-CD2 4.28Å; F185-Y187 HydrophobicContact CZ-CD2 4.46Å | ||
| 186 | T | 46.3 | Very low | 45.2 | Very low | 119 Ų | 119 | 127 Ų | 127 | 73% | 0.73 | 72% | 0.723 | S | S | * | * | trans | -88.7 | 117.8 | 167.8 | -55.3 | 0 | 0 | 0 | 0 | 108.2 | S184 D188 | S184-T186 PolarHBondContact O-N 2.95Å; S184-T186 VanDerWaalsContact O-N 3.09Å; T186-D188 PolarHBondContact O-N 3.37Å | ||
| 187 | Y | 44.4 | Very low | 45.1 | Very low | 177 Ų | 177 | 128.6 Ų | 128.6 | 69% | 0.694 | 73% | 0.731 | S | S | * | * | trans | -79.1 | 107.5 | 174.4 | -178 | -93.1 | 0 | 0 | 0 | 109.4 | F185 P189 | F185-Y187 HydrophobicContact CE1-CD2 4.28Å; F185-Y187 HydrophobicContact CZ-CD2 4.46Å; Y187-P189 HydrophobicContact CD1-CB 4.49Å; Y187-P189 HydrophobicContact CE1-CB 3.98Å | ||
| 188 | D | 43.4 | Very low | 45 | Very low | 99 Ų | 99 | 135 Ų | 135 | 53% | 0.529 | 75% | 0.745 | S | S | . | * | trans | -87.9 | 117.4 | 167.9 | -168.8 | -30.4 | 0 | 0 | 0 | 108.8 | T186 T190 | T186-D188 PolarHBondContact O-N 3.37Å; D188-T190 PolarHBondContact O-N 3.23Å; D188-T190 WeakPolarHBondContact OD1-CB 3.36Å; D188-T190 PolarHBondContact OD1-N 2.84Å; D188-T190 PolarHBondContact OD1-OG1 2.92Å | ||
| 189 | P | 43.7 | Very low | 44.8 | Very low | 103 Ų | 103 | 137.2 Ų | 137.2 | 67% | 0.669 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.1 | 5.2 | -179.2 | 31.7 | -36.2 | 0 | 0 | 0 | 114.4 | Y187 | Y187-P189 HydrophobicContact CD1-CB 4.49Å; Y187-P189 HydrophobicContact CE1-CB 3.98Å |
| 190 | T | 53.3 | Low | 44.6 | Very low | 113 Ų | 113 | 134.7 Ų | 134.7 | 69% | 0.693 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99 | -14.1 | -168.7 | -33.6 | 0 | 0 | 0 | 0 | 114.5 | D188 A192 | D188-T190 PolarHBondContact O-N 3.23Å; D188-T190 WeakPolarHBondContact OD1-CB 3.36Å; D188-T190 PolarHBondContact OD1-N 2.84Å; D188-T190 PolarHBondContact OD1-OG1 2.92Å; T190-A192 PolarHBondContact O-N 3.49Å; T190-A192 VanDerWaalsContact O-N 3.14Å |
| 191 | E | 43.7 | Very low | 44.5 | Very low | 187 Ų | 187 | 133.4 Ų | 133.4 | 87% | 0.874 | 75% | 0.75 | S | S | * | * | trans | -87.8 | 69.4 | 177.6 | -74 | -162.8 | 138.8 | 0 | 0 | 113.3 | ||||
| 192 | A | 45.4 | Very low | 44.8 | Very low | 80 Ų | 80 | 133.4 Ų | 133.4 | 66% | 0.661 | 76% | 0.756 | S | S | * | * | trans | -144.5 | 102.7 | 159 | 0 | 0 | 0 | 0 | 0 | 109.5 | T190 | T190-A192 PolarHBondContact O-N 3.49Å; T190-A192 VanDerWaalsContact O-N 3.14Å | ||
| 193 | P | 47.9 | Very low | 44.7 | Very low | 126 Ų | 126 | 135.7 Ų | 135.7 | 82% | 0.818 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -64 | 130.7 | 171.5 | 27 | -32.3 | 0 | 0 | 0 | 108.9 | ||
| 194 | P | 51.8 | Low | 44.7 | Very low | 113 Ų | 113 | 131.9 Ų | 131.9 | 73% | 0.734 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 149.5 | 176.3 | 27.5 | -33.9 | 0 | 0 | 0 | 110.3 | ||
| 195 | P | 47.4 | Very low | 44.7 | Very low | 116 Ų | 116 | 136.3 Ų | 136.3 | 75% | 0.753 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 144.5 | 174.3 | 27.2 | -34.4 | 0 | 0 | 0 | 110.2 | ||
| 196 | P | 46.3 | Very low | 44.5 | Very low | 108 Ų | 108 | 136.3 Ų | 136.3 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -65 | 160.6 | 173.8 | 29.9 | -34.6 | 0 | 0 | 0 | 110.7 | ||
| 197 | D | 41.3 | Very low | 44 | Very low | 152 Ų | 152 | 138.2 Ų | 138.2 | 81% | 0.813 | 78% | 0.777 | S | S | * | * | trans | 70.7 | 72.6 | 170.4 | -49.4 | -26.3 | 0 | 0 | 0 | 116.5 | ||||
| 198 | K | 41.4 | Very low | 43.7 | Very low | 207 Ų | 207 | 134.3 Ų | 134.3 | 90% | 0.9 | 78% | 0.782 | S | S | * | * | trans | -155.3 | 116.2 | 134.2 | -108.4 | 156.2 | -170.1 | 174.7 | 0 | 111 | ||||
| 199 | E | 39.1 | Very low | 43.7 | Very low | 202 Ų | 202 | 135.2 Ų | 135.2 | 94% | 0.944 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 138.4 | -176.5 | -62.6 | 167.5 | 134 | 0 | 0 | 111.6 | ||
| 200 | A | 42.7 | Very low | 43.8 | Very low | 91 Ų | 91 | 135.8 Ų | 135.8 | 75% | 0.752 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -95.8 | 143.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 201 | P | 40.8 | Very low | 43.4 | Very low | 122 Ų | 122 | 136.3 Ų | 136.3 | 79% | 0.792 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -74 | 146.8 | 175.6 | -10.5 | 26.3 | 0 | 0 | 0 | 112.5 | ||
| 202 | P | 52.3 | Low | 42.8 | Very low | 117 Ų | 117 | 130.5 Ų | 130.5 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 162.9 | 177.3 | 30.3 | -35.1 | 0 | 0 | 0 | 113.7 | ||
| 203 | P | 44.7 | Very low | 42 | Very low | 121 Ų | 121 | 136.4 Ų | 136.4 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -77 | 158.7 | -171.8 | 31.8 | -37.2 | 0 | 0 | 0 | 114.3 | ||
| 204 | P | 42.4 | Very low | 41.3 | Very low | 129 Ų | 129 | 137.2 Ų | 137.2 | 84% | 0.838 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -92.4 | 123.6 | 179.6 | 34.3 | -31.2 | 0 | 0 | 0 | 113.3 | ||
| 205 | E | 39.7 | Very low | 40.6 | Very low | 197 Ų | 197 | 139.5 Ų | 139.5 | 92% | 0.921 | 81% | 0.805 | S | S | * | * | trans | -109.7 | 163.7 | 157.2 | -89.3 | -171.5 | 161.5 | 0 | 0 | 110.9 | ||||
| 206 | E | 35.4 | Very low | 40.2 | Very low | 184 Ų | 184 | 140.8 Ų | 140.8 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | trans | -65.7 | 135.3 | -163.4 | -52.7 | 176.3 | 104.7 | 0 | 0 | 115.4 | ||||
| 207 | L | 36.4 | Very low | 39.3 | Very low | 158 Ų | 158 | 143.4 Ų | 143.4 | 83% | 0.827 | 81% | 0.807 | S | S | * | * | -177.7 | 119.3 | 111 | -127.8 | 66.4 | 0 | 0 | 0 | 113.7 | |||||
| 208 | A | 38.7 | Very low | 39.1 | Very low | 96 Ų | 96 | 144.5 Ų | 144.5 | 79% | 0.793 | 81% | 0.807 | S | S | * | * | trans | 47.3 | 156 | 145.3 | 0 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 209 | P | 43 | Very low | 38.7 | Very low | 118 Ų | 118 | 142 Ų | 142 | 77% | 0.766 | 80% | 0.798 | S | S | * | * | trans | -120 | -157.4 | -154.8 | 47.6 | -35.5 | 0 | 0 | 0 | 113.2 | ||||
| 210 | P | 46.5 | Very low | 38.5 | Very low | 114 Ų | 114 | 140.1 Ų | 140.1 | 74% | 0.74 | 79% | 0.793 | S | S | * | * | cis | -126.1 | -144.4 | -20.1 | 43.7 | -26.1 | 0 | 0 | 0 | 109.9 | ||||
| 211 | P | 44.2 | Very low | 37.8 | Very low | 125 Ų | 125 | 141 Ų | 141 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | cis | -118 | 176.3 | -34.8 | 38.2 | -23.4 | 0 | 0 | 0 | 111.8 | ||||
