| 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 | 45.4 | Very low | 44.7 | Very low | 249 Ų | 249 | 149.4 Ų | 149.4 | 100% | 1.227 | 87% | 0.867 | S | S | * | * | 0 | 91.8 | 0 | -70.1 | 170.2 | 112.2 | 0 | 0 | 104.9 | |||||
| 2 | S | 49.6 | Very low | 44.7 | Very low | 112 Ų | 112 | 148.2 Ų | 148.2 | 78% | 0.783 | 86% | 0.863 | S | S | * | * | trans | -122.6 | 111.1 | -164.9 | 39.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 3 | D | 42 | Very low | 44.1 | Very low | 160 Ų | 160 | 141.9 Ų | 141.9 | 86% | 0.856 | 85% | 0.849 | S | S | * | * | trans | -72.4 | 126.4 | 165.9 | -69 | -50.3 | 0 | 0 | 0 | 108.5 | ||||
| 4 | D | 59.7 | Low | 44 | Very low | 162 Ų | 162 | 145.8 Ų | 145.8 | 87% | 0.866 | 85% | 0.854 | S | S | * | * | trans | -135.3 | 119 | 162.3 | -99.3 | -38.9 | 0 | 0 | 0 | 109.9 | ||||
| 5 | Q | 42 | Very low | 43.3 | Very low | 194 Ų | 194 | 148.3 Ų | 148.3 | 91% | 0.907 | 85% | 0.854 | S | S | * | * | trans | -71.4 | 130.5 | -178.8 | -65.7 | 174.7 | -0.6 | 0 | 0 | 110.5 | ||||
| 6 | A | 48.7 | Very low | 43 | Very low | 104 Ų | 104 | 145.2 Ų | 145.2 | 86% | 0.86 | 85% | 0.852 | S | S | * | * | trans | -110.6 | 98.8 | 164.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 7 | S | 41.5 | Very low | 43 | Very low | 108 Ų | 108 | 143.5 Ų | 143.5 | 76% | 0.755 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 127.8 | 171.9 | 49.8 | 0 | 0 | 0 | 0 | 111.9 | ||
| 8 | A | 41.3 | Very low | 42.8 | Very low | 105 Ų | 105 | 141.9 Ų | 141.9 | 87% | 0.868 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 123.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 9 | I | 46.2 | Very low | 42.6 | Very low | 152 Ų | 152 | 146.9 Ų | 146.9 | 78% | 0.779 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 132.5 | 170.4 | -58.3 | 173.2 | 0 | 0 | 0 | 107.9 | ||
| 10 | P | 35.1 | Very low | 42.3 | Very low | 109 Ų | 109 | 142.8 Ų | 142.8 | 71% | 0.708 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 132.8 | 179.2 | 31.7 | -31 | 0 | 0 | 0 | 110.3 | V12 | P10-V12 PolarHBondContact O-N 3.18Š|
| 11 | M | 40.6 | Very low | 42.4 | Very low | 188 Ų | 188 | 141.6 Ų | 141.6 | 93% | 0.926 | 83% | 0.828 | S | S | * | * | trans | -69.6 | 107.3 | 171.6 | -67.7 | -79.3 | -73.1 | 0 | 0 | 108.9 | ||||
| 12 | V | 44.4 | Very low | 42.1 | Very low | 135 Ų | 135 | 137.1 Ų | 137.1 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | trans | -68.3 | 129.9 | 168.2 | 175.9 | 0 | 0 | 0 | 0 | 108.1 | P10 E14 | P10-V12 PolarHBondContact O-N 3.18Å; V12-E14 PolarHBondContact O-N 3.09Å | ||
| 13 | G | 36.4 | Very low | 41.7 | Very low | 67 Ų | 67 | 142.1 Ų | 142.1 | 69% | 0.691 | 81% | 0.813 | S | S | * | * | trans | -60.4 | 127.4 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q15 | G13-Q15 PolarHBondContact O-N 3.09Š| ||
| 14 | E | 42.7 | Very low | 41.6 | Very low | 196 Ų | 196 | 142.5 Ų | 142.5 | 92% | 0.916 | 81% | 0.809 | S | S | * | * | trans | -70.6 | 105 | 171 | -156.9 | 127.3 | 124.5 | 0 | 0 | 108.6 | V12 A16 | V12-E14 PolarHBondContact O-N 3.09Å; E14-A16 PolarHBondContact O-N 3.02Å | ||
| 15 | Q | 34.4 | Very low | 41.1 | Very low | 183 Ų | 183 | 139.7 Ų | 139.7 | 86% | 0.855 | 80% | 0.802 | S | S | * | * | trans | -65.7 | 117.2 | 167.9 | -78.1 | -178.6 | -41.8 | 0 | 0 | 108.5 | G13 V17 | G13-Q15 PolarHBondContact O-N 3.09Å; Q15-V17 PolarHBondContact O-N 3.25Å; Q15-V17 VanDerWaalsContact O-N 3.16Å | ||
| 16 | A | 38.9 | Very low | 41.1 | Very low | 99 Ų | 99 | 137.1 Ų | 137.1 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -61.3 | 113.5 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | E14 P18 | E14-A16 PolarHBondContact O-N 3.02Å; A16-P18 WeakPolarHBondContact O-CD 3.41Å | ||
| 17 | V | 42.1 | Very low | 40.9 | Very low | 116 Ų | 116 | 137.6 Ų | 137.6 | 70% | 0.703 | 79% | 0.789 | S | S | * | * | trans | -75.1 | 120.5 | 172.1 | -161.1 | 0 | 0 | 0 | 0 | 107.5 | Q15 Y19 | Q15-V17 PolarHBondContact O-N 3.25Å; Q15-V17 VanDerWaalsContact O-N 3.16Å; V17-Y19 PolarHBondContact O-N 2.72Å; V17-Y19 VanDerWaalsContact O-N 3.15Å | ||
| 18 | P | 39.9 | Very low | 41.2 | Very low | 116 Ų | 116 | 137.6 Ų | 137.6 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | trans | -73.8 | 109.7 | 177.1 | 29.3 | -29.1 | 0 | 0 | 0 | 108.3 | A16 G20 | A16-P18 WeakPolarHBondContact O-CD 3.41Å; P18-G20 PolarHBondContact O-N 3.41Å; P18-G20 VanDerWaalsContact O-N 3.08Å | ||
| 19 | Y | 37.7 | Very low | 41.2 | Very low | 236 Ų | 236 | 138.4 Ų | 138.4 | 93% | 0.925 | 78% | 0.779 | S | S | * | * | trans | -74.4 | 94.8 | 165.2 | -92.5 | -92.3 | 0 | 0 | 0 | 107.9 | V17 | V17-Y19 PolarHBondContact O-N 2.72Å; V17-Y19 VanDerWaalsContact O-N 3.15Å | ||
| 20 | G | 36.5 | Very low | 40.9 | Very low | 64 Ų | 64 | 140.4 Ų | 140.4 | 66% | 0.66 | 78% | 0.778 | S | S | * | * | trans | -172.7 | 75.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | P18 | P18-G20 PolarHBondContact O-N 3.41Å; P18-G20 VanDerWaalsContact O-N 3.08Å | ||
| 21 | T | 44.6 | Very low | 41.1 | Very low | 118 Ų | 118 | 143.9 Ų | 143.9 | 72% | 0.724 | 79% | 0.785 | S | S | * | * | trans | -123.6 | 107.2 | 159.6 | 46.5 | 0 | 0 | 0 | 0 | 106.9 | Y23 | T21-Y23 PolarHBondContact O-N 3.03Å; T21-Y23 VanDerWaalsContact O-N 3.14Å | ||
| 22 | D | 39.4 | Very low | 40.9 | Very low | 156 Ų | 156 | 143.8 Ų | 143.8 | 83% | 0.834 | 78% | 0.782 | S | S | * | * | trans | -46.4 | 115.8 | 161.9 | -73.3 | -52.9 | 0 | 0 | 0 | 108.5 | Q24 | D22-Q24 PolarHBondContact O-N 2.87Š| ||
| 23 | Y | 42.3 | Very low | 40.8 | Very low | 217 Ų | 217 | 142.7 Ų | 142.7 | 85% | 0.851 | 78% | 0.781 | S | S | * | * | trans | -73.5 | 77.7 | 165.9 | -90.5 | -93.6 | 0 | 0 | 0 | 107.6 | T21 S25 | T21-Y23 PolarHBondContact O-N 3.03Å; T21-Y23 VanDerWaalsContact O-N 3.14Å; Y23-S25 VanDerWaalsContact C-N 3.31Å; Y23-S25 PolarHBondContact O-N 3.09Å | ||
| 24 | Q | 40 | Very low | 41.1 | Very low | 167 Ų | 167 | 143.6 Ų | 143.6 | 78% | 0.78 | 78% | 0.781 | S | S | * | * | trans | -83.5 | 85.1 | 162.5 | -155.6 | 92.4 | -21.4 | 0 | 0 | 106.2 | D22 D26 | D22-Q24 PolarHBondContact O-N 2.87Å; Q24-D26 PolarHBondContact O-N 3.24Å | ||
| 25 | S | 48 | Very low | 40.8 | Very low | 103 Ų | 103 | 141 Ų | 141 | 72% | 0.72 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 120.2 | 167.4 | 53 | 0 | 0 | 0 | 0 | 108.1 | Y23 | Y23-S25 VanDerWaalsContact C-N 3.31Å; Y23-S25 PolarHBondContact O-N 3.09Å |
| 26 | D | 41.5 | Very low | 41.2 | Very low | 141 Ų | 141 | 138.6 Ų | 138.6 | 75% | 0.754 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 135.9 | 168.8 | -69.1 | -44.8 | 0 | 0 | 0 | 109.4 | Q24 V28 | Q24-D26 PolarHBondContact O-N 3.24Å; D26-V28 PolarHBondContact O-N 2.95Å; D26-V28 VanDerWaalsContact O-N 3.13Å |
| 27 | P | 46.1 | Very low | 41 | Very low | 113 Ų | 113 | 138.9 Ų | 138.9 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -63 | 119.7 | 177.7 | 25.2 | -31.9 | 0 | 0 | 0 | 109.4 | T29 | P27-T29 PolarHBondContact O-N 3.29Š|