| 212 | G | 30.6 | Very low | 37.3 | Very low | 64 Ų | 64 | 141.1 Ų | 141.1 | 66% | 0.66 | 80% | 0.796 | S | S | * | * | cis | 165.8 | 176.6 | -0.6 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 213 | K | 30.3 | Very low | 36.3 | Very low | 204 Ų | 204 | 144 Ų | 144 | 89% | 0.887 | 80% | 0.8 | S | S | * | * | trans | 73.1 | 136.4 | -175.2 | -57.5 | -179.3 | 178.7 | 177.8 | 0 | 115.4 | ||||
| 214 | L | 32.8 | Very low | 35.7 | Very low | 144 Ų | 144 | 145.6 Ų | 145.6 | 75% | 0.754 | 80% | 0.8 | S | S | * | * | cis | 171 | 124.9 | -15.7 | -114.8 | 168.3 | 0 | 0 | 0 | 102.9 | ||||
| 215 | L | 36.2 | Very low | 35 | Very low | 161 Ų | 161 | 144.9 Ų | 144.9 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | 177.1 | 91.5 | 136.4 | -96.7 | 169.6 | 0 | 0 | 0 | 111.5 | ||||
| 216 | I | 38.6 | Very low | 34.6 | Very low | 142 Ų | 142 | 144.4 Ų | 144.4 | 73% | 0.728 | 80% | 0.796 | S | S | * | * | trans | 41.7 | 114.2 | 136.6 | -55.2 | 172.5 | 0 | 0 | 0 | 118.2 | ||||
| 217 | Q | 29.2 | Very low | 34.4 | Very low | 164 Ų | 164 | 141.4 Ų | 141.4 | 77% | 0.766 | 80% | 0.795 | S | S | * | * | trans | -122.2 | 122.9 | 168.6 | 163.7 | -172.1 | -14.6 | 0 | 0 | 108.1 | ||||
| 218 | E | 36.8 | Very low | 34 | Very low | 175 Ų | 175 | 140 Ų | 140 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -144.8 | 103.5 | 163.4 | -65.3 | -174.2 | 147.2 | 0 | 0 | 105.4 | ||||
| 219 | E | 31.6 | Very low | 33.7 | Very low | 154 Ų | 154 | 143.4 Ų | 143.4 | 72% | 0.72 | 79% | 0.793 | S | S | * | * | 51.8 | 93.4 | 78.6 | -69.3 | -160.3 | 169.9 | 0 | 0 | 114.7 | |||||
| 220 | I | 35.8 | Very low | 33 | Very low | 162 Ų | 162 | 148.2 Ų | 148.2 | 83% | 0.831 | 80% | 0.796 | S | S | * | * | trans | -132.7 | 102.9 | 148.2 | -58.3 | -177.5 | 0 | 0 | 0 | 108.5 | ||||
| 221 | C | 27.8 | Very low | 32 | Very low | 110 Ų | 110 | 151.3 Ų | 151.3 | 74% | 0.743 | 80% | 0.798 | S | S | * | * | trans | -63.6 | 134.1 | 170.5 | -68.9 | 0 | 0 | 0 | 0 | 111 | E223 | C221-E223 PolarHBondContact O-N 2.91Š| ||
| 222 | S | 30.5 | Very low | 31.4 | Very low | 124 Ų | 124 | 150.4 Ų | 150.4 | 87% | 0.867 | 79% | 0.79 | S | S | * | * | trans | -96.8 | 75 | 164.8 | -68 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 223 | E | 30.1 | Very low | 31.4 | Very low | 179 Ų | 179 | 155.2 Ų | 155.2 | 84% | 0.836 | 80% | 0.795 | S | S | * | * | trans | -82.5 | 137.6 | 173.5 | -168.7 | 171.3 | -170.7 | 0 | 0 | 111.3 | C221 | C221-E223 PolarHBondContact O-N 2.91Š| ||
| 224 | I | 33.2 | Very low | 31.5 | Very low | 154 Ų | 154 | 151.5 Ų | 151.5 | 79% | 0.79 | 80% | 0.795 | S | S | * | * | trans | -80.1 | 124.6 | -178 | -63.7 | 157.6 | 0 | 0 | 0 | 109 | ||||
| 225 | S | 27.4 | Very low | 31.6 | Very low | 113 Ų | 113 | 151.8 Ų | 151.8 | 79% | 0.79 | 80% | 0.797 | S | S | * | * | trans | -131.2 | 115.5 | 163.7 | 55.7 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 226 | Q | 30.8 | Very low | 31.2 | Very low | 187 Ų | 187 | 150 Ų | 150 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | -78.6 | 133.8 | 159.6 | -60.6 | 171.5 | 3.2 | 0 | 0 | 107.7 | ||||
| 227 | S | 31.1 | Very low | 31 | Very low | 122 Ų | 122 | 146.1 Ų | 146.1 | 85% | 0.853 | 79% | 0.793 | S | S | * | * | trans | -144.4 | 135.9 | 153 | 68.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 228 | T | 29 | Very low | 31.3 | Very low | 129 Ų | 129 | 146.8 Ų | 146.8 | 79% | 0.791 | 80% | 0.801 | S | S | * | * | trans | -123.9 | 116.4 | 179.7 | -76.4 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 229 | Q | 31.4 | Very low | 31.2 | Very low | 167 Ų | 167 | 143.7 Ų | 143.7 | 78% | 0.78 | 80% | 0.799 | S | S | * | * | trans | 160 | 117.3 | 156.4 | -90.7 | 158.2 | 16.7 | 0 | 0 | 107.2 | ||||
| 230 | R | 28.6 | Very low | 31.4 | Very low | 218 Ų | 218 | 145.3 Ų | 145.3 | 82% | 0.823 | 81% | 0.806 | S | S | * | * | 73.7 | 143.3 | 79.4 | -76 | -171.1 | 178.3 | 161.4 | -0.4 | 113.8 | |||||
| 231 | F | 26.4 | Very low | 31.6 | Very low | 179 Ų | 179 | 143.9 Ų | 143.9 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | trans | 88.5 | 100.5 | 167.5 | -82.4 | -84.1 | 0 | 0 | 0 | 119.9 | ||||
| 232 | T | 31.2 | Very low | 32.6 | Very low | 106 Ų | 106 | 144 Ų | 144 | 65% | 0.65 | 80% | 0.804 | S | S | * | * | trans | 65.6 | 111.7 | 130.6 | 49.3 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 233 | Q | 31.5 | Very low | 33.4 | Very low | 165 Ų | 165 | 143.5 Ų | 143.5 | 77% | 0.771 | 80% | 0.798 | S | S | * | * | 62.2 | 75.1 | 116 | -160.8 | 174.9 | 8.2 | 0 | 0 | 117.2 | |||||
| 234 | S | 30.5 | Very low | 34 | Very low | 127 Ų | 127 | 140.5 Ų | 140.5 | 89% | 0.888 | 79% | 0.794 | S | S | * | * | trans | -72.9 | 123.4 | 157 | 54.5 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 235 | L | 36.1 | Very low | 34.3 | Very low | 149 Ų | 149 | 138.8 Ų | 138.8 | 78% | 0.78 | 79% | 0.793 | S | S | * | * | trans | -137.2 | 140.3 | 169.7 | -159.6 | 150.6 | 0 | 0 | 0 | 107.9 | ||||
| 236 | S | 28.5 | Very low | 34.9 | Very low | 123 Ų | 123 | 137.7 Ų | 137.7 | 86% | 0.86 | 79% | 0.791 | S | S | * | * | trans | 79.8 | 123.5 | -166.9 | -156.6 | 0 | 0 | 0 | 0 | 114 | ||||
| 237 | G | 32.5 | Very low | 35.2 | Very low | 62 Ų | 62 | 138.4 Ų | 138.4 | 64% | 0.639 | 79% | 0.792 | S | S | * | * | cis | 175.8 | 175.4 | -5.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 238 | L | 35.8 | Very low | 35.7 | Very low | 177 Ų | 177 | 143.5 Ų | 143.5 | 93% | 0.927 | 79% | 0.793 | S | S | * | * | trans | 87.2 | 144.6 | 168.3 | -52.5 | 176.5 | 0 | 0 | 0 | 119.6 | ||||
| 239 | S | 35.7 | Very low | 35.8 | Very low | 111 Ų | 111 | 142.7 Ų | 142.7 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | trans | 67.4 | 62.6 | 174.5 | 67.2 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 240 | E | 35.4 | Very low | 36.4 | Very low | 188 Ų | 188 | 140.5 Ų | 140.5 | 88% | 0.879 | 80% | 0.795 | S | S | * | * | 27.5 | 96.4 | 111 | -166.4 | 162.9 | -162 | 0 | 0 | 119.3 | |||||
| 241 | V | 39.8 | Very low | 37.1 | Very low | 131 Ų | 131 | 135.5 Ų | 135.5 | 79% | 0.794 | 79% | 0.792 | S | S | * | * | trans | -141.3 | 122 | 148.6 | -179.1 | 0 | 0 | 0 | 0 | 108 | P243 | V241-P243 WeakPolarHBondContact O-CD 3.27Š| ||
| 242 | P | 48.4 | Very low | 37.8 | Very low | 113 Ų | 113 | 136.2 Ų | 136.2 | 73% | 0.734 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 123 | -179 | 32.1 | -31.7 | 0 | 0 | 0 | 112.3 | ||
| 243 | P | 47.7 | Very low | 38.4 | Very low | 113 Ų | 113 | 135.3 Ų | 135.3 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 153.5 | 164.6 | 32 | -32.9 | 0 | 0 | 0 | 111.5 | V241 | V241-P243 WeakPolarHBondContact O-CD 3.27Š|
| 244 | P | 42.1 | Very low | 39.4 | Very low | 117 Ų | 117 | 132.9 Ų | 132.9 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 154.7 | -177.4 | 27.2 | -35 | 0 | 0 | 0 | 113.1 | A246 | P244-A246 PolarHBondContact O-N 3.4Š|
| 245 | P | 41.4 | Very low | 40.3 | Very low | 117 Ų | 117 | 132.6 Ų | 132.6 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | trans | -70.1 | 114.2 | -170.2 | 27.5 | -34.8 | 0 | 0 | 0 | 112.3 | F247 | P245-F247 PolarHBondContact O-N 3.47Š| ||
| 246 | A | 39.8 | Very low | 41.1 | Very low | 91 Ų | 91 | 134 Ų | 134 | 75% | 0.752 | 80% | 0.798 | S | S | * | * | trans | -67.2 | 120.5 | 166 | 0 | 0 | 0 | 0 | 0 | 109.6 | P244 Y248 | P244-A246 PolarHBondContact O-N 3.4Å; A246-Y248 PolarHBondContact O-N 3.36Å | ||
| 247 | F | 36.2 | Very low | 42.6 | Very low | 202 Ų | 202 | 133.5 Ų | 133.5 | 89% | 0.886 | 79% | 0.791 | S | S | * | * | trans | -59.4 | 130.5 | 176.3 | -72.7 | -96.6 | 0 | 0 | 0 | 110.7 | P245 S249 | P245-F247 PolarHBondContact O-N 3.47Å; F247-S249 PolarHBondContact O-N 2.96Å | ||
| 248 | Y | 41.9 | Very low | 43.8 | Very low | 228 Ų | 228 | 136.7 Ų | 136.7 | 89% | 0.894 | 80% | 0.8 | S | S | * | * | trans | -61.8 | 106.6 | 174.4 | -75.8 | -94.5 | 0 | 0 | 0 | 110.4 | A246 C250 | A246-Y248 PolarHBondContact O-N 3.36Å; Y248-C250 PolarHBondContact O-N 3.25Å | ||
| 249 | S | 31.6 | Very low | 45.1 | Very low | 112 Ų | 112 | 131 Ų | 131 | 78% | 0.783 | 79% | 0.785 | S | S | * | * | trans | -74 | 82.9 | 164.4 | -169.5 | 0 | 0 | 0 | 0 | 109.3 | F247 C251 | F247-S249 PolarHBondContact O-N 2.96Å; S249-C251 VanDerWaalsContact C-N 3.25Å; S249-C251 PolarHBondContact O-N 2.96Å | ||
| 250 | C | 42.8 | Very low | 46.6 | Very low | 121 Ų | 121 | 131.1 Ų | 131.1 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | trans | -71.7 | 81.3 | 170 | -175.3 | 0 | 0 | 0 | 0 | 109.4 | Y248 | Y248-C250 PolarHBondContact O-N 3.25Š| ||
| 251 | C | 44.3 | Very low | 48.8 | Very low | 113 Ų | 113 | 126.3 Ų | 126.3 | 76% | 0.764 | 76% | 0.76 | S | S | * | * | trans | -166.4 | 73 | 169.3 | -98.8 | 0 | 0 | 0 | 0 | 110.5 | S249 | S249-C251 VanDerWaalsContact C-N 3.25Å; S249-C251 PolarHBondContact O-N 2.96Å | ||
| 252 | Q | 41.4 | Very low | 50.6 | Low | 195 Ų | 195 | 126.5 Ų | 126.5 | 91% | 0.911 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -88 | 118 | 156.9 | -71 | -147.7 | -9.8 | 0 | 0 | 108.6 | ||
| 253 | A | 43.2 | Very low | 51.9 | Low | 87 Ų | 87 | 129 Ų | 129 | 72% | 0.719 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 143.9 | 168.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||
| 254 | P | 53.3 | Low | 53.6 | Low | 113 Ų | 113 | 125.3 Ų | 125.3 | 73% | 0.734 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 142.5 | 177.1 | 26.6 | -34.3 | 0 | 0 | 0 | 109.8 | E256 | P254-E256 PolarHBondContact O-N 2.84Š|
| 255 | P | 49.3 | Very low | 55.5 | Low | 122 Ų | 122 | 123.5 Ų | 123.5 | 79% | 0.792 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 124.3 | 176.7 | 25.6 | -33.2 | 0 | 0 | 0 | 109.1 | ||
| 256 | E | 52.7 | Low | 57.4 | Low | 179 Ų | 179 | 122.6 Ų | 122.6 | 84% | 0.836 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 137 | 172.7 | -68.9 | -166.7 | 151.3 | 0 | 0 | 109.2 | P254 | P254-E256 PolarHBondContact O-N 2.84Š|
| 257 | P | 58.3 | Low | 59.6 | Low | 111 Ų | 111 | 123.8 Ų | 123.8 | 72% | 0.721 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 139.2 | 176.8 | 26 | -33.9 | 0 | 0 | 0 | 108.5 | G259 | P257-G259 PolarHBondContact O-N 3.38Š|
| 258 | P | 58.7 | Low | 62 | Low | 129 Ų | 129 | 118.5 Ų | 118.5 | 84% | 0.838 | 68% | 0.677 | S | S | * | * | trans | -60.3 | 99.3 | -175.7 | 24.1 | -33.9 | 0 | 0 | 0 | 109.6 | L260 | P258-L260 PolarHBondContact O-N 2.68Š| ||
| 259 | G | 62.8 | Low | 64 | Low | 59 Ų | 59 | 109.4 Ų | 109.4 | 61% | 0.608 | 64% | 0.644 | S | S | * | * | trans | -54.8 | 133.1 | -175.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | P257 T261 | P257-G259 PolarHBondContact O-N 3.38Å; G259-T261 PolarHBondContact O-N 3.08Å | ||
| 260 | L | 67.8 | Low | 66.4 | Low | 112 Ų | 112 | 110.4 Ų | 110.4 | 59% | 0.586 | 63% | 0.634 | S | S | * | * | trans | -49 | 107 | -180 | -178.7 | 75.2 | 0 | 0 | 0 | 108.4 | P258 M262 A264 L265 | P258-L260 PolarHBondContact O-N 2.68Å; L260-M262 PolarHBondContact O-N 2.85Å; L260-A264 HydrophobicContact CD1-CB 3.73Å; L260-A264 HydrophobicContact CG-CB 4.16Å; L260-L265 HydrophobicContact CD2-CB 3.89Å; L260-L265 HydrophobicContact CD2-CD1 4.26Å; L260-L265 HydrophobicContact CD2-CG 3.9Å; L260-L265 HydrophobicContact CG-CB 4.41Å | ||
| 261 | T | 80.6 | Confident | 68.4 | Low | 88 Ų | 88 | 107.1 Ų | 107.1 | 54% | 0.54 | 61% | 0.612 | S | S | . | * | trans | -57.7 | 142 | -170.3 | 68.3 | 0 | 0 | 0 | 0 | 109.1 | G259 K263 A264 L265 | G259-T261 PolarHBondContact O-N 3.08Å; T261-K263 CarbonylContact O-C 3.57Å; T261-K263 PolarHBondContact O-N 3.25Å; T261-A264 WeakPolarHBondContact O-CA 3.22Å; T261-A264 WeakPolarHBondContact O-CB 3.35Å; T261-A264 PolarHBondContact O-N 2.88Å; T261-A264 PolarHBondContact OG1-N 2.98Å; T261-L265 PolarHBondContact O-N 2.92Å; T261-L265 VanDerWaalsContact O-N 3.09Å | ||
| 262 | M | 78.1 | Confident | 70.3 | Confident | 135 Ų | 135 | 106.5 Ų | 106.5 | 67% | 0.665 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -50 | -31.1 | -179.5 | -173.7 | -175.5 | -178.4 | 0 | 0 | 112.3 | L260 L266 | L260-M262 PolarHBondContact O-N 2.85Å; M262-L266 HydrophobicContact CG-CD1 4.36Å; M262-L266 VanDerWaalsContact O-CG 3.25Å; M262-L266 WeakPolarHBondContact O-CG 3.48Å; M262-L266 PolarHBondContact O-N 3.44Å |
| 263 | K | 76.3 | Confident | 72.1 | Confident | 166 Ų | 166 | 100.6 Ų | 100.6 | 72% | 0.722 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -65.1 | -46.9 | 172.8 | -62.3 | -178 | 179.6 | 178.9 | 0 | 113.2 | T261 L265 L266 I267 | T261-K263 CarbonylContact O-C 3.57Å; T261-K263 PolarHBondContact O-N 3.25Å; K263-L265 VanDerWaalsContact C-N 3.32Å; K263-L265 PolarHBondContact O-N 3.14Å; K263-L266 PolarHBondContact O-N 3.27Å; K263-I267 WeakPolarHBondContact O-CD1 3.46Å; K263-I267 VanDerWaalsContact O-CG1 3.24Å; K263-I267 WeakPolarHBondContact O-CG1 3.32Å; K263-I267 PolarHBondContact O-N 3.36Å |