| 28 | V | 46.6 | Very low | 40.5 | Very low | 108 Ų | 108 | 140.6 Ų | 140.6 | 66% | 0.655 | 78% | 0.775 | S | S | * | * | trans | -67.6 | 103.5 | 167.7 | -178.6 | 0 | 0 | 0 | 0 | 107.3 | D26 Y30 | D26-V28 PolarHBondContact O-N 2.95Å; D26-V28 VanDerWaalsContact O-N 3.13Å; V28-Y30 HydrophobicContact CB-CE2 4.14Å; V28-Y30 HydrophobicContact CG1-CD2 4.26Å; V28-Y30 HydrophobicContact CG1-CE2 3.87Å; V28-Y30 WeakPolarHBondContact O-CD2 3.43Å; V28-Y30 PolarHBondContact O-N 2.98Å | ||
| 29 | T | 41.3 | Very low | 40.8 | Very low | 123 Ų | 123 | 141.4 Ų | 141.4 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | trans | -68.1 | 99.4 | 174.1 | -59.9 | 0 | 0 | 0 | 0 | 109.1 | P27 | P27-T29 PolarHBondContact O-N 3.29Š| ||
| 30 | Y | 39.8 | Very low | 40.6 | Very low | 193 Ų | 193 | 138.7 Ų | 138.7 | 76% | 0.757 | 77% | 0.773 | S | S | * | * | trans | -75.7 | 119.8 | 165.3 | -71.4 | -85.5 | 0 | 0 | 0 | 108.8 | V28 Q32 | V28-Y30 HydrophobicContact CB-CE2 4.14Å; V28-Y30 HydrophobicContact CG1-CD2 4.26Å; V28-Y30 HydrophobicContact CG1-CE2 3.87Å; V28-Y30 WeakPolarHBondContact O-CD2 3.43Å; V28-Y30 PolarHBondContact O-N 2.98Å; Y30-Q32 VanDerWaalsContact C-N 3.35Å; Y30-Q32 PolarHBondContact O-N 3.07Å | ||
| 31 | Q | 39.7 | Very low | 40.5 | Very low | 182 Ų | 182 | 139 Ų | 139 | 85% | 0.85 | 78% | 0.776 | S | S | * | * | trans | -68 | 95.7 | 168.3 | -78.3 | -174 | -22.2 | 0 | 0 | 108.8 | S33 | Q31-S33 PolarHBondContact O-N 3.01Å; Q31-S33 VanDerWaalsContact O-N 3.09Å | ||
| 32 | Q | 37.6 | Very low | 40.3 | Very low | 186 Ų | 186 | 138.2 Ų | 138.2 | 87% | 0.869 | 78% | 0.781 | S | S | * | * | trans | -67.5 | 98.8 | 166.3 | -84.6 | 172.1 | -6.3 | 0 | 0 | 109 | Y30 A34 | Y30-Q32 VanDerWaalsContact C-N 3.35Å; Y30-Q32 PolarHBondContact O-N 3.07Å; Q32-A34 PolarHBondContact O-N 3.33Å | ||
| 33 | S | 42 | Very low | 40 | Very low | 113 Ų | 113 | 139.2 Ų | 139.2 | 79% | 0.79 | 79% | 0.787 | S | S | * | * | trans | -81.3 | 98.6 | 165 | -64.4 | 0 | 0 | 0 | 0 | 109.6 | Q31 | Q31-S33 PolarHBondContact O-N 3.01Å; Q31-S33 VanDerWaalsContact O-N 3.09Å | ||
| 34 | A | 42.4 | Very low | 39.9 | Very low | 85 Ų | 85 | 132.3 Ų | 132.3 | 70% | 0.702 | 78% | 0.782 | S | S | * | * | trans | 37 | 111 | 150.4 | 0 | 0 | 0 | 0 | 0 | 119.5 | Q32 | Q32-A34 PolarHBondContact O-N 3.33Š| ||
| 35 | V | 36.2 | Very low | 39.9 | Very low | 142 Ų | 142 | 132.4 Ų | 132.4 | 86% | 0.861 | 79% | 0.787 | S | S | * | * | trans | -47.2 | 133.7 | 155.7 | 178.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 36 | V | 42.4 | Very low | 39.3 | Very low | 132 Ų | 132 | 136.1 Ų | 136.1 | 80% | 0.8 | 79% | 0.793 | S | S | * | * | trans | -126.7 | 130.1 | 160.7 | -165.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 37 | P | 35.4 | Very low | 39.2 | Very low | 105 Ų | 105 | 136.8 Ų | 136.8 | 68% | 0.682 | 80% | 0.797 | S | S | * | * | trans | -87.6 | 163 | -156.9 | 34.8 | -35.1 | 0 | 0 | 0 | 114.5 | ||||
| 38 | D | 32.1 | Very low | 38.9 | Very low | 152 Ų | 152 | 138.9 Ų | 138.9 | 81% | 0.813 | 80% | 0.797 | S | S | * | * | trans | -40.4 | 135 | 175.6 | -143.3 | -9.5 | 0 | 0 | 0 | 114.7 | ||||
| 39 | V | 45.3 | Very low | 38.6 | Very low | 133 Ų | 133 | 144.3 Ų | 144.3 | 81% | 0.806 | 81% | 0.805 | S | S | * | * | trans | -131.6 | 103.7 | 168 | -178.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 40 | Q | 33.6 | Very low | 38.7 | Very low | 180 Ų | 180 | 144.3 Ų | 144.3 | 84% | 0.841 | 81% | 0.807 | S | S | * | * | trans | -59.4 | 140.6 | 158.5 | -63.1 | 169.3 | -19.2 | 0 | 0 | 110.1 | ||||
| 41 | G | 34.5 | Very low | 38.7 | Very low | 70 Ų | 70 | 139.4 Ų | 139.4 | 72% | 0.722 | 81% | 0.807 | S | S | * | * | trans | 142.6 | 105.4 | 152.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 42 | A | 40 | Very low | 39 | Very low | 101 Ų | 101 | 139 Ų | 139 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | 47 | 120.5 | 123.7 | 0 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 43 | N | 33.7 | Very low | 38.8 | Very low | 177 Ų | 177 | 134 Ų | 134 | 95% | 0.947 | 81% | 0.809 | S | S | * | * | trans | -10.4 | 120.1 | 150.2 | -74.8 | -29.9 | 0 | 0 | 0 | 116.7 | ||||
| 44 | G | 39.3 | Very low | 38.7 | Very low | 73 Ų | 73 | 136 Ų | 136 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | trans | -165.2 | 108.8 | 164 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 45 | L | 40 | Very low | 38.2 | Very low | 168 Ų | 168 | 137.7 Ų | 137.7 | 88% | 0.88 | 82% | 0.818 | S | S | * | * | trans | -58.1 | 137.9 | 171 | -78.7 | 77.6 | 0 | 0 | 0 | 110.8 | ||||
| 46 | Q | 35.3 | Very low | 38.3 | Very low | 181 Ų | 181 | 133.5 Ų | 133.5 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | trans | -166.5 | 127.7 | 135.3 | -107.7 | 157.7 | 59.9 | 0 | 0 | 113.3 | ||||
| 47 | D | 40.8 | Very low | 37.8 | Very low | 156 Ų | 156 | 131 Ų | 131 | 83% | 0.834 | 80% | 0.804 | S | S | * | * | trans | 58 | 144.1 | 140.8 | -86.9 | -39.6 | 0 | 0 | 0 | 124.4 | ||||
| 48 | Q | 39.2 | Very low | 38.1 | Very low | 157 Ų | 157 | 132.4 Ų | 132.4 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | trans | -90.3 | 152.8 | -168.8 | -61.5 | 172.4 | 3.7 | 0 | 0 | 113.6 | ||||
| 49 | R | 40.9 | Very low | 38.5 | Very low | 221 Ų | 221 | 130.3 Ų | 130.3 | 83% | 0.834 | 80% | 0.803 | S | S | * | * | trans | 101 | 155.1 | 147.6 | -59.4 | -168.9 | -154.3 | -158 | 6 | 117.8 | ||||
| 50 | P | 41.9 | Very low | 38.4 | Very low | 123 Ų | 123 | 128 Ų | 128 | 80% | 0.799 | 80% | 0.798 | S | S | * | * | cis | -133.5 | 179.6 | -36.1 | 34.2 | -15.6 | 0 | 0 | 0 | 113.3 | ||||
| 51 | A | 40.7 | Very low | 39 | Very low | 90 Ų | 90 | 127.6 Ų | 127.6 | 74% | 0.744 | 79% | 0.794 | S | S | * | * | trans | -50.1 | 140.8 | -174 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 52 | D | 45.1 | Very low | 39.9 | Very low | 174 Ų | 174 | 133.4 Ų | 133.4 | 93% | 0.93 | 80% | 0.802 | S | S | * | * | trans | -148.4 | 130.7 | 141.3 | -89.9 | -35.5 | 0 | 0 | 0 | 109.4 | ||||
| 53 | G | 33.7 | Very low | 40.7 | Very low | 81 Ų | 81 | 136 Ų | 136 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | trans | -76 | 139.2 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 54 | N | 39.5 | Very low | 42.5 | Very low | 154 Ų | 154 | 131.8 Ų | 131.8 | 82% | 0.824 | 77% | 0.773 | S | S | * | * | trans | -150.6 | 104 | 145.9 | -167 | 25.4 | 0 | 0 | 0 | 109.7 | G56 | N54-G56 PolarHBondContact O-N 3.23Š| ||
| 55 | S | 33.6 | Very low | 44 | Very low | 122 Ų | 122 | 130.6 Ų | 130.6 | 85% | 0.853 | 75% | 0.753 | S | S | * | * | trans | -68.6 | 97.4 | 167.3 | 48.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 56 | G | 36.5 | Very low | 45.7 | Very low | 53 Ų | 53 | 125.2 Ų | 125.2 | 55% | 0.546 | 73% | 0.732 | S | S | . | * | trans | -124.9 | 96.7 | 169.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | N54 V58 | N54-G56 PolarHBondContact O-N 3.23Å; G56-V58 WeakPolarHBondContact O-CG2 3.46Å; G56-V58 PolarHBondContact O-N 3.3Å; G56-V58 VanDerWaalsContact O-N 3.09Å | ||
| 57 | G | 32.3 | Very low | 47.7 | Very low | 81 Ų | 81 | 119.5 Ų | 119.5 | 84% | 0.835 | 71% | 0.712 | S | S | * | * | trans | -57.9 | 110.8 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 58 | V | 41.9 | Very low | 49.5 | Very low | 134 Ų | 134 | 116.5 Ų | 116.5 | 81% | 0.812 | 69% | 0.694 | S | S | * | * | trans | -99.8 | 80 | 167.7 | -134.3 | 0 | 0 | 0 | 0 | 106.8 | G56 A60 | G56-V58 WeakPolarHBondContact O-CG2 3.46Å; G56-V58 PolarHBondContact O-N 3.3Å; G56-V58 VanDerWaalsContact O-N 3.09Å; V58-A60 PolarHBondContact O-N 3.45Å; V58-A60 VanDerWaalsContact O-N 3.09Å | ||