| 264 | A | 82.8 | Confident | 73.9 | Confident | 35 Ų | 35 | 100 Ų | 100 | 29% | 0.289 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.3 | -38.5 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | L260 T261 I267 L268 | L260-A264 HydrophobicContact CD1-CB 3.73Å; L260-A264 HydrophobicContact CG-CB 4.16Å; T261-A264 WeakPolarHBondContact O-CA 3.22Å; T261-A264 WeakPolarHBondContact O-CB 3.35Å; T261-A264 PolarHBondContact O-N 2.88Å; T261-A264 PolarHBondContact OG1-N 2.98Å; A264-I267 PolarHBondContact O-N 2.81Å; A264-L268 WeakPolarHBondContact O-CB 3.24Å; A264-L268 PolarHBondContact O-N 3.42Å |
| 265 | L | 81.5 | Confident | 75.2 | Confident | 78 Ų | 78 | 98.8 Ų | 98.8 | 41% | 0.408 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.8 | -46.1 | 175.2 | -153.7 | 168.5 | 0 | 0 | 0 | 111.2 | L260 T261 K263 I267 L268 I269 | L260-L265 HydrophobicContact CD2-CB 3.89Å; L260-L265 HydrophobicContact CD2-CD1 4.26Å; L260-L265 HydrophobicContact CD2-CG 3.9Å; L260-L265 HydrophobicContact CG-CB 4.41Å; T261-L265 PolarHBondContact O-N 2.92Å; T261-L265 VanDerWaalsContact O-N 3.09Å; K263-L265 VanDerWaalsContact C-N 3.32Å; K263-L265 PolarHBondContact O-N 3.14Å; L265-I267 PolarHBondContact O-N 3.36Å; L265-L268 PolarHBondContact O-N 3.3Å; L265-I269 HydrophobicContact CD2-CD1 3.39Å; L265-I269 HydrophobicContact CD2-CG1 4.03Å; L265-I269 WeakPolarHBondContact O-CG1 3.48Å; L265-I269 PolarHBondContact O-N 2.85Å |
| 266 | L | 82.4 | Confident | 76.5 | Confident | 99 Ų | 99 | 94.7 Ų | 94.7 | 52% | 0.518 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.3 | -40 | 175.2 | -71.8 | 168.9 | 0 | 0 | 0 | 113.2 | M262 K263 L268 I269 F270 | M262-L266 HydrophobicContact CG-CD1 4.36Å; M262-L266 VanDerWaalsContact O-CG 3.25Å; M262-L266 WeakPolarHBondContact O-CG 3.48Å; M262-L266 PolarHBondContact O-N 3.44Å; K263-L266 PolarHBondContact O-N 3.27Å; L266-L268 VanDerWaalsContact C-N 3.33Å; L266-I269 PolarHBondContact O-N 3.23Å; L266-F270 WeakPolarHBondContact O-CB 3.24Å; L266-F270 PolarHBondContact O-N 3.28Å |
| 267 | I | 85.8 | Confident | 77.5 | Confident | 116 Ų | 116 | 88.3 Ų | 88.3 | 60% | 0.595 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -63.5 | -40.1 | 175.4 | -69.9 | 163 | 0 | 0 | 0 | 110.8 | K263 A264 L265 F270 S271 | K263-I267 WeakPolarHBondContact O-CD1 3.46Å; K263-I267 VanDerWaalsContact O-CG1 3.24Å; K263-I267 WeakPolarHBondContact O-CG1 3.32Å; K263-I267 PolarHBondContact O-N 3.36Å; A264-I267 PolarHBondContact O-N 2.81Å; L265-I267 PolarHBondContact O-N 3.36Å; I267-F270 PolarHBondContact O-N 3.26Å; I267-S271 PolarHBondContact O-N 2.88Å; I267-S271 PolarHBondContact O-OG 3.28Å |
| 268 | L | 86.9 | Confident | 78.4 | Confident | 90 Ų | 90 | 89.3 Ų | 89.3 | 47% | 0.471 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67.4 | -38.8 | 177.5 | 180 | 146.4 | 0 | 0 | 0 | 112.6 | A264 L265 L266 F270 S271 I272 | A264-L268 WeakPolarHBondContact O-CB 3.24Å; A264-L268 PolarHBondContact O-N 3.42Å; L265-L268 PolarHBondContact O-N 3.3Å; L266-L268 VanDerWaalsContact C-N 3.33Å; L268-F270 VanDerWaalsContact C-N 3.34Å; L268-S271 PolarHBondContact O-OG 3.48Å; L268-I272 HydrophobicContact CD2-CD1 3.62Å; L268-I272 HydrophobicContact CG-CD1 4.23Å; L268-I272 WeakPolarHBondContact O-CD1 3.4Å; L268-I272 VanDerWaalsContact O-CG1 3.26Å; L268-I272 WeakPolarHBondContact O-CG1 3.48Å; L268-I272 PolarHBondContact O-N 3.25Å; L268-I272 VanDerWaalsContact O-N 3.13Å |
| 269 | I | 83.4 | Confident | 79.1 | Confident | 38 Ų | 38 | 93 Ų | 93 | 20% | 0.195 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -63.1 | -43.8 | 172.7 | -65.4 | 155.8 | 0 | 0 | 0 | 110.4 | L265 L266 I272 F273 I297 | L265-I269 HydrophobicContact CD2-CD1 3.39Å; L265-I269 HydrophobicContact CD2-CG1 4.03Å; L265-I269 WeakPolarHBondContact O-CG1 3.48Å; L265-I269 PolarHBondContact O-N 2.85Å; L266-I269 PolarHBondContact O-N 3.23Å; I269-I272 PolarHBondContact O-N 3.35Å; I269-F273 PolarHBondContact O-N 3.05Å; I269-I297 HydrophobicContact CD1-CD1 3.58Å; I269-I297 HydrophobicContact CG1-CD1 4.02Å; I269-I297 HydrophobicContact CG2-CD1 4.48Å |
| 270 | F | 82.3 | Confident | 79.5 | Confident | 132 Ų | 132 | 92.7 Ų | 92.7 | 58% | 0.579 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -67.4 | -37.5 | -178.6 | -173.6 | -112 | 0 | 0 | 0 | 112.8 | L266 I267 L268 F273 I274 | L266-F270 WeakPolarHBondContact O-CB 3.24Å; L266-F270 PolarHBondContact O-N 3.28Å; I267-F270 PolarHBondContact O-N 3.26Å; L268-F270 VanDerWaalsContact C-N 3.34Å; F270-F273 WeakPolarHBondContact O-CB 3.49Å; F270-F273 PolarHBondContact O-N 2.82Å; F270-I274 HydrophobicContact CD1-CD1 3.84Å; F270-I274 HydrophobicContact CE1-CD1 3.46Å; F270-I274 VanDerWaalsContact CE1-CD1 3.46Å; F270-I274 HydrophobicContact CE1-CG1 4.47Å; F270-I274 HydrophobicContact CE2-CD1 4.49Å; F270-I274 HydrophobicContact CZ-CD1 3.82Å; F270-I274 HydrophobicContact CZ-CG1 4.48Å; F270-I274 WeakPolarHBondContact O-CG1 3.35Å; F270-I274 PolarHBondContact O-N 3.26Å; F270-I274 VanDerWaalsContact O-N 3.09Å |
| 271 | S | 85.4 | Confident | 79.4 | Confident | 53 Ų | 53 | 91 Ų | 91 | 37% | 0.371 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -68.2 | -40.8 | 174.6 | 63.9 | 0 | 0 | 0 | 0 | 112.1 | I267 L268 F273 I274 I275 | I267-S271 PolarHBondContact O-N 2.88Å; I267-S271 PolarHBondContact O-OG 3.28Å; L268-S271 PolarHBondContact O-OG 3.48Å; S271-F273 VanDerWaalsContact C-N 3.29Å; S271-F273 PolarHBondContact O-N 2.89Å; S271-I274 PolarHBondContact O-N 3.36Å; S271-I275 WeakPolarHBondContact O-CB 3.35Å; S271-I275 WeakPolarHBondContact O-CD1 3.25Å; S271-I275 VanDerWaalsContact O-CG1 3.24Å; S271-I275 WeakPolarHBondContact O-CG1 3.45Å; S271-I275 PolarHBondContact O-N 3.29Å |
| 272 | I | 83.3 | Confident | 78.7 | Confident | 100 Ų | 100 | 89 Ų | 89 | 51% | 0.513 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.8 | -38.7 | 173.9 | -68.8 | 168.5 | 0 | 0 | 0 | 111.2 | L268 I269 I275 S276 | L268-I272 HydrophobicContact CD2-CD1 3.62Å; L268-I272 HydrophobicContact CG-CD1 4.23Å; L268-I272 WeakPolarHBondContact O-CD1 3.4Å; L268-I272 VanDerWaalsContact O-CG1 3.26Å; L268-I272 WeakPolarHBondContact O-CG1 3.48Å; L268-I272 PolarHBondContact O-N 3.25Å; L268-I272 VanDerWaalsContact O-N 3.13Å; I269-I272 PolarHBondContact O-N 3.35Å; I272-I275 PolarHBondContact O-N 3.25Å; I272-S276 WeakPolarHBondContact O-CB 3.31Å; I272-S276 PolarHBondContact O-N 2.9Å |