| 59 | T | 41.8 | Very low | 51.2 | Low | 108 Ų | 108 | 111 Ų | 111 | 66% | 0.663 | 67% | 0.673 | S | S | * | * | trans | -82 | 63.9 | 164.5 | 57.3 | 0 | 0 | 0 | 0 | 108.5 | F61 | T59-F61 VanDerWaalsContact C-N 3.29Å; T59-F61 HydrophobicContact CG2-CZ 4.48Å; T59-F61 PolarHBondContact O-N 2.84Å | ||
| 60 | A | 41.8 | Very low | 52.9 | Low | 84 Ų | 84 | 105.1 Ų | 105.1 | 69% | 0.694 | 66% | 0.658 | S | S | * | * | trans | -81.7 | 88.7 | 159.9 | 0 | 0 | 0 | 0 | 0 | 105.6 | V58 Q62 | V58-A60 PolarHBondContact O-N 3.45Å; V58-A60 VanDerWaalsContact O-N 3.09Å; A60-Q62 PolarHBondContact O-N 2.83Å | ||
| 61 | F | 47.4 | Very low | 54.8 | Low | 171 Ų | 171 | 101.7 Ų | 101.7 | 75% | 0.75 | 64% | 0.637 | S | S | * | * | trans | -57.7 | 112.9 | 177.3 | -66.9 | -81.1 | 0 | 0 | 0 | 108.1 | T59 F63 | T59-F61 VanDerWaalsContact C-N 3.29Å; T59-F61 HydrophobicContact CG2-CZ 4.48Å; T59-F61 PolarHBondContact O-N 2.84Å; F61-F63 VanDerWaalsContact C-N 3.28Å; F61-F63 PolarHBondContact O-N 2.89Å | ||
| 62 | Q | 51.9 | Low | 56.7 | Low | 192 Ų | 192 | 100 Ų | 100 | 90% | 0.897 | 62% | 0.615 | S | S | * | * | trans | -61.8 | 98.9 | 164.9 | -164.3 | 164.8 | 15.6 | 0 | 0 | 106.1 | A60 D64 | A60-Q62 PolarHBondContact O-N 2.83Å; Q62-D64 PolarHBondContact O-N 3.19Å | ||
| 63 | F | 57.6 | Low | 58.3 | Low | 155 Ų | 155 | 96.9 Ų | 96.9 | 68% | 0.68 | 60% | 0.595 | S | S | * | * | trans | -76.5 | 93 | -173.9 | -162 | -88.6 | 0 | 0 | 0 | 108.2 | F61 S65 M68 | F61-F63 VanDerWaalsContact C-N 3.28Å; F61-F63 PolarHBondContact O-N 2.89Å; F63-S65 VanDerWaalsContact CD1-OG 3.24Å; F63-S65 WeakPolarHBondContact CD1-OG 3.28Å; F63-S65 VanDerWaalsContact CE1-OG 3.28Å; F63-S65 WeakPolarHBondContact CE1-OG 3.49Å; F63-S65 PolarHBondContact O-N 3.1Å; F63-M68 HydrophobicContact CZ-SD 4.43Å | ||
| 64 | D | 71.1 | Confident | 60.7 | Low | 90 Ų | 90 | 97.5 Ų | 97.5 | 48% | 0.481 | 58% | 0.579 | S | S | . | * | trans | -88.8 | 85.1 | 173.4 | -176.3 | -2.7 | 0 | 0 | 0 | 109.5 | Q62 A66 S67 M68 | Q62-D64 PolarHBondContact O-N 3.19Å; D64-A66 PolarHBondContact O-N 3.04Å; D64-A66 WeakPolarHBondContact OD1-CB 3.32Å; D64-A66 PolarHBondContact OD1-N 3.31Å; D64-A66 VanDerWaalsContact OD1-N 3.12Å; D64-S67 WeakPolarHBondContact CB-OG 3.49Å; D64-S67 PolarHBondContact O-N 3.37Å; D64-S67 VanDerWaalsContact O-N 3.13Å; D64-S67 PolarHBondContact O-OG 2.87Å; D64-S67 PolarHBondContact OD1-N 3.35Å; D64-S67 VanDerWaalsContact OD1-N 3.12Å; D64-S67 WeakPolarHBondContact OD2-CB 3.42Å; D64-M68 PolarHBondContact O-N 3.4Å | ||
| 65 | S | 71.1 | Confident | 62.9 | Low | 48 Ų | 48 | 94.5 Ų | 94.5 | 34% | 0.336 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -54.4 | -31.3 | 176.9 | -53.5 | 0 | 0 | 0 | 0 | 112.7 | F63 M68 S69 | F63-S65 VanDerWaalsContact CD1-OG 3.24Å; F63-S65 WeakPolarHBondContact CD1-OG 3.28Å; F63-S65 VanDerWaalsContact CE1-OG 3.28Å; F63-S65 WeakPolarHBondContact CE1-OG 3.49Å; F63-S65 PolarHBondContact O-N 3.1Å; S65-M68 PolarHBondContact O-N 2.85Å; S65-S69 WeakPolarHBondContact O-CB 3.42Å; S65-S69 PolarHBondContact O-N 3.17Å; S65-S69 PolarHBondContact O-OG 3.22Å |
| 66 | A | 74.9 | Confident | 65.3 | Low | 54 Ų | 54 | 91.3 Ų | 91.3 | 45% | 0.446 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -70.4 | -43.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | D64 M68 S69 L70 | D64-A66 PolarHBondContact O-N 3.04Å; D64-A66 WeakPolarHBondContact OD1-CB 3.32Å; D64-A66 PolarHBondContact OD1-N 3.31Å; D64-A66 VanDerWaalsContact OD1-N 3.12Å; A66-M68 VanDerWaalsContact C-N 3.29Å; A66-M68 PolarHBondContact O-N 3.34Å; A66-S69 WeakPolarHBondContact CA-OG 3.41Å; A66-S69 PolarHBondContact O-N 2.92Å; A66-S69 PolarHBondContact O-OG 2.87Å; A66-L70 WeakPolarHBondContact O-CB 3.25Å; A66-L70 WeakPolarHBondContact O-CD1 3.46Å; A66-L70 WeakPolarHBondContact O-CG 3.38Å; A66-L70 PolarHBondContact O-N 3.29Å |
| 67 | S | 78.2 | Confident | 67.6 | Low | 62 Ų | 62 | 91.3 Ų | 91.3 | 43% | 0.434 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.2 | -38.3 | 174.9 | 74.5 | 0 | 0 | 0 | 0 | 112.6 | D64 S71 | D64-S67 WeakPolarHBondContact CB-OG 3.49Å; D64-S67 PolarHBondContact O-N 3.37Å; D64-S67 VanDerWaalsContact O-N 3.13Å; D64-S67 PolarHBondContact O-OG 2.87Å; D64-S67 PolarHBondContact OD1-N 3.35Å; D64-S67 VanDerWaalsContact OD1-N 3.12Å; D64-S67 WeakPolarHBondContact OD2-CB 3.42Å; S67-S71 PolarHBondContact O-N 2.96Å; S67-S71 PolarHBondContact O-OG 2.94Å |
| 68 | M | 78.6 | Confident | 70.5 | Confident | 92 Ų | 92 | 91.6 Ų | 91.6 | 45% | 0.453 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -73.7 | -39.6 | -179.7 | -165.9 | 166.8 | -177.9 | 0 | 0 | 112.1 | F63 D64 S65 A66 S71 I72 | F63-M68 HydrophobicContact CZ-SD 4.43Å; D64-M68 PolarHBondContact O-N 3.4Å; S65-M68 PolarHBondContact O-N 2.85Å; A66-M68 VanDerWaalsContact C-N 3.29Å; A66-M68 PolarHBondContact O-N 3.34Å; M68-S71 PolarHBondContact O-N 3.2Å; M68-S71 PolarHBondContact O-OG 3.38Å; M68-I72 HydrophobicContact CG-CD1 4.27Å; M68-I72 WeakPolarHBondContact O-CD1 3.32Å; M68-I72 VanDerWaalsContact O-CG1 3.24Å; M68-I72 WeakPolarHBondContact O-CG1 3.47Å; M68-I72 PolarHBondContact O-N 3.4Å |
| 69 | S | 75.2 | Confident | 72.7 | Confident | 42 Ų | 42 | 89.9 Ų | 89.9 | 29% | 0.294 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.2 | -40 | 174.2 | 55.8 | 0 | 0 | 0 | 0 | 112.2 | S65 A66 I72 Q73 | S65-S69 WeakPolarHBondContact O-CB 3.42Å; S65-S69 PolarHBondContact O-N 3.17Å; S65-S69 PolarHBondContact O-OG 3.22Å; A66-S69 WeakPolarHBondContact CA-OG 3.41Å; A66-S69 PolarHBondContact O-N 2.92Å; A66-S69 PolarHBondContact O-OG 2.87Å; S69-I72 PolarHBondContact O-N 2.99Å; S69-Q73 WeakPolarHBondContact O-CG 3.48Å; S69-Q73 PolarHBondContact O-N 3.17Å |
| 70 | L | 77.2 | Confident | 75.1 | Confident | 98 Ų | 98 | 86.3 Ų | 86.3 | 51% | 0.513 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.4 | -42.3 | 173.1 | -80.6 | 159.4 | 0 | 0 | 0 | 112.3 | A66 Q73 N74 | A66-L70 WeakPolarHBondContact O-CB 3.25Å; A66-L70 WeakPolarHBondContact O-CD1 3.46Å; A66-L70 WeakPolarHBondContact O-CG 3.38Å; A66-L70 PolarHBondContact O-N 3.29Å; L70-Q73 PolarHBondContact O-N 3.5Å; L70-N74 WeakPolarHBondContact O-CB 3.46Å; L70-N74 VanDerWaalsContact O-CG 3.29Å; L70-N74 PolarHBondContact O-N 3.35Å; L70-N74 PolarHBondContact O-ND2 3.02Å; L70-N74 VanDerWaalsContact O-ND2 3.17Å |
| 71 | S | 81.4 | Confident | 77.5 | Confident | 51 Ų | 51 | 87.5 Ų | 87.5 | 36% | 0.357 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -66.4 | -39.9 | 178.5 | 69 | 0 | 0 | 0 | 0 | 112.1 | S67 M68 N74 N75 | S67-S71 PolarHBondContact O-N 2.96Å; S67-S71 PolarHBondContact O-OG 2.94Å; M68-S71 PolarHBondContact O-N 3.2Å; M68-S71 PolarHBondContact O-OG 3.38Å; S71-N74 PolarHBondContact O-N 3.01Å; S71-N75 WeakPolarHBondContact O-CB 3.43Å; S71-N75 PolarHBondContact O-N 2.87Å; S71-N75 PolarHBondContact O-OD1 3.03Å |
| 72 | I | 80.4 | Confident | 79.7 | Confident | 53 Ų | 53 | 85 Ų | 85 | 27% | 0.272 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -60.8 | -49.1 | 173.6 | -67.3 | 162.6 | 0 | 0 | 0 | 110.6 | M68 S69 N74 N75 T76 Y116 | M68-I72 HydrophobicContact CG-CD1 4.27Å; M68-I72 WeakPolarHBondContact O-CD1 3.32Å; M68-I72 VanDerWaalsContact O-CG1 3.24Å; M68-I72 WeakPolarHBondContact O-CG1 3.47Å; M68-I72 PolarHBondContact O-N 3.4Å; S69-I72 PolarHBondContact O-N 2.99Å; I72-N74 VanDerWaalsContact C-N 3.32Å; I72-N74 PolarHBondContact O-N 3.41Å; I72-N75 PolarHBondContact O-N 3.48Å; I72-T76 PolarHBondContact O-N 2.93Å; I72-T76 PolarHBondContact O-OG1 3.1Å; I72-T76 VanDerWaalsContact O-OG1 3.1Å; I72-Y116 HydrophobicContact CD1-CD2 3.81Å; I72-Y116 HydrophobicContact CD1-CG 4.01Å |
| 73 | Q | 78.5 | Confident | 81.7 | Confident | 110 Ų | 110 | 77.7 Ų | 77.7 | 51% | 0.514 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -59.6 | -41.9 | 178.8 | -74.6 | 177.7 | -6.9 | 0 | 0 | 112.5 | S69 L70 T76 A77 | S69-Q73 WeakPolarHBondContact O-CG 3.48Å; S69-Q73 PolarHBondContact O-N 3.17Å; L70-Q73 PolarHBondContact O-N 3.5Å; Q73-T76 PolarHBondContact O-N 3.44Å; Q73-A77 WeakPolarHBondContact O-CB 3.44Å; Q73-A77 PolarHBondContact O-N 3.47Å |
| 74 | N | 82.9 | Confident | 83.4 | Confident | 94 Ų | 94 | 73.8 Ų | 73.8 | 50% | 0.503 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -65.8 | -41.2 | 176.8 | -73.9 | -31.6 | 0 | 0 | 0 | 111.9 | L70 S71 I72 A77 N78 | L70-N74 WeakPolarHBondContact O-CB 3.46Å; L70-N74 VanDerWaalsContact O-CG 3.29Å; L70-N74 PolarHBondContact O-N 3.35Å; L70-N74 PolarHBondContact O-ND2 3.02Å; L70-N74 VanDerWaalsContact O-ND2 3.17Å; S71-N74 PolarHBondContact O-N 3.01Å; I72-N74 VanDerWaalsContact C-N 3.32Å; I72-N74 PolarHBondContact O-N 3.41Å; N74-A77 PolarHBondContact O-N 3.45Å; N74-N78 WeakPolarHBondContact O-CB 3.42Å; N74-N78 VanDerWaalsContact O-CG 3.23Å; N74-N78 PolarHBondContact O-N 3.4Å; N74-N78 PolarHBondContact O-ND2 2.92Å |
| 75 | N | 85.7 | Confident | 84.5 | Confident | 90 Ų | 90 | 72.4 Ų | 72.4 | 48% | 0.481 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -61.3 | -48.6 | 176.1 | -70.7 | -9.8 | 0 | 0 | 0 | 110.9 | S71 I72 A77 N78 E79 | S71-N75 WeakPolarHBondContact O-CB 3.43Å; S71-N75 PolarHBondContact O-N 2.87Å; S71-N75 PolarHBondContact O-OD1 3.03Å; I72-N75 PolarHBondContact O-N 3.48Å; N75-A77 VanDerWaalsContact C-N 3.28Å; N75-A77 PolarHBondContact O-N 3.19Å; N75-N78 PolarHBondContact O-N 3.12Å; N75-E79 WeakPolarHBondContact O-CB 3.24Å; N75-E79 VanDerWaalsContact O-CG 3.32Å; N75-E79 WeakPolarHBondContact O-CG 3.24Å; N75-E79 PolarHBondContact O-N 3.12Å |
| 76 | T | 84.3 | Confident | 85.5 | Confident | 55 Ų | 55 | 75.2 Ų | 75.2 | 34% | 0.337 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -60.7 | -37.3 | 176.7 | -52.4 | 0 | 0 | 0 | 0 | 112.3 | I72 Q73 L80 L108 | I72-T76 PolarHBondContact O-N 2.93Å; I72-T76 PolarHBondContact O-OG1 3.1Å; I72-T76 VanDerWaalsContact O-OG1 3.1Å; Q73-T76 PolarHBondContact O-N 3.44Å; T76-L80 WeakPolarHBondContact O-CB 3.28Å; T76-L80 PolarHBondContact O-N 3.18Å; T76-L108 HydrophobicContact CG2-CD2 4.05Å |
| 77 | A | 86.4 | Confident | 86.2 | Confident | 54 Ų | 54 | 73.4 Ų | 73.4 | 45% | 0.446 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -68 | -39.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q73 N74 N75 L81 | Q73-A77 WeakPolarHBondContact O-CB 3.44Å; Q73-A77 PolarHBondContact O-N 3.47Å; N74-A77 PolarHBondContact O-N 3.45Å; N75-A77 VanDerWaalsContact C-N 3.28Å; N75-A77 PolarHBondContact O-N 3.19Å; A77-L81 PolarHBondContact O-N 3.31Å; A77-L81 VanDerWaalsContact O-N 3.11Å |
| 78 | N | 91.3 | Very high | 86.8 | Confident | 86 Ų | 86 | 78.6 Ų | 78.6 | 46% | 0.46 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -66.7 | -47.2 | 175.3 | -69.7 | -27.7 | 0 | 0 | 0 | 111.1 | N74 N75 L80 L81 E82 | N74-N78 WeakPolarHBondContact O-CB 3.42Å; N74-N78 VanDerWaalsContact O-CG 3.23Å; N74-N78 PolarHBondContact O-N 3.4Å; N74-N78 PolarHBondContact O-ND2 2.92Å; N75-N78 PolarHBondContact O-N 3.12Å; N78-L80 VanDerWaalsContact C-N 3.29Å; N78-L80 PolarHBondContact O-N 3.13Å; N78-L81 WeakPolarHBondContact O-CB 3.38Å; N78-L81 PolarHBondContact O-N 2.93Å; N78-E82 WeakPolarHBondContact O-CG 3.31Å; N78-E82 PolarHBondContact O-N 3.36Å |
| 79 | E | 89.7 | Confident | 87.4 | Confident | 98 Ų | 98 | 81.3 Ų | 81.3 | 46% | 0.458 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -55.8 | -44.5 | 174.9 | -74.1 | 170.8 | -177.4 | 0 | 0 | 111.3 | N75 L81 E82 L83 | N75-E79 WeakPolarHBondContact O-CB 3.24Å; N75-E79 VanDerWaalsContact O-CG 3.32Å; N75-E79 WeakPolarHBondContact O-CG 3.24Å; N75-E79 PolarHBondContact O-N 3.12Å; E79-L81 VanDerWaalsContact C-N 3.31Å; E79-L81 PolarHBondContact O-N 3.03Å; E79-E82 PolarHBondContact O-N 3.17Å; E79-L83 WeakPolarHBondContact O-CB 3.41Å; E79-L83 VanDerWaalsContact O-CG 3.25Å; E79-L83 WeakPolarHBondContact O-CG 3.32Å; E79-L83 PolarHBondContact O-N 3.04Å |
| 80 | L | 90.9 | Very high | 88 | Confident | 33 Ų | 33 | 81.1 Ų | 81.1 | 17% | 0.173 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -62.9 | -37.4 | 177 | 179.1 | 61.3 | 0 | 0 | 0 | 112.5 | T76 N78 K84 I105 L108 Q109 | T76-L80 WeakPolarHBondContact O-CB 3.28Å; T76-L80 PolarHBondContact O-N 3.18Å; N78-L80 VanDerWaalsContact C-N 3.29Å; N78-L80 PolarHBondContact O-N 3.13Å; L80-K84 HydrophobicContact CD1-CD 4.46Å; L80-K84 HydrophobicContact CG-CD 4.4Å; L80-K84 WeakPolarHBondContact O-CB 3.33Å; L80-K84 VanDerWaalsContact O-CG 3.26Å; L80-K84 WeakPolarHBondContact O-CG 3.36Å; L80-K84 PolarHBondContact O-N 3.05Å; L80-K84 VanDerWaalsContact O-N 3.08Å; L80-I105 HydrophobicContact CD1-CB 4.42Å; L80-I105 HydrophobicContact CD1-CG1 4.45Å; L80-I105 HydrophobicContact CD1-CG2 4.02Å; L80-L108 HydrophobicContact CB-CD1 4.41Å; L80-L108 HydrophobicContact CD1-CB 4.02Å; L80-L108 HydrophobicContact CD1-CD1 4.37Å; L80-Q109 HydrophobicContact CD1-CG 3.83Å; L80-Q109 HydrophobicContact CD2-CG 3.93Å |
| 81 | L | 92.8 | Very high | 88.6 | Confident | 109 Ų | 109 | 79.9 Ų | 79.9 | 57% | 0.571 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -68.7 | -44.8 | 176.9 | 177.8 | 63.5 | 0 | 0 | 0 | 111.4 | A77 N78 E79 K84 T85 | A77-L81 PolarHBondContact O-N 3.31Å; A77-L81 VanDerWaalsContact O-N 3.11Å; N78-L81 WeakPolarHBondContact O-CB 3.38Å; N78-L81 PolarHBondContact O-N 2.93Å; E79-L81 VanDerWaalsContact C-N 3.31Å; E79-L81 PolarHBondContact O-N 3.03Å; L81-K84 PolarHBondContact O-N 3.4Å; L81-T85 PolarHBondContact O-N 3.38Å; L81-T85 PolarHBondContact O-OG1 3.08Å |
| 82 | E | 93.4 | Very high | 88.8 | Confident | 119 Ų | 119 | 80.7 Ų | 80.7 | 56% | 0.556 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -60.1 | -50.4 | 176.4 | -72.5 | 176.2 | -166.4 | 0 | 0 | 110.6 | N78 E79 K84 T85 E86 | N78-E82 WeakPolarHBondContact O-CG 3.31Å; N78-E82 PolarHBondContact O-N 3.36Å; E79-E82 PolarHBondContact O-N 3.17Å; E82-K84 PolarHBondContact O-N 3.15Å; E82-T85 WeakPolarHBondContact O-CB 3.26Å; E82-T85 PolarHBondContact O-N 3.47Å; E82-T85 VanDerWaalsContact O-N 3.1Å; E82-E86 WeakPolarHBondContact O-CG 3.28Å; E82-E86 PolarHBondContact O-N 3.11Å |