| 273 | F | 78.7 | Confident | 78 | Confident | 70 Ų | 70 | 86.7 Ų | 86.7 | 31% | 0.307 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.9 | -52.3 | 173.4 | 174.6 | -141.9 | 0 | 0 | 0 | 112.1 | I269 F270 S271 I275 S276 V277 S286 T290 | I269-F273 PolarHBondContact O-N 3.05Å; F270-F273 WeakPolarHBondContact O-CB 3.49Å; F270-F273 PolarHBondContact O-N 2.82Å; S271-F273 VanDerWaalsContact C-N 3.29Å; S271-F273 PolarHBondContact O-N 2.89Å; F273-I275 VanDerWaalsContact C-N 3.27Å; F273-I275 PolarHBondContact O-N 3.16Å; F273-S276 WeakPolarHBondContact O-CA 3.33Å; F273-S276 WeakPolarHBondContact O-CB 3.18Å; F273-S276 PolarHBondContact O-N 2.99Å; F273-V277 HydrophobicContact CD2-CG2 3.74Å; F273-V277 HydrophobicContact CE2-CG2 3.42Å; F273-V277 VanDerWaalsContact CE2-CG2 3.42Å; F273-V277 HydrophobicContact CZ-CG2 3.94Å; F273-V277 WeakPolarHBondContact O-CG2 3.37Å; F273-V277 PolarHBondContact O-N 3.49Å; F273-S286 WeakPolarHBondContact CE2-OG 3.33Å; F273-T290 HydrophobicContact CB-CG2 3.7Å; F273-T290 HydrophobicContact CD1-CG2 4.45Å; F273-T290 HydrophobicContact CD2-CG2 3.14Å; F273-T290 HydrophobicContact CE2-CG2 3.76Å; F273-T290 HydrophobicContact CG-CG2 3.53Å |
| 274 | I | 80.6 | Confident | 77.5 | Confident | 74 Ų | 74 | 89.2 Ų | 89.2 | 38% | 0.379 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -57.2 | -44.2 | 179.6 | -69.5 | 167.4 | 0 | 0 | 0 | 110.6 | F270 S271 S276 V277 L278 | F270-I274 HydrophobicContact CD1-CD1 3.84Å; F270-I274 HydrophobicContact CE1-CD1 3.46Å; F270-I274 VanDerWaalsContact CE1-CD1 3.46Å; F270-I274 HydrophobicContact CE1-CG1 4.47Å; F270-I274 HydrophobicContact CE2-CD1 4.49Å; F270-I274 HydrophobicContact CZ-CD1 3.82Å; F270-I274 HydrophobicContact CZ-CG1 4.48Å; F270-I274 WeakPolarHBondContact O-CG1 3.35Å; F270-I274 PolarHBondContact O-N 3.26Å; F270-I274 VanDerWaalsContact O-N 3.09Å; S271-I274 PolarHBondContact O-N 3.36Å; I274-S276 PolarHBondContact O-N 3.48Å; I274-V277 PolarHBondContact O-N 3.41Å; I274-L278 HydrophobicContact CG2-CD1 3.81Å; I274-L278 HydrophobicContact CG2-CG 4.39Å; I274-L278 VanDerWaalsContact O-CG 3.26Å; I274-L278 WeakPolarHBondContact O-CG 3.44Å; I274-L278 PolarHBondContact O-N 2.92Å |
| 275 | I | 80.9 | Confident | 76.8 | Confident | 89 Ų | 89 | 96.3 Ų | 96.3 | 46% | 0.456 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.6 | -45.1 | 175.8 | -67.3 | 165.5 | 0 | 0 | 0 | 110.5 | S271 I272 F273 V277 L278 Y279 | S271-I275 WeakPolarHBondContact O-CB 3.35Å; S271-I275 WeakPolarHBondContact O-CD1 3.25Å; S271-I275 VanDerWaalsContact O-CG1 3.24Å; S271-I275 WeakPolarHBondContact O-CG1 3.45Å; S271-I275 PolarHBondContact O-N 3.29Å; I272-I275 PolarHBondContact O-N 3.25Å; F273-I275 VanDerWaalsContact C-N 3.27Å; F273-I275 PolarHBondContact O-N 3.16Å; I275-V277 PolarHBondContact O-N 3.05Å; I275-L278 PolarHBondContact O-N 3.43Å; I275-Y279 HydrophobicContact CG2-CD2 3.68Å; I275-Y279 HydrophobicContact CG2-CE2 3.89Å; I275-Y279 WeakPolarHBondContact O-CD2 3.3Å; I275-Y279 PolarHBondContact O-N 2.97Å |
| 276 | S | 76.8 | Confident | 76.2 | Confident | 35 Ų | 35 | 92.6 Ų | 92.6 | 25% | 0.245 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -60.3 | -39.7 | 176.2 | 174.1 | 0 | 0 | 0 | 0 | 113.5 | I272 F273 I274 S280 S286 | I272-S276 WeakPolarHBondContact O-CB 3.31Å; I272-S276 PolarHBondContact O-N 2.9Å; F273-S276 WeakPolarHBondContact O-CA 3.33Å; F273-S276 WeakPolarHBondContact O-CB 3.18Å; F273-S276 PolarHBondContact O-N 2.99Å; I274-S276 PolarHBondContact O-N 3.48Å; S276-S280 WeakPolarHBondContact O-CB 3.27Å; S276-S280 PolarHBondContact O-N 3.01Å; S276-S280 PolarHBondContact O-OG 3.46Å; S276-S286 WeakPolarHBondContact CB-OG 3.5Å; S276-S286 PolarHBondContact OG-OG 2.96Å |
| 277 | V | 74.4 | Confident | 75.7 | Confident | 46 Ų | 46 | 90.3 Ų | 90.3 | 28% | 0.279 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.5 | -47.1 | 174.6 | 176.6 | 0 | 0 | 0 | 0 | 110.3 | F273 I274 I275 S286 | F273-V277 HydrophobicContact CD2-CG2 3.74Å; F273-V277 HydrophobicContact CE2-CG2 3.42Å; F273-V277 VanDerWaalsContact CE2-CG2 3.42Å; F273-V277 HydrophobicContact CZ-CG2 3.94Å; F273-V277 WeakPolarHBondContact O-CG2 3.37Å; F273-V277 PolarHBondContact O-N 3.49Å; I274-V277 PolarHBondContact O-N 3.41Å; I275-V277 PolarHBondContact O-N 3.05Å; V277-S286 VanDerWaalsContact CG2-OG 3.25Å; V277-S286 WeakPolarHBondContact CG2-OG 3.43Å; V277-S286 PolarHBondContact N-OG 3.44Å |
| 278 | L | 77.5 | Confident | 75.3 | Confident | 132 Ų | 132 | 91.5 Ų | 91.5 | 69% | 0.691 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -66.3 | -37.9 | -177 | -69.4 | 170.3 | 0 | 0 | 0 | 113.1 | I274 I275 | I274-L278 HydrophobicContact CG2-CD1 3.81Å; I274-L278 HydrophobicContact CG2-CG 4.39Å; I274-L278 VanDerWaalsContact O-CG 3.26Å; I274-L278 WeakPolarHBondContact O-CG 3.44Å; I274-L278 PolarHBondContact O-N 2.92Å; I275-L278 PolarHBondContact O-N 3.43Å |
| 279 | Y | 73.5 | Confident | 74.8 | Confident | 206 Ų | 206 | 90.6 Ų | 90.6 | 81% | 0.808 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -83.8 | -25.3 | -177.7 | -86.3 | -88.5 | 0 | 0 | 0 | 114.6 | I275 | I275-Y279 HydrophobicContact CG2-CD2 3.68Å; I275-Y279 HydrophobicContact CG2-CE2 3.89Å; I275-Y279 WeakPolarHBondContact O-CD2 3.3Å; I275-Y279 PolarHBondContact O-N 2.97Å |
| 280 | S | 71.3 | Confident | 74.5 | Confident | 53 Ų | 53 | 89.9 Ų | 89.9 | 37% | 0.371 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -86 | -19.8 | -177.8 | 63.7 | 0 | 0 | 0 | 0 | 114.3 | S276 S282 | S276-S280 WeakPolarHBondContact O-CB 3.27Å; S276-S280 PolarHBondContact O-N 3.01Å; S276-S280 PolarHBondContact O-OG 3.46Å; S280-S282 PolarHBondContact O-N 2.96Å; S280-S282 PolarHBondContact OG-O 3.41Å |
| 281 | G | 64.8 | Low | 74.4 | Confident | 76 Ų | 76 | 86.5 Ų | 86.5 | 78% | 0.784 | 47% | 0.468 | S | S | * | . | S | Bend | trans | 61.1 | 4.5 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 282 | S | 66.3 | Low | 74.2 | Confident | 45 Ų | 45 | 86.6 Ų | 86.6 | 32% | 0.315 | 47% | 0.472 | S | S | . | . | trans | -139.8 | 101.7 | -172.5 | -173.9 | 0 | 0 | 0 | 0 | 110.1 | S280 W284 W285 S286 | S280-S282 PolarHBondContact O-N 2.96Å; S280-S282 PolarHBondContact OG-O 3.41Å; S282-W284 PolarHBondContact O-N 3.24Å; S282-W285 PolarHBondContact O-N 2.83Å; S282-S286 PolarHBondContact O-N 3.31Å | ||
| 283 | C | 63.5 | Low | 74.1 | Confident | 88 Ų | 88 | 87 Ų | 87 | 60% | 0.595 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -56.1 | -27.1 | -176 | -59.3 | 0 | 0 | 0 | 0 | 113.5 | A287 | C283-A287 VanDerWaalsContact O-CB 3.27Å; C283-A287 WeakPolarHBondContact O-CB 3.25Å; C283-A287 PolarHBondContact O-N 3.38Å |