| 83 | L | 93.6 | Very high | 89.4 | Confident | 38 Ų | 38 | 84.2 Ų | 84.2 | 20% | 0.199 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -57.3 | -47.6 | 177 | -72.1 | 170.2 | 0 | 0 | 0 | 111.4 | E79 T85 E86 A87 L101 E104 I105 L108 | E79-L83 WeakPolarHBondContact O-CB 3.41Å; E79-L83 VanDerWaalsContact O-CG 3.25Å; E79-L83 WeakPolarHBondContact O-CG 3.32Å; E79-L83 PolarHBondContact O-N 3.04Å; L83-T85 VanDerWaalsContact C-N 3.27Å; L83-T85 PolarHBondContact O-N 3.29Å; L83-E86 PolarHBondContact O-N 3.05Å; L83-A87 PolarHBondContact O-N 2.98Å; L83-L101 HydrophobicContact CD2-CD1 4.18Å; L83-L101 HydrophobicContact CD2-CG 4.11Å; L83-L101 WeakPolarHBondContact O-CD2 2.86Å; L83-E104 HydrophobicContact CD1-CB 4.33Å; L83-E104 HydrophobicContact CD1-CG 3.73Å; L83-I105 HydrophobicContact CB-CD1 4.31Å; L83-I105 HydrophobicContact CB-CG1 3.84Å; L83-L108 HydrophobicContact CD1-CD1 3.53Å |
| 84 | K | 93 | Very high | 90 | Very high | 74 Ų | 74 | 83.1 Ų | 83.1 | 32% | 0.322 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -57.6 | -41.4 | 177.2 | -78.5 | 173.6 | 177.4 | -178.6 | 0 | 112.8 | L80 L81 E82 A87 E88 I105 | L80-K84 HydrophobicContact CD1-CD 4.46Å; L80-K84 HydrophobicContact CG-CD 4.4Å; L80-K84 WeakPolarHBondContact O-CB 3.33Å; L80-K84 VanDerWaalsContact O-CG 3.26Å; L80-K84 WeakPolarHBondContact O-CG 3.36Å; L80-K84 PolarHBondContact O-N 3.05Å; L80-K84 VanDerWaalsContact O-N 3.08Å; L81-K84 PolarHBondContact O-N 3.4Å; E82-K84 PolarHBondContact O-N 3.15Å; K84-A87 VanDerWaalsContact O-CB 3.31Å; K84-A87 WeakPolarHBondContact O-CB 3.42Å; K84-A87 PolarHBondContact O-N 3.03Å; K84-E88 PolarHBondContact O-N 2.97Å; K84-I105 HydrophobicContact CB-CD1 4.41Å; K84-I105 HydrophobicContact CG-CD1 3.83Å; K84-I105 HydrophobicContact CG-CG1 4.29Å; K84-I105 HydrophobicContact CG-CG2 4.21Å |
| 85 | T | 94.1 | Very high | 90.3 | Very high | 60 Ų | 60 | 84.4 Ų | 84.4 | 37% | 0.368 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -65.2 | -44.8 | 178 | -53.3 | 0 | 0 | 0 | 0 | 110.8 | L81 E82 L83 A87 E88 M89 | L81-T85 PolarHBondContact O-N 3.38Å; L81-T85 PolarHBondContact O-OG1 3.08Å; E82-T85 WeakPolarHBondContact O-CB 3.26Å; E82-T85 PolarHBondContact O-N 3.47Å; E82-T85 VanDerWaalsContact O-N 3.1Å; L83-T85 VanDerWaalsContact C-N 3.27Å; L83-T85 PolarHBondContact O-N 3.29Å; T85-A87 VanDerWaalsContact C-N 3.33Å; T85-A87 PolarHBondContact O-N 3.35Å; T85-E88 PolarHBondContact O-N 2.86Å; T85-M89 HydrophobicContact CG2-CE 3.88Å; T85-M89 WeakPolarHBondContact O-CG 3.45Å; T85-M89 PolarHBondContact O-N 3.12Å |
| 86 | E | 92.4 | Very high | 90.7 | Very high | 108 Ų | 108 | 86.6 Ų | 86.6 | 51% | 0.505 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63 | -38.1 | 175.7 | -72.1 | -174.8 | -172.1 | 0 | 0 | 112.3 | E82 L83 E88 M89 I90 L101 | E82-E86 WeakPolarHBondContact O-CG 3.28Å; E82-E86 PolarHBondContact O-N 3.11Å; L83-E86 PolarHBondContact O-N 3.05Å; E86-E88 PolarHBondContact O-N 3.39Å; E86-M89 PolarHBondContact O-N 3.34Å; E86-I90 VanDerWaalsContact O-CG1 3.32Å; E86-I90 WeakPolarHBondContact O-CG1 3.46Å; E86-I90 PolarHBondContact O-N 3.09Å; E86-L101 HydrophobicContact CB-CD1 3.67Å |
| 87 | A | 90.6 | Very high | 91.1 | Very high | 16 Ų | 16 | 85.8 Ų | 85.8 | 13% | 0.132 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -54.2 | -40 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | L83 K84 T85 L101 I105 | L83-A87 PolarHBondContact O-N 2.98Å; K84-A87 VanDerWaalsContact O-CB 3.31Å; K84-A87 WeakPolarHBondContact O-CB 3.42Å; K84-A87 PolarHBondContact O-N 3.03Å; T85-A87 VanDerWaalsContact C-N 3.33Å; T85-A87 PolarHBondContact O-N 3.35Å; A87-L101 HydrophobicContact CB-CD2 3.2Å; A87-I105 HydrophobicContact CB-CD1 3.91Å |
| 88 | E | 90.2 | Very high | 91.3 | Very high | 171 Ų | 171 | 87.4 Ų | 87.4 | 80% | 0.799 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -75.7 | -29.5 | -178.6 | -67.7 | 179.7 | 179.5 | 0 | 0 | 112 | K84 T85 E86 | K84-E88 PolarHBondContact O-N 2.97Å; T85-E88 PolarHBondContact O-N 2.86Å; E86-E88 PolarHBondContact O-N 3.39Å |
| 89 | M | 91.1 | Very high | 91.4 | Very high | 149 Ų | 149 | 88.7 Ų | 88.7 | 73% | 0.734 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -87.7 | -18.7 | -178.9 | -65.1 | -171.2 | -177.1 | 0 | 0 | 114 | T85 E86 | T85-M89 HydrophobicContact CG2-CE 3.88Å; T85-M89 WeakPolarHBondContact O-CG 3.45Å; T85-M89 PolarHBondContact O-N 3.12Å; E86-M89 PolarHBondContact O-N 3.34Å |
| 90 | I | 89.1 | Confident | 91.5 | Very high | 38 Ų | 38 | 88.7 Ų | 88.7 | 20% | 0.195 | 46% | 0.464 | C | S | . | . | S | Bend | trans | -62.1 | 124.6 | -178.4 | -75.9 | 166.8 | 0 | 0 | 0 | 110.5 | E86 L94 A97 K98 L101 | E86-I90 VanDerWaalsContact O-CG1 3.32Å; E86-I90 WeakPolarHBondContact O-CG1 3.46Å; E86-I90 PolarHBondContact O-N 3.09Å; I90-L94 HydrophobicContact CG2-CB 3.97Å; I90-A97 HydrophobicContact CD1-CB 4.49Å; I90-K98 HydrophobicContact CG2-CB 4.12Å; I90-L101 HydrophobicContact CD1-CB 4.31Å; I90-L101 HydrophobicContact CD1-CD1 3.69Å |
| 91 | P | 89.2 | Confident | 91.6 | Very high | 72 Ų | 72 | 87.9 Ų | 87.9 | 47% | 0.468 | 46% | 0.46 | S | S | . | . | trans | -65.5 | 139.1 | 178.3 | 28.7 | -35.7 | 0 | 0 | 0 | 110.8 | N93 L94 | P91-N93 VanDerWaalsContact CB-OD1 3.28Å; P91-N93 WeakPolarHBondContact CB-OD1 3.47Å; P91-N93 WeakPolarHBondContact CG-OD1 3.47Å; P91-N93 PolarHBondContact O-N 2.94Å; P91-N93 PolarHBondContact O-OD1 3.28Å; P91-L94 HydrophobicContact CG-CD1 3.83Å; P91-L94 HydrophobicContact CG-CG 4.09Å; P91-L94 PolarHBondContact O-N 2.99Å | ||
| 92 | G | 85 | Confident | 91.5 | Very high | 68 Ų | 68 | 86.8 Ų | 86.8 | 70% | 0.701 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | -12.8 | -170.2 | 0 | 0 | 0 | 0 | 0 | 116 | L94 | G92-L94 VanDerWaalsContact C-N 3.29Š|
| 93 | N | 92.3 | Very high | 91.3 | Very high | 126 Ų | 126 | 86 Ų | 86 | 67% | 0.674 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.8 | -20.3 | 172.4 | 63.7 | -29.9 | 0 | 0 | 0 | 112.8 | P91 I95 | P91-N93 VanDerWaalsContact CB-OD1 3.28Å; P91-N93 WeakPolarHBondContact CB-OD1 3.47Å; P91-N93 WeakPolarHBondContact CG-OD1 3.47Å; P91-N93 PolarHBondContact O-N 2.94Å; P91-N93 PolarHBondContact O-OD1 3.28Å; N93-I95 VanDerWaalsContact C-N 3.28Å; N93-I95 PolarHBondContact O-N 3.01Å |
| 94 | L | 92.2 | Very high | 91.1 | Very high | 87 Ų | 87 | 88.4 Ų | 88.4 | 46% | 0.455 | 45% | 0.454 | S | S | . | . | trans | -90.6 | 58.2 | 178 | -59.4 | -178.8 | 0 | 0 | 0 | 111.6 | I90 P91 G92 H96 A97 K98 | I90-L94 HydrophobicContact CG2-CB 3.97Å; P91-L94 HydrophobicContact CG-CD1 3.83Å; P91-L94 HydrophobicContact CG-CG 4.09Å; P91-L94 PolarHBondContact O-N 2.99Å; G92-L94 VanDerWaalsContact C-N 3.29Å; L94-H96 PolarHBondContact O-N 3.01Å; L94-H96 VanDerWaalsContact O-N 3.15Å; L94-A97 HydrophobicContact CB-CB 3.92Å; L94-A97 PolarHBondContact O-N 3.32Å; L94-K98 PolarHBondContact O-N 2.98Å | ||
| 95 | I | 90.1 | Very high | 91 | Very high | 121 Ų | 121 | 85.6 Ų | 85.6 | 62% | 0.621 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -53.7 | -40.7 | -175.3 | -57 | 170.6 | 0 | 0 | 0 | 111.6 | N93 R99 | N93-I95 VanDerWaalsContact C-N 3.28Å; N93-I95 PolarHBondContact O-N 3.01Å; I95-R99 WeakPolarHBondContact O-CB 3.47Å; I95-R99 PolarHBondContact O-N 3.01Å |