| 284 | W | 66.3 | Low | 74.2 | Confident | 219 Ų | 219 | 88.7 Ų | 88.7 | 83% | 0.83 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -69.2 | -42.8 | -178.3 | -69.8 | 9.9 | 0 | 0 | 0 | 112.4 | S282 A287 M288 | S282-W284 PolarHBondContact O-N 3.24Å; W284-A287 PolarHBondContact O-N 2.91Å; W284-M288 WeakPolarHBondContact O-CG 3.44Å; W284-M288 PolarHBondContact O-N 3.48Å |
| 285 | W | 66.6 | Low | 74.4 | Confident | 183 Ų | 183 | 87.7 Ų | 87.7 | 69% | 0.693 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.1 | -40.9 | 176 | -72.2 | 98.7 | 0 | 0 | 0 | 111.7 | S282 M288 V289 | S282-W285 PolarHBondContact O-N 2.83Å; W285-M288 PolarHBondContact O-N 2.92Å; W285-V289 WeakPolarHBondContact O-CG2 3.48Å; W285-V289 PolarHBondContact O-N 3.41Å |
| 286 | S | 68.7 | Low | 74.4 | Confident | 0 Ų | 0 | 87.1 Ų | 87.1 | 0% | 0 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -68.8 | -35.7 | 177.4 | -163.6 | 0 | 0 | 0 | 0 | 112.9 | F273 S276 V277 S282 V289 T290 | F273-S286 WeakPolarHBondContact CE2-OG 3.33Å; S276-S286 WeakPolarHBondContact CB-OG 3.5Å; S276-S286 PolarHBondContact OG-OG 2.96Å; V277-S286 VanDerWaalsContact CG2-OG 3.25Å; V277-S286 WeakPolarHBondContact CG2-OG 3.43Å; V277-S286 PolarHBondContact N-OG 3.44Å; S282-S286 PolarHBondContact O-N 3.31Å; S286-V289 PolarHBondContact O-N 3.47Å; S286-T290 PolarHBondContact O-N 3.41Å; S286-T290 PolarHBondContact O-OG1 3.05Å |
| 287 | A | 71.9 | Confident | 74.6 | Confident | 51 Ų | 51 | 88.3 Ų | 88.3 | 42% | 0.421 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.8 | -41.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | C283 W284 T290 A291 | C283-A287 VanDerWaalsContact O-CB 3.27Å; C283-A287 WeakPolarHBondContact O-CB 3.25Å; C283-A287 PolarHBondContact O-N 3.38Å; W284-A287 PolarHBondContact O-N 2.91Å; A287-T290 PolarHBondContact O-OG1 2.94Å; A287-A291 VanDerWaalsContact O-CB 3.31Å; A287-A291 WeakPolarHBondContact O-CB 3.24Å; A287-A291 PolarHBondContact O-N 3.04Å |
| 288 | M | 77.8 | Confident | 74.7 | Confident | 142 Ų | 142 | 88.9 Ų | 88.9 | 70% | 0.7 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66.3 | -43.4 | 175.1 | -67.5 | -148.2 | 81 | 0 | 0 | 112.4 | W284 W285 T290 A291 A292 | W284-M288 WeakPolarHBondContact O-CG 3.44Å; W284-M288 PolarHBondContact O-N 3.48Å; W285-M288 PolarHBondContact O-N 2.92Å; M288-T290 VanDerWaalsContact C-N 3.32Å; M288-T290 PolarHBondContact O-N 2.95Å; M288-A291 PolarHBondContact O-N 2.77Å; M288-A292 WeakPolarHBondContact O-CB 3.44Å; M288-A292 PolarHBondContact O-N 3.04Å |
| 289 | V | 77.9 | Confident | 74.8 | Confident | 70 Ų | 70 | 85.1 Ų | 85.1 | 42% | 0.424 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.3 | -39.3 | 177.8 | 169.8 | 0 | 0 | 0 | 0 | 111.4 | W285 S286 M293 | W285-V289 WeakPolarHBondContact O-CG2 3.48Å; W285-V289 PolarHBondContact O-N 3.41Å; S286-V289 PolarHBondContact O-N 3.47Å; V289-M293 WeakPolarHBondContact O-CG 3.45Å; V289-M293 PolarHBondContact O-N 2.78Å |
| 290 | T | 76.1 | Confident | 74.9 | Confident | 24 Ų | 24 | 79.5 Ų | 79.5 | 15% | 0.147 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -77.1 | -35.2 | 177 | 42.7 | 0 | 0 | 0 | 0 | 114.4 | F273 S286 A287 M288 A292 M293 L294 | F273-T290 HydrophobicContact CB-CG2 3.7Å; F273-T290 HydrophobicContact CD1-CG2 4.45Å; F273-T290 HydrophobicContact CD2-CG2 3.14Å; F273-T290 HydrophobicContact CE2-CG2 3.76Å; F273-T290 HydrophobicContact CG-CG2 3.53Å; S286-T290 PolarHBondContact O-N 3.41Å; S286-T290 PolarHBondContact O-OG1 3.05Å; A287-T290 PolarHBondContact O-OG1 2.94Å; M288-T290 VanDerWaalsContact C-N 3.32Å; M288-T290 PolarHBondContact O-N 2.95Å; T290-A292 VanDerWaalsContact C-N 3.27Å; T290-A292 PolarHBondContact O-N 3.35Å; T290-M293 PolarHBondContact O-N 3.02Å; T290-L294 WeakPolarHBondContact O-CB 3.43Å; T290-L294 VanDerWaalsContact O-CG 3.3Å; T290-L294 WeakPolarHBondContact O-CG 3.45Å; T290-L294 PolarHBondContact O-N 3.33Å |
| 291 | A | 79.4 | Confident | 75 | Confident | 60 Ų | 60 | 81.6 Ų | 81.6 | 50% | 0.496 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -58.6 | -43.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | A287 M288 L294 A295 | A287-A291 VanDerWaalsContact O-CB 3.31Å; A287-A291 WeakPolarHBondContact O-CB 3.24Å; A287-A291 PolarHBondContact O-N 3.04Å; M288-A291 PolarHBondContact O-N 2.77Å; A291-L294 PolarHBondContact O-N 3.47Å; A291-A295 VanDerWaalsContact O-CB 3.32Å; A291-A295 WeakPolarHBondContact O-CB 3.25Å; A291-A295 PolarHBondContact O-N 3.13Å |
| 292 | A | 81.4 | Confident | 75.2 | Confident | 55 Ų | 55 | 85.9 Ų | 85.9 | 46% | 0.455 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.1 | -46.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | M288 T290 A295 T296 | M288-A292 WeakPolarHBondContact O-CB 3.44Å; M288-A292 PolarHBondContact O-N 3.04Å; T290-A292 VanDerWaalsContact C-N 3.27Å; T290-A292 PolarHBondContact O-N 3.35Å; A292-A295 PolarHBondContact O-N 2.91Å; A292-T296 WeakPolarHBondContact O-CG2 3.33Å; A292-T296 PolarHBondContact O-N 3.38Å; A292-T296 PolarHBondContact O-OG1 3.09Å |
| 293 | M | 81.6 | Confident | 75.4 | Confident | 109 Ų | 109 | 88.8 Ų | 88.8 | 54% | 0.537 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.3 | -38 | 177.4 | -73.4 | -66.7 | -172.3 | 0 | 0 | 113.1 | V289 T290 A295 T296 I297 | V289-M293 WeakPolarHBondContact O-CG 3.45Å; V289-M293 PolarHBondContact O-N 2.78Å; T290-M293 PolarHBondContact O-N 3.02Å; M293-A295 VanDerWaalsContact C-N 3.35Å; M293-T296 WeakPolarHBondContact CA-OG1 3.38Å; M293-T296 PolarHBondContact O-N 3.5Å; M293-T296 PolarHBondContact O-OG1 2.95Å; M293-I297 WeakPolarHBondContact O-CB 3.39Å; M293-I297 VanDerWaalsContact O-CD1 3.31Å; M293-I297 WeakPolarHBondContact O-CD1 3.26Å; M293-I297 WeakPolarHBondContact O-CG1 3.46Å; M293-I297 PolarHBondContact O-N 3.34Å |
| 294 | L | 81.3 | Confident | 75.4 | Confident | 106 Ų | 106 | 88.9 Ų | 88.9 | 56% | 0.555 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -68.8 | -35 | 174.4 | -71.5 | 170.8 | 0 | 0 | 0 | 111.6 | T290 A291 S298 | T290-L294 WeakPolarHBondContact O-CB 3.43Å; T290-L294 VanDerWaalsContact O-CG 3.3Å; T290-L294 WeakPolarHBondContact O-CG 3.45Å; T290-L294 PolarHBondContact O-N 3.33Å; A291-L294 PolarHBondContact O-N 3.47Å; L294-S298 VanDerWaalsContact O-CB 3.27Å; L294-S298 WeakPolarHBondContact O-CB 3.5Å; L294-S298 PolarHBondContact O-N 3.24Å; L294-S298 PolarHBondContact O-OG 3.41Å; L294-S298 VanDerWaalsContact O-OG 3.08Å |