| 96 | H | 92.9 | Very high | 90.7 | Very high | 136 Ų | 136 | 87.7 Ų | 87.7 | 63% | 0.63 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -72 | -37.2 | -179.7 | -61.5 | -39.6 | 0 | 0 | 0 | 113.2 | L94 R99 L100 | L94-H96 PolarHBondContact O-N 3.01Å; L94-H96 VanDerWaalsContact O-N 3.15Å; H96-R99 PolarHBondContact O-N 3.02Å; H96-L100 VanDerWaalsContact O-CG 3.28Å; H96-L100 WeakPolarHBondContact O-CG 3.34Å; H96-L100 PolarHBondContact O-N 3.39Å |
| 97 | A | 93.1 | Very high | 90.3 | Very high | 39 Ų | 39 | 85.2 Ų | 85.2 | 32% | 0.322 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.2 | -48.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | I90 L94 R99 L100 L101 | I90-A97 HydrophobicContact CD1-CB 4.49Å; L94-A97 HydrophobicContact CB-CB 3.92Å; L94-A97 PolarHBondContact O-N 3.32Å; A97-R99 PolarHBondContact O-N 2.92Å; A97-L100 PolarHBondContact O-N 3.35Å; A97-L100 VanDerWaalsContact O-N 3.09Å; A97-L101 WeakPolarHBondContact O-CB 3.39Å; A97-L101 PolarHBondContact O-N 2.82Å |
| 98 | K | 91.3 | Very high | 89.9 | Confident | 87 Ų | 87 | 86.1 Ų | 86.1 | 38% | 0.378 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -55.8 | -47.6 | 174.9 | -177.2 | 168.6 | 176.9 | 167.3 | 0 | 112 | I90 L94 L100 L101 E102 | I90-K98 HydrophobicContact CG2-CB 4.12Å; L94-K98 PolarHBondContact O-N 2.98Å; K98-L100 VanDerWaalsContact C-N 3.32Å; K98-L100 PolarHBondContact O-N 3.19Å; K98-L101 PolarHBondContact O-N 3.01Å; K98-E102 WeakPolarHBondContact CE-OE1 3.45Å; K98-E102 HydrophobicContact CG-CG 4.27Å; K98-E102 IonicContact NZ-OE1 3.93Å; K98-E102 WeakPolarHBondContact O-CB 3.34Å; K98-E102 WeakPolarHBondContact O-CG 3.43Å; K98-E102 PolarHBondContact O-N 3.13Å |
| 99 | R | 91.7 | Very high | 89.6 | Confident | 113 Ų | 113 | 83.1 Ų | 83.1 | 43% | 0.426 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.5 | -33.4 | 176.6 | -176.1 | -163.3 | 61.4 | 88.3 | 6.1 | 113.6 | I95 H96 A97 R103 | I95-R99 WeakPolarHBondContact O-CB 3.47Å; I95-R99 PolarHBondContact O-N 3.01Å; H96-R99 PolarHBondContact O-N 3.02Å; A97-R99 PolarHBondContact O-N 2.92Å; R99-R103 WeakPolarHBondContact O-CB 3.46Å; R99-R103 PolarHBondContact O-N 3.4Å; R99-R103 PolarHBondContact O-NH1 2.91Å |
| 100 | L | 92.9 | Very high | 88.8 | Confident | 98 Ų | 98 | 78.7 Ų | 78.7 | 51% | 0.513 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -70.6 | -46.2 | 177.2 | -76.2 | 172.2 | 0 | 0 | 0 | 110.2 | H96 A97 K98 R103 E104 | H96-L100 VanDerWaalsContact O-CG 3.28Å; H96-L100 WeakPolarHBondContact O-CG 3.34Å; H96-L100 PolarHBondContact O-N 3.39Å; A97-L100 PolarHBondContact O-N 3.35Å; A97-L100 VanDerWaalsContact O-N 3.09Å; K98-L100 VanDerWaalsContact C-N 3.32Å; K98-L100 PolarHBondContact O-N 3.19Å; L100-R103 WeakPolarHBondContact O-CB 3.45Å; L100-R103 PolarHBondContact O-N 3.42Å; L100-E104 PolarHBondContact O-N 3.49Å; L100-E104 VanDerWaalsContact O-N 3.12Å |
| 101 | L | 92.5 | Very high | 87.9 | Confident | 16 Ų | 16 | 78.6 Ų | 78.6 | 8% | 0.084 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -68.3 | -45.1 | -178.7 | -172.5 | 154 | 0 | 0 | 0 | 112.1 | L83 E86 A87 I90 A97 K98 R103 E104 I105 | L83-L101 HydrophobicContact CD2-CD1 4.18Å; L83-L101 HydrophobicContact CD2-CG 4.11Å; L83-L101 WeakPolarHBondContact O-CD2 2.86Å; E86-L101 HydrophobicContact CB-CD1 3.67Å; A87-L101 HydrophobicContact CB-CD2 3.2Å; I90-L101 HydrophobicContact CD1-CB 4.31Å; I90-L101 HydrophobicContact CD1-CD1 3.69Å; A97-L101 WeakPolarHBondContact O-CB 3.39Å; A97-L101 PolarHBondContact O-N 2.82Å; K98-L101 PolarHBondContact O-N 3.01Å; L101-R103 PolarHBondContact O-N 3.47Å; L101-E104 WeakPolarHBondContact O-CB 3.24Å; L101-E104 PolarHBondContact O-N 3.34Å; L101-I105 HydrophobicContact CD2-CD1 3.42Å; L101-I105 VanDerWaalsContact CD2-CD1 3.42Å; L101-I105 HydrophobicContact CD2-CG1 4.1Å; L101-I105 WeakPolarHBondContact O-CG1 3.4Å; L101-I105 PolarHBondContact O-N 3.37Å |
| 102 | E | 90.2 | Very high | 86.9 | Confident | 86 Ų | 86 | 77.4 Ų | 77.4 | 40% | 0.402 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -58.1 | -37.5 | 175 | -74.5 | 172.8 | 163.7 | 0 | 0 | 111.8 | K98 I105 D106 | K98-E102 WeakPolarHBondContact CE-OE1 3.45Å; K98-E102 HydrophobicContact CG-CG 4.27Å; K98-E102 IonicContact NZ-OE1 3.93Å; K98-E102 WeakPolarHBondContact O-CB 3.34Å; K98-E102 WeakPolarHBondContact O-CG 3.43Å; K98-E102 PolarHBondContact O-N 3.13Å; E102-I105 PolarHBondContact O-N 2.98Å; E102-D106 WeakPolarHBondContact O-CB 3.46Å; E102-D106 PolarHBondContact O-N 3.42Å |
| 103 | R | 90 | Very high | 86.5 | Confident | 103 Ų | 103 | 77.1 Ų | 77.1 | 39% | 0.389 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -64.5 | -40.9 | 174.3 | 177.9 | -170.5 | -63.6 | 75.6 | 26.8 | 111.6 | R99 L100 L101 D106 V107 | R99-R103 WeakPolarHBondContact O-CB 3.46Å; R99-R103 PolarHBondContact O-N 3.4Å; R99-R103 PolarHBondContact O-NH1 2.91Å; L100-R103 WeakPolarHBondContact O-CB 3.45Å; L100-R103 PolarHBondContact O-N 3.42Å; L101-R103 PolarHBondContact O-N 3.47Å; R103-D106 PolarHBondContact O-N 3.45Å; R103-V107 HydrophobicContact CG-CG2 4.43Å; R103-V107 WeakPolarHBondContact O-CB 3.48Å; R103-V107 WeakPolarHBondContact O-CG2 3.38Å; R103-V107 PolarHBondContact O-N 2.89Å |
| 104 | E | 89.6 | Confident | 85.7 | Confident | 88 Ų | 88 | 73.8 Ų | 73.8 | 41% | 0.411 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -66.7 | -43.3 | 179.6 | -167.8 | 60.3 | -161.2 | 0 | 0 | 111.1 | L83 L100 L101 D106 V107 L108 | L83-E104 HydrophobicContact CD1-CB 4.33Å; L83-E104 HydrophobicContact CD1-CG 3.73Å; L100-E104 PolarHBondContact O-N 3.49Å; L100-E104 VanDerWaalsContact O-N 3.12Å; L101-E104 WeakPolarHBondContact O-CB 3.24Å; L101-E104 PolarHBondContact O-N 3.34Å; E104-D106 VanDerWaalsContact C-N 3.33Å; E104-D106 PolarHBondContact O-N 2.82Å; E104-V107 WeakPolarHBondContact O-CB 3.29Å; E104-V107 PolarHBondContact O-N 3.16Å; E104-V107 VanDerWaalsContact O-N 3.16Å; E104-L108 HydrophobicContact CG-CD1 4.37Å; E104-L108 WeakPolarHBondContact O-CG 3.37Å; E104-L108 PolarHBondContact O-N 2.9Å |
| 105 | I | 90.8 | Very high | 85.1 | Confident | 15 Ų | 15 | 77.4 Ų | 77.4 | 8% | 0.077 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -55.8 | -49.4 | 171.3 | -67.8 | 172.9 | 0 | 0 | 0 | 110.4 | L80 L83 K84 A87 L101 E102 V107 L108 Q109 | L80-I105 HydrophobicContact CD1-CB 4.42Å; L80-I105 HydrophobicContact CD1-CG1 4.45Å; L80-I105 HydrophobicContact CD1-CG2 4.02Å; L83-I105 HydrophobicContact CB-CD1 4.31Å; L83-I105 HydrophobicContact CB-CG1 3.84Å; K84-I105 HydrophobicContact CB-CD1 4.41Å; K84-I105 HydrophobicContact CG-CD1 3.83Å; K84-I105 HydrophobicContact CG-CG1 4.29Å; K84-I105 HydrophobicContact CG-CG2 4.21Å; A87-I105 HydrophobicContact CB-CD1 3.91Å; L101-I105 HydrophobicContact CD2-CD1 3.42Å; L101-I105 VanDerWaalsContact CD2-CD1 3.42Å; L101-I105 HydrophobicContact CD2-CG1 4.1Å; L101-I105 WeakPolarHBondContact O-CG1 3.4Å; L101-I105 PolarHBondContact O-N 3.37Å; E102-I105 PolarHBondContact O-N 2.98Å; I105-V107 VanDerWaalsContact C-N 3.3Å; I105-V107 PolarHBondContact O-N 3.45Å; I105-L108 PolarHBondContact O-N 3.27Å; I105-Q109 HydrophobicContact CG2-CG 4.15Å; I105-Q109 VanDerWaalsContact O-CB 3.29Å; I105-Q109 WeakPolarHBondContact O-CB 3.49Å; I105-Q109 VanDerWaalsContact O-CG 3.24Å; I105-Q109 WeakPolarHBondContact O-CG 3.03Å; I105-Q109 PolarHBondContact O-N 3.32Å |