| 295 | A | 84.4 | Confident | 74.7 | Confident | 53 Ų | 53 | 87.1 Ų | 87.1 | 44% | 0.438 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.4 | -45.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | A291 A292 M293 S298 A299 | A291-A295 VanDerWaalsContact O-CB 3.32Å; A291-A295 WeakPolarHBondContact O-CB 3.25Å; A291-A295 PolarHBondContact O-N 3.13Å; A292-A295 PolarHBondContact O-N 2.91Å; M293-A295 VanDerWaalsContact C-N 3.35Å; A295-S298 PolarHBondContact O-N 3.23Å; A295-S298 PolarHBondContact O-OG 3.34Å; A295-A299 WeakPolarHBondContact O-CB 3.38Å; A295-A299 PolarHBondContact O-N 3.19Å |
| 296 | T | 81.7 | Confident | 73.9 | Confident | 77 Ų | 77 | 82.5 Ų | 82.5 | 47% | 0.472 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -66.4 | -42.7 | 177.4 | 56.4 | 0 | 0 | 0 | 0 | 112.1 | A292 M293 S298 A299 V300 | A292-T296 WeakPolarHBondContact O-CG2 3.33Å; A292-T296 PolarHBondContact O-N 3.38Å; A292-T296 PolarHBondContact O-OG1 3.09Å; M293-T296 WeakPolarHBondContact CA-OG1 3.38Å; M293-T296 PolarHBondContact O-N 3.5Å; M293-T296 PolarHBondContact O-OG1 2.95Å; T296-S298 PolarHBondContact O-N 3.21Å; T296-A299 PolarHBondContact O-N 3.28Å; T296-V300 WeakPolarHBondContact O-CG2 3.24Å; T296-V300 PolarHBondContact O-N 3.49Å |
| 297 | I | 81.3 | Confident | 73.1 | Confident | 60 Ų | 60 | 84.4 Ų | 84.4 | 31% | 0.308 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.9 | -42.5 | 175.2 | -67.9 | 161.7 | 0 | 0 | 0 | 110.8 | I269 M293 V300 M301 | I269-I297 HydrophobicContact CD1-CD1 3.58Å; I269-I297 HydrophobicContact CG1-CD1 4.02Å; I269-I297 HydrophobicContact CG2-CD1 4.48Å; M293-I297 WeakPolarHBondContact O-CB 3.39Å; M293-I297 VanDerWaalsContact O-CD1 3.31Å; M293-I297 WeakPolarHBondContact O-CD1 3.26Å; M293-I297 WeakPolarHBondContact O-CG1 3.46Å; M293-I297 PolarHBondContact O-N 3.34Å; I297-V300 PolarHBondContact O-N 3Å; I297-M301 HydrophobicContact CG2-CG 4.28Å; I297-M301 WeakPolarHBondContact O-CB 3.46Å; I297-M301 WeakPolarHBondContact O-CG 3.4Å; I297-M301 PolarHBondContact O-N 3.28Å |
| 298 | S | 76.3 | Confident | 72 | Confident | 57 Ų | 57 | 88.1 Ų | 88.1 | 40% | 0.399 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.1 | -41.1 | 177.8 | 68.7 | 0 | 0 | 0 | 0 | 111.8 | L294 A295 T296 M301 F302 | L294-S298 VanDerWaalsContact O-CB 3.27Å; L294-S298 WeakPolarHBondContact O-CB 3.5Å; L294-S298 PolarHBondContact O-N 3.24Å; L294-S298 PolarHBondContact O-OG 3.41Å; L294-S298 VanDerWaalsContact O-OG 3.08Å; A295-S298 PolarHBondContact O-N 3.23Å; A295-S298 PolarHBondContact O-OG 3.34Å; T296-S298 PolarHBondContact O-N 3.21Å; S298-M301 PolarHBondContact O-N 2.93Å; S298-F302 VanDerWaalsContact O-CD2 3.29Å; S298-F302 WeakPolarHBondContact O-CD2 3.41Å; S298-F302 PolarHBondContact O-N 3.09Å |
| 299 | A | 77.9 | Confident | 70.5 | Confident | 53 Ų | 53 | 89.3 Ų | 89.3 | 44% | 0.438 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.3 | -46.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | A295 T296 M301 F302 V303 | A295-A299 WeakPolarHBondContact O-CB 3.38Å; A295-A299 PolarHBondContact O-N 3.19Å; T296-A299 PolarHBondContact O-N 3.28Å; A299-M301 VanDerWaalsContact C-N 3.34Å; A299-M301 PolarHBondContact O-N 2.92Å; A299-F302 PolarHBondContact O-N 3.41Å; A299-V303 WeakPolarHBondContact O-CG2 3.48Å; A299-V303 PolarHBondContact O-N 2.9Å |
| 300 | V | 76.9 | Confident | 69 | Low | 88 Ų | 88 | 89 Ų | 89 | 53% | 0.533 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.1 | -41.7 | 175.1 | 171.3 | 0 | 0 | 0 | 0 | 111 | T296 I297 F302 V303 T304 | T296-V300 WeakPolarHBondContact O-CG2 3.24Å; T296-V300 PolarHBondContact O-N 3.49Å; I297-V300 PolarHBondContact O-N 3Å; V300-F302 PolarHBondContact O-N 3.39Å; V300-V303 PolarHBondContact O-N 3.13Å; V300-T304 HydrophobicContact CG1-CG2 4.12Å; V300-T304 WeakPolarHBondContact O-CB 3.48Å; V300-T304 VanDerWaalsContact O-CG2 3.31Å; V300-T304 WeakPolarHBondContact O-CG2 3.47Å; V300-T304 PolarHBondContact O-N 2.96Å; V300-T304 PolarHBondContact O-OG1 3.32Å |
| 301 | M | 73.6 | Confident | 67.7 | Low | 97 Ų | 97 | 96.3 Ų | 96.3 | 48% | 0.478 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.2 | -35.2 | 175.6 | -74 | -66.8 | -64.3 | 0 | 0 | 112.7 | I297 S298 A299 T304 K305 | I297-M301 HydrophobicContact CG2-CG 4.28Å; I297-M301 WeakPolarHBondContact O-CB 3.46Å; I297-M301 WeakPolarHBondContact O-CG 3.4Å; I297-M301 PolarHBondContact O-N 3.28Å; S298-M301 PolarHBondContact O-N 2.93Å; A299-M301 VanDerWaalsContact C-N 3.34Å; A299-M301 PolarHBondContact O-N 2.92Å; M301-T304 WeakPolarHBondContact CA-OG1 3.49Å; M301-K305 WeakPolarHBondContact O-CB 3.26Å; M301-K305 PolarHBondContact O-N 2.92Å |
| 302 | F | 69.3 | Low | 66 | Low | 167 Ų | 167 | 104 Ų | 104 | 73% | 0.732 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -66 | -49 | 173.1 | -92.4 | -76.4 | 0 | 0 | 0 | 111.2 | S298 A299 V300 K305 S306 | S298-F302 VanDerWaalsContact O-CD2 3.29Å; S298-F302 WeakPolarHBondContact O-CD2 3.41Å; S298-F302 PolarHBondContact O-N 3.09Å; A299-F302 PolarHBondContact O-N 3.41Å; V300-F302 PolarHBondContact O-N 3.39Å; F302-K305 PolarHBondContact O-N 3.01Å; F302-S306 PolarHBondContact O-N 3.41Å; F302-S306 PolarHBondContact O-OG 3.03Å; F302-S306 VanDerWaalsContact O-OG 3.05Å |
| 303 | V | 69.9 | Low | 64.6 | Low | 106 Ų | 106 | 112.8 Ų | 112.8 | 64% | 0.642 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -65.4 | -38.8 | -179.5 | 173.5 | 0 | 0 | 0 | 0 | 112.4 | A299 V300 S306 | A299-V303 WeakPolarHBondContact O-CG2 3.48Å; A299-V303 PolarHBondContact O-N 2.9Å; V300-V303 PolarHBondContact O-N 3.13Å; V303-S306 WeakPolarHBondContact CA-OG 3.36Å; V303-S306 PolarHBondContact O-OG 3.38Å |
| 304 | T | 63.1 | Low | 63.3 | Low | 90 Ų | 90 | 118.5 Ų | 118.5 | 55% | 0.552 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -80.9 | -27.5 | 179.2 | 54.6 | 0 | 0 | 0 | 0 | 113.3 | V300 M301 S306 G307 | V300-T304 HydrophobicContact CG1-CG2 4.12Å; V300-T304 WeakPolarHBondContact O-CB 3.48Å; V300-T304 VanDerWaalsContact O-CG2 3.31Å; V300-T304 WeakPolarHBondContact O-CG2 3.47Å; V300-T304 PolarHBondContact O-N 2.96Å; V300-T304 PolarHBondContact O-OG1 3.32Å; M301-T304 WeakPolarHBondContact CA-OG1 3.49Å; T304-S306 VanDerWaalsContact C-N 3.34Å; T304-G307 PolarHBondContact O-N 3.33Å |
| 305 | K | 50.9 | Low | 61.9 | Low | 182 Ų | 182 | 117.8 Ų | 117.8 | 79% | 0.791 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -75.7 | -23.3 | 171.7 | -170.8 | 174.1 | 178.5 | -177.3 | 0 | 112.3 | M301 F302 G307 | M301-K305 WeakPolarHBondContact O-CB 3.26Å; M301-K305 PolarHBondContact O-N 2.92Å; F302-K305 PolarHBondContact O-N 3.01Å; K305-G307 PolarHBondContact O-N 3Å; K305-G307 VanDerWaalsContact O-N 3.1Å |