| 106 | D | 87.1 | Confident | 84.6 | Confident | 105 Ų | 105 | 77.9 Ų | 77.9 | 56% | 0.561 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -59.3 | -41 | 178.1 | -79.7 | -17.2 | 0 | 0 | 0 | 111.7 | E102 R103 E104 S110 | E102-D106 WeakPolarHBondContact O-CB 3.46Å; E102-D106 PolarHBondContact O-N 3.42Å; R103-D106 PolarHBondContact O-N 3.45Å; E104-D106 VanDerWaalsContact C-N 3.33Å; E104-D106 PolarHBondContact O-N 2.82Å; D106-S110 WeakPolarHBondContact O-CA 3.5Å; D106-S110 WeakPolarHBondContact O-CB 3.21Å; D106-S110 PolarHBondContact O-N 2.73Å; D106-S110 PolarHBondContact O-OG 3.11Å |
| 107 | V | 83.8 | Confident | 84.1 | Confident | 56 Ų | 56 | 74.7 Ų | 74.7 | 34% | 0.339 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.9 | -52.3 | 178 | 167.2 | 0 | 0 | 0 | 0 | 110.3 | R103 E104 I105 Q109 S110 G111 A112 | R103-V107 HydrophobicContact CG-CG2 4.43Å; R103-V107 WeakPolarHBondContact O-CB 3.48Å; R103-V107 WeakPolarHBondContact O-CG2 3.38Å; R103-V107 PolarHBondContact O-N 2.89Å; E104-V107 WeakPolarHBondContact O-CB 3.29Å; E104-V107 PolarHBondContact O-N 3.16Å; E104-V107 VanDerWaalsContact O-N 3.16Å; I105-V107 VanDerWaalsContact C-N 3.3Å; I105-V107 PolarHBondContact O-N 3.45Å; V107-Q109 PolarHBondContact O-N 2.97Å; V107-S110 PolarHBondContact O-N 2.9Å; V107-S110 PolarHBondContact O-OG 2.93Å; V107-G111 PolarHBondContact O-N 3.25Å; V107-A112 HydrophobicContact CG1-CB 3.79Å; V107-A112 PolarHBondContact O-N 3.3Å |
| 108 | L | 83.5 | Confident | 83.5 | Confident | 35 Ų | 35 | 75.4 Ų | 75.4 | 18% | 0.183 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -62.5 | -42 | 179 | -67.8 | 177.4 | 0 | 0 | 0 | 112.1 | T76 L80 L83 E104 I105 G111 | T76-L108 HydrophobicContact CG2-CD2 4.05Å; L80-L108 HydrophobicContact CB-CD1 4.41Å; L80-L108 HydrophobicContact CD1-CB 4.02Å; L80-L108 HydrophobicContact CD1-CD1 4.37Å; L83-L108 HydrophobicContact CD1-CD1 3.53Å; E104-L108 HydrophobicContact CG-CD1 4.37Å; E104-L108 WeakPolarHBondContact O-CG 3.37Å; E104-L108 PolarHBondContact O-N 2.9Å; I105-L108 PolarHBondContact O-N 3.27Å; L108-G111 PolarHBondContact O-N 2.82Å |
| 109 | Q | 83.6 | Confident | 82.8 | Confident | 107 Ų | 107 | 76.2 Ų | 76.2 | 50% | 0.5 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -71.1 | -34.7 | 177.7 | -71.7 | -170.2 | -60.2 | 0 | 0 | 113.3 | L80 I105 V107 G111 | L80-Q109 HydrophobicContact CD1-CG 3.83Å; L80-Q109 HydrophobicContact CD2-CG 3.93Å; I105-Q109 HydrophobicContact CG2-CG 4.15Å; I105-Q109 VanDerWaalsContact O-CB 3.29Å; I105-Q109 WeakPolarHBondContact O-CB 3.49Å; I105-Q109 VanDerWaalsContact O-CG 3.24Å; I105-Q109 WeakPolarHBondContact O-CG 3.03Å; I105-Q109 PolarHBondContact O-N 3.32Å; V107-Q109 PolarHBondContact O-N 2.97Å; Q109-G111 PolarHBondContact O-N 3.2Å |
| 110 | S | 74 | Confident | 81.9 | Confident | 56 Ų | 56 | 78.5 Ų | 78.5 | 39% | 0.392 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.8 | -6.1 | 179.8 | 72.9 | 0 | 0 | 0 | 0 | 112.9 | D106 V107 R127 | D106-S110 WeakPolarHBondContact O-CA 3.5Å; D106-S110 WeakPolarHBondContact O-CB 3.21Å; D106-S110 PolarHBondContact O-N 2.73Å; D106-S110 PolarHBondContact O-OG 3.11Å; V107-S110 PolarHBondContact O-N 2.9Å; V107-S110 PolarHBondContact O-OG 2.93Å; S110-R127 VanDerWaalsContact O-CD 3.23Å; S110-R127 WeakPolarHBondContact O-CD 3.49Å; S110-R127 PolarHBondContact O-NH1 3.27Å |
| 111 | G | 70 | Confident | 80.3 | Confident | 37 Ų | 37 | 75.5 Ų | 75.5 | 38% | 0.381 | 41% | 0.406 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.2 | 72.8 | -175.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | V107 L108 Q109 | V107-G111 PolarHBondContact O-N 3.25Å; L108-G111 PolarHBondContact O-N 2.82Å; Q109-G111 PolarHBondContact O-N 3.2Å |
| 112 | A | 69.3 | Low | 78.7 | Confident | 46 Ų | 46 | 82.2 Ų | 82.2 | 38% | 0.38 | 44% | 0.442 | S | S | . | . | P | Polyproline II helix | trans | -51.4 | 155.1 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | V107 P114 | V107-A112 HydrophobicContact CG1-CB 3.79Å; V107-A112 PolarHBondContact O-N 3.3Å; A112-P114 WeakPolarHBondContact O-CD 3.31Å; A112-P114 VanDerWaalsContact O-N 3.1Å |
| 113 | E | 75 | Confident | 77.6 | Confident | 63 Ų | 63 | 79.6 Ų | 79.6 | 29% | 0.294 | 43% | 0.434 | S | S | . | . | P | Polyproline II helix | trans | -58.8 | 118.1 | 171.3 | -60.5 | -175.9 | 169.4 | 0 | 0 | 107 | E115 L128 R130 | E113-E115 PolarHBondContact O-N 2.89Å; E113-L128 HydrophobicContact CB-CD2 4.5Å; E113-L128 HydrophobicContact CG-CD2 3.76Å; E113-L128 WeakPolarHBondContact OE1-CD2 3.23Å; E113-R130 IonicContact OE1-CZ 3.34Å; E113-R130 IonicContact OE1-NH1 2.79Å; E113-R130 PolarHBondContact OE1-NH1 3.17Å; E113-R130 IonicContact OE1-NH2 3.34Å; E113-R130 PolarHBondContact OE1-NH2 3.09Å; E113-R130 IonicContact OE2-CZ 3.5Å; E113-R130 IonicContact OE2-NH1 3.31Å; E113-R130 PolarHBondContact OE2-NH1 3.21Å; E113-R130 IonicContact OE2-NH2 2.78Å; E113-R130 PolarHBondContact OE2-NH2 2.83Å |
| 114 | P | 75.5 | Confident | 77 | Confident | 55 Ų | 55 | 81 Ų | 81 | 36% | 0.357 | 44% | 0.444 | S | S | . | . | P | Polyproline II helix | trans | -63.8 | 138.8 | -174.7 | 27.4 | -35.6 | 0 | 0 | 0 | 109.3 | A112 Y116 L117 I126 | A112-P114 WeakPolarHBondContact O-CD 3.31Å; A112-P114 VanDerWaalsContact O-N 3.1Å; P114-Y116 PolarHBondContact O-N 3.12Å; P114-L117 HydrophobicContact CG-CD2 3.65Å; P114-I126 HydrophobicContact CG-CB 4.38Å; P114-I126 HydrophobicContact CG-CG2 3.73Å |
| 115 | E | 79.8 | Confident | 76.9 | Confident | 164 Ų | 164 | 80.4 Ų | 80.4 | 77% | 0.766 | 45% | 0.448 | S | S | * | . | S | Bend | trans | -62.2 | -36.4 | 178.2 | -173.6 | -177.9 | 167.1 | 0 | 0 | 111.4 | E113 | E113-E115 PolarHBondContact O-N 2.89Š|
| 116 | Y | 79.5 | Confident | 76.8 | Confident | 131 Ų | 131 | 80.3 Ų | 80.3 | 51% | 0.514 | 45% | 0.448 | S | S | . | . | S | Bend | trans | -113.1 | 132.8 | 179.8 | -57.4 | -87 | 0 | 0 | 0 | 110.3 | I72 P114 | I72-Y116 HydrophobicContact CD1-CD2 3.81Å; I72-Y116 HydrophobicContact CD1-CG 4.01Å; P114-Y116 PolarHBondContact O-N 3.12Å |
| 117 | L | 83.8 | Confident | 77 | Confident | 69 Ų | 69 | 79.2 Ų | 79.2 | 36% | 0.361 | 44% | 0.436 | S | S | . | . | trans | -111.7 | 122.9 | 176.3 | -63.8 | 173.6 | 0 | 0 | 0 | 109.4 | P114 I126 A209 Y213 | P114-L117 HydrophobicContact CG-CD2 3.65Å; L117-I126 HydrophobicContact CD2-CD1 4.11Å; L117-I126 HydrophobicContact CD2-CG2 3.89Å; L117-A209 HydrophobicContact CD1-CB 4.26Å; L117-A209 HydrophobicContact CD2-CB 4.02Å; L117-Y213 HydrophobicContact CD1-CE2 3.91Å | ||
| 118 | D | 78.8 | Confident | 77.4 | Confident | 54 Ų | 54 | 76.5 Ų | 76.5 | 29% | 0.289 | 42% | 0.42 | S | S | . | . | trans | -85.4 | 115.7 | 165.2 | -168.4 | -15.2 | 0 | 0 | 0 | 108.9 | D120 G121 S123 | D118-D120 PolarHBondContact OD1-N 3.34Å; D118-G121 PolarHBondContact OD1-N 3.31Å; D118-S123 WeakPolarHBondContact O-CB 3.36Å; D118-S123 PolarHBondContact O-OG 2.78Å; D118-S123 VanDerWaalsContact O-OG 3.11Å | ||