| 306 | S | 50.5 | Low | 60.3 | Low | 86 Ų | 86 | 124.6 Ų | 124.6 | 60% | 0.601 | 65% | 0.653 | S | S | * | * | trans | -78.7 | 50.4 | 159.6 | 54.6 | 0 | 0 | 0 | 0 | 112.3 | F302 V303 T304 | F302-S306 PolarHBondContact O-N 3.41Å; F302-S306 PolarHBondContact O-OG 3.03Å; F302-S306 VanDerWaalsContact O-OG 3.05Å; V303-S306 WeakPolarHBondContact CA-OG 3.36Å; V303-S306 PolarHBondContact O-OG 3.38Å; T304-S306 VanDerWaalsContact C-N 3.34Å | ||
| 307 | G | 52 | Low | 59 | Low | 39 Ų | 39 | 126.6 Ų | 126.6 | 40% | 0.402 | 67% | 0.665 | S | S | . | * | trans | -58.4 | 159.9 | 156.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | T304 K305 M309 | T304-G307 PolarHBondContact O-N 3.33Å; K305-G307 PolarHBondContact O-N 3Å; K305-G307 VanDerWaalsContact O-N 3.1Å; G307-M309 PolarHBondContact O-N 3.24Å; G307-M309 VanDerWaalsContact O-N 3.1Å | ||
| 308 | P | 48.4 | Very low | 57.8 | Low | 130 Ų | 130 | 131.7 Ų | 131.7 | 84% | 0.844 | 69% | 0.688 | S | S | * | * | trans | -52.2 | 125 | -179.3 | 23.3 | -33.6 | 0 | 0 | 0 | 108.7 | G310 | P308-G310 VanDerWaalsContact C-N 3.26Å; P308-G310 PolarHBondContact O-N 3.49Å | ||
| 309 | M | 46 | Very low | 56.4 | Low | 167 Ų | 167 | 135.8 Ų | 135.8 | 82% | 0.823 | 71% | 0.705 | S | S | * | * | trans | -65.3 | 91.8 | -171.4 | -173.6 | 144.9 | 67 | 0 | 0 | 108.7 | G307 E311 | G307-M309 PolarHBondContact O-N 3.24Å; G307-M309 VanDerWaalsContact O-N 3.1Å; M309-E311 PolarHBondContact O-N 2.99Å; M309-E311 VanDerWaalsContact O-N 3.17Å | ||
| 310 | G | 47.8 | Very low | 55.1 | Low | 64 Ų | 64 | 140.7 Ų | 140.7 | 66% | 0.66 | 72% | 0.722 | S | S | * | * | trans | -52.2 | 121.8 | -167.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | P308 W312 | P308-G310 VanDerWaalsContact C-N 3.26Å; P308-G310 PolarHBondContact O-N 3.49Å; G310-W312 PolarHBondContact O-N 3.34Å | ||
| 311 | E | 49.1 | Very low | 53.9 | Low | 176 Ų | 176 | 142.2 Ų | 142.2 | 82% | 0.822 | 73% | 0.732 | S | S | * | * | trans | -33.4 | 108.7 | -170.4 | -168.3 | 164.4 | -174 | 0 | 0 | 111.2 | M309 R313 | M309-E311 PolarHBondContact O-N 2.99Å; M309-E311 VanDerWaalsContact O-N 3.17Å; E311-R313 PolarHBondContact O-N 2.82Å | ||
| 312 | W | 42.9 | Very low | 52.8 | Low | 223 Ų | 223 | 142.1 Ų | 142.1 | 85% | 0.845 | 74% | 0.741 | S | S | * | * | trans | -52.7 | 107.2 | -179.1 | -109.9 | 74.5 | 0 | 0 | 0 | 107 | G310 R314 | G310-W312 PolarHBondContact O-N 3.34Å; W312-R314 PolarHBondContact O-N 2.74Å | ||
| 313 | R | 51.1 | Low | 51.9 | Low | 238 Ų | 238 | 144.1 Ų | 144.1 | 90% | 0.898 | 74% | 0.743 | S | S | * | * | trans | -59 | 103.7 | -175.6 | -61 | -173 | -166.4 | -148.9 | 4 | 106.8 | E311 A315 | E311-R313 PolarHBondContact O-N 2.82Å; R313-A315 PolarHBondContact O-N 3.19Å | ||
| 314 | R | 56.1 | Low | 50.9 | Low | 229 Ų | 229 | 146 Ų | 146 | 86% | 0.864 | 75% | 0.75 | S | S | * | * | trans | -52.9 | 121.2 | 170 | -71.2 | -176.1 | -176.4 | 138.1 | 2.6 | 105.6 | W312 K316 | W312-R314 PolarHBondContact O-N 2.74Å; R314-K316 PolarHBondContact O-N 2.92Å | ||
| 315 | A | 51.1 | Low | 49.9 | Very low | 91 Ų | 91 | 153 Ų | 153 | 75% | 0.752 | 78% | 0.776 | S | S | * | * | trans | -53.8 | 119.2 | 171.6 | 0 | 0 | 0 | 0 | 0 | 106.3 | R313 T317 | R313-A315 PolarHBondContact O-N 3.19Å; A315-T317 VanDerWaalsContact C-N 3.31Å; A315-T317 PolarHBondContact O-N 2.96Å | ||
| 316 | K | 50.5 | Low | 49.9 | Very low | 197 Ų | 197 | 151.6 Ų | 151.6 | 86% | 0.857 | 78% | 0.776 | S | S | * | * | trans | -72 | 95.7 | -178.4 | -168.3 | 177.2 | -176.3 | -176.8 | 0 | 105.7 | R314 E318 | R314-K316 PolarHBondContact O-N 2.92Å; K316-E318 PolarHBondContact O-N 3.39Å | ||
| 317 | T | 53.6 | Low | 49.8 | Very low | 118 Ų | 118 | 155 Ų | 155 | 72% | 0.724 | 79% | 0.785 | S | S | * | * | trans | -61 | 104.6 | 170.6 | 43.2 | 0 | 0 | 0 | 0 | 106.9 | A315 D319 | A315-T317 VanDerWaalsContact C-N 3.31Å; A315-T317 PolarHBondContact O-N 2.96Å; T317-D319 PolarHBondContact O-N 2.92Å | ||
| 318 | E | 56 | Low | 49.7 | Very low | 167 Ų | 167 | 161.4 Ų | 161.4 | 78% | 0.78 | 81% | 0.806 | S | S | * | * | trans | -68.4 | 108.9 | 170.7 | 45.3 | -156 | 132.3 | 0 | 0 | 108 | K316 I320 | K316-E318 PolarHBondContact O-N 3.39Å; E318-I320 PolarHBondContact O-N 3.48Å | ||
| 319 | D | 47.4 | Very low | 49.8 | Very low | 144 Ų | 144 | 163.3 Ų | 163.3 | 77% | 0.77 | 80% | 0.804 | S | S | * | * | trans | -63.9 | 98.9 | 176.9 | -76.4 | -41.7 | 0 | 0 | 0 | 109.2 | T317 T321 | T317-D319 PolarHBondContact O-N 2.92Å; D319-T321 HydrophobicContact CB-CG2 4.3Å; D319-T321 PolarHBondContact O-N 3.2Å | ||
| 320 | I | 50.9 | Low | 50 | Low | 156 Ų | 156 | 163.1 Ų | 163.1 | 80% | 0.8 | 80% | 0.803 | S | S | * | * | trans | -73.8 | 80.2 | 171.2 | -48.3 | 177.6 | 0 | 0 | 0 | 107.8 | E318 S322 | E318-I320 PolarHBondContact O-N 3.48Å; I320-S322 PolarHBondContact O-N 3.04Å | ||
| 321 | T | 52 | Low | 50.2 | Low | 119 Ų | 119 | 169.7 Ų | 169.7 | 73% | 0.73 | 81% | 0.812 | S | S | * | * | trans | -71.5 | 98 | 171 | 64.1 | 0 | 0 | 0 | 0 | 108.7 | D319 R323 | D319-T321 HydrophobicContact CB-CG2 4.3Å; D319-T321 PolarHBondContact O-N 3.2Å; T321-R323 VanDerWaalsContact C-N 3.33Å; T321-R323 PolarHBondContact O-N 2.95Å | ||
| 322 | S | 51 | Low | 50.3 | Low | 95 Ų | 95 | 169.2 Ų | 169.2 | 66% | 0.664 | 81% | 0.811 | S | S | * | * | trans | -68.6 | 92.4 | 172 | 56.7 | 0 | 0 | 0 | 0 | 109.2 | I320 N324 | I320-S322 PolarHBondContact O-N 3.04Å; S322-N324 PolarHBondContact O-N 3.23Å; S322-N324 VanDerWaalsContact O-N 3.15Å | ||
| 323 | R | 50 | Low | 50.8 | Low | 209 Ų | 209 | 165.1 Ų | 165.1 | 79% | 0.789 | 81% | 0.809 | S | S | * | * | trans | -75.4 | 97.7 | 174.2 | -174 | -177 | -176.6 | 112.7 | 9.5 | 109.2 | T321 | T321-R323 VanDerWaalsContact C-N 3.33Å; T321-R323 PolarHBondContact O-N 2.95Å | ||
| 324 | N | 48.1 | Very low | 50.8 | Low | 145 Ų | 145 | 159 Ų | 159 | 78% | 0.775 | 80% | 0.801 | S | S | * | * | trans | -103.6 | 83.9 | 172.4 | -66.3 | 10.5 | 0 | 0 | 0 | 109.6 | S322 | S322-N324 PolarHBondContact O-N 3.23Å; S322-N324 VanDerWaalsContact O-N 3.15Å | ||
| 325 | E | 42.9 | Very low | 50.3 | Low | 238 Ų | 238 | 152.6 Ų | 152.6 | 100% | 1.112 | 80% | 0.796 | S | S | * | * | trans | -145.8 | 0 | 160.6 | -71.9 | -170.7 | 168.1 | 0 | 0 | 108.9 |
Retrieved 325 of 325 residues in 405.8 ms
(Link to these results)