| 119 | V | 78.4 | Confident | 77.9 | Confident | 103 Ų | 103 | 78.6 Ų | 78.6 | 62% | 0.624 | 43% | 0.429 | S | S | * | . | trans | -95.7 | -25.3 | -178.3 | -175.3 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 120 | D | 72.3 | Confident | 78.5 | Confident | 162 Ų | 162 | 78.7 Ų | 78.7 | 87% | 0.866 | 43% | 0.425 | S | S | * | . | S | Bend | trans | -102.7 | -8.9 | -164.6 | -66.6 | -31.2 | 0 | 0 | 0 | 113.6 | D118 | D118-D120 PolarHBondContact OD1-N 3.34Š|
| 121 | G | 58.9 | Low | 79.6 | Confident | 35 Ų | 35 | 81.2 Ų | 81.2 | 36% | 0.361 | 43% | 0.429 | S | S | . | . | S | Bend | trans | -147 | 122.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | D118 S123 | D118-G121 PolarHBondContact OD1-N 3.31Å; G121-S123 PolarHBondContact O-N 2.79Å |
| 122 | N | 59.1 | Low | 80.9 | Confident | 156 Ų | 156 | 80.9 Ų | 80.9 | 83% | 0.834 | 42% | 0.419 | S | S | * | . | trans | 43.6 | 42.6 | 165.9 | -108.2 | 50.2 | 0 | 0 | 0 | 115.2 | Q124 | N122-Q124 PolarHBondContact O-N 3.13Š| ||
| 123 | S | 67.2 | Low | 82.2 | Confident | 32 Ų | 32 | 84.5 Ų | 84.5 | 22% | 0.224 | 43% | 0.432 | C | S | . | . | trans | -49.7 | 102.8 | -171.9 | -166.9 | 0 | 0 | 0 | 0 | 110.7 | D118 G121 | D118-S123 WeakPolarHBondContact O-CB 3.36Å; D118-S123 PolarHBondContact O-OG 2.78Å; D118-S123 VanDerWaalsContact O-OG 3.11Å; G121-S123 PolarHBondContact O-N 2.79Å | ||
| 124 | Q | 77.9 | Confident | 83.2 | Confident | 131 Ų | 131 | 82 Ų | 82 | 61% | 0.612 | 42% | 0.421 | S | S | * | . | P | Polyproline II helix | trans | -57.4 | 140.1 | 178.8 | -70.7 | -67.5 | -17.5 | 0 | 0 | 108.1 | N122 I126 | N122-Q124 PolarHBondContact O-N 3.13Å; Q124-I126 PolarHBondContact O-N 3.28Å; Q124-I126 VanDerWaalsContact O-N 3.12Å |
| 125 | P | 87 | Confident | 84.1 | Confident | 76 Ų | 76 | 80.3 Ų | 80.3 | 49% | 0.494 | 41% | 0.41 | S | S | . | . | P | Polyproline II helix | trans | -56.4 | 123.6 | 178.8 | -23.5 | 32.9 | 0 | 0 | 0 | 110.5 | V206 A207 | P125-V206 HydrophobicContact CB-CG1 3.89Å; P125-A207 CarbonylContact C-O 3.55Å; P125-A207 WeakPolarHBondContact CA-O 3.44Å |
| 126 | I | 88.8 | Confident | 84.8 | Confident | 14 Ų | 14 | 75.1 Ų | 75.1 | 7% | 0.072 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.2 | 151.9 | 173 | 68.7 | 170.3 | 0 | 0 | 0 | 109.5 | P114 L117 Q124 L128 V206 A207 A209 A212 Y213 | P114-I126 HydrophobicContact CG-CB 4.38Å; P114-I126 HydrophobicContact CG-CG2 3.73Å; L117-I126 HydrophobicContact CD2-CD1 4.11Å; L117-I126 HydrophobicContact CD2-CG2 3.89Å; Q124-I126 PolarHBondContact O-N 3.28Å; Q124-I126 VanDerWaalsContact O-N 3.12Å; I126-L128 HydrophobicContact CD1-CD1 4.4Å; I126-L128 HydrophobicContact CD1-CD2 3.72Å; I126-L128 HydrophobicContact CD1-CG 4.02Å; I126-L128 HydrophobicContact CG1-CD2 4.4Å; I126-L128 HydrophobicContact CG1-CG 4.34Å; I126-V206 WeakPolarHBondContact O-CA 3.4Å; I126-A207 PolarHBondContact N-O 3.12Å; I126-A207 PolarHBondContact O-N 3.14Å; I126-A209 HydrophobicContact CD1-CB 3.87Å; I126-A209 HydrophobicContact CG1-CB 4.44Å; I126-A212 HydrophobicContact CD1-CB 4.08Å; I126-A212 HydrophobicContact CG1-CB 3.77Å; I126-Y213 HydrophobicContact CD1-CD2 4.49Å; I126-Y213 HydrophobicContact CD1-CE2 3.89Å |
| 127 | R | 90.6 | Very high | 85.4 | Confident | 81 Ų | 81 | 77.7 Ų | 77.7 | 31% | 0.306 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.3 | 115.5 | 171.6 | -173.7 | -177.7 | -172.9 | -167.8 | -0.3 | 109.3 | S110 E204 V205 V206 | S110-R127 VanDerWaalsContact O-CD 3.23Å; S110-R127 WeakPolarHBondContact O-CD 3.49Å; S110-R127 PolarHBondContact O-NH1 3.27Å; R127-E204 IonicContact CZ-OE2 2.8Å; R127-E204 IonicContact NE-OE2 3.3Å; R127-E204 VanDerWaalsContact NH2-CD 3.26Å; R127-E204 IonicContact NH2-OE1 2.86Å; R127-E204 PolarHBondContact NH2-OE1 3.27Å; R127-E204 IonicContact NH2-OE2 3.67Å; R127-E204 PolarHBondContact NH2-OE2 3.49Å; R127-V205 CarbonylContact C-O 3.58Å; R127-V205 VanDerWaalsContact CA-O 3.31Å; R127-V205 WeakPolarHBondContact CA-O 3.17Å; R127-V206 HydrophobicContact CB-CG2 4.29Å; R127-V206 HydrophobicContact CG-CG2 4.06Å |
| 128 | L | 93.1 | Very high | 85.7 | Confident | 0 Ų | 0 | 84.2 Ų | 84.2 | 0% | 0 | 43% | 0.425 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.4 | 139.6 | 170.7 | -58.6 | -180 | 0 | 0 | 0 | 109.7 | E113 I126 E204 V205 A212 Y213 L216 | E113-L128 HydrophobicContact CB-CD2 4.5Å; E113-L128 HydrophobicContact CG-CD2 3.76Å; E113-L128 WeakPolarHBondContact OE1-CD2 3.23Å; I126-L128 HydrophobicContact CD1-CD1 4.4Å; I126-L128 HydrophobicContact CD1-CD2 3.72Å; I126-L128 HydrophobicContact CD1-CG 4.02Å; I126-L128 HydrophobicContact CG1-CD2 4.4Å; I126-L128 HydrophobicContact CG1-CG 4.34Å; L128-E204 WeakPolarHBondContact O-CA 3.3Å; L128-V205 HydrophobicContact CB-CB 4.45Å; L128-V205 PolarHBondContact N-O 2.91Å; L128-V205 PolarHBondContact O-N 3.28Å; L128-A212 HydrophobicContact CD1-CB 3.68Å; L128-A212 HydrophobicContact CG-CB 4.07Å; L128-Y213 HydrophobicContact CD1-CD1 3.73Å; L128-Y213 HydrophobicContact CD1-CD2 4.34Å; L128-Y213 HydrophobicContact CD1-CE1 3.9Å; L128-Y213 HydrophobicContact CD1-CE2 4.47Å; L128-Y213 HydrophobicContact CD1-CG 3.95Å; L128-Y213 HydrophobicContact CD2-CE1 4.08Å; L128-L216 HydrophobicContact CB-CD2 4.17Å; L128-L216 HydrophobicContact CD1-CB 4.39Å; L128-L216 HydrophobicContact CD1-CD2 4.01Å |
| 129 | M | 93.6 | Very high | 86.3 | Confident | 78 Ų | 78 | 84 Ų | 84 | 38% | 0.384 | 42% | 0.424 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.8 | 129.6 | 176.6 | -175 | -84.2 | -64.1 | 0 | 0 | 111.5 | K131 R202 I203 E204 | M129-K131 HydrophobicContact SD-CG 4.15Å; M129-R202 HydrophobicContact CG-CG 4.01Å; M129-R202 HydrophobicContact SD-CG 4.11Å; M129-I203 WeakPolarHBondContact CA-O 3.24Å; M129-E204 HydrophobicContact CB-CG 4.36Å; M129-E204 HydrophobicContact CG-CG 3.9Å |
| 130 | R | 95.4 | Very high | 86.9 | Confident | 110 Ų | 110 | 84.1 Ų | 84.1 | 42% | 0.415 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.9 | 137.5 | 174 | -69 | -65.7 | 177.8 | -96.3 | 0.6 | 111.5 | E113 R202 I203 L216 | E113-R130 IonicContact OE1-CZ 3.34Å; E113-R130 IonicContact OE1-NH1 2.79Å; E113-R130 PolarHBondContact OE1-NH1 3.17Å; E113-R130 IonicContact OE1-NH2 3.34Å; E113-R130 PolarHBondContact OE1-NH2 3.09Å; E113-R130 IonicContact OE2-CZ 3.5Å; E113-R130 IonicContact OE2-NH1 3.31Å; E113-R130 PolarHBondContact OE2-NH1 3.21Å; E113-R130 IonicContact OE2-NH2 2.78Å; E113-R130 PolarHBondContact OE2-NH2 2.83Å; R130-R202 WeakPolarHBondContact O-CA 3.3Å; R130-I203 PolarHBondContact N-O 3.47Å; R130-I203 PolarHBondContact O-N 3.17Å; R130-L216 HydrophobicContact CB-CD1 4.34Å; R130-L216 HydrophobicContact CG-CD1 4.29Å; R130-L216 HydrophobicContact CG-CD2 3.98Å |
| 131 | K | 96.6 | Very high | 87.7 | Confident | 109 Ų | 109 | 88.2 Ų | 88.2 | 47% | 0.474 | 43% | 0.431 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.3 | 124.2 | 170.2 | -66.9 | -176.1 | 174.7 | -176 | 0 | 109.1 | M129 D197 V201 | M129-K131 HydrophobicContact SD-CG 4.15Å; K131-D197 IonicContact NZ-OD2 3.66Å; K131-D197 PolarHBondContact NZ-OD2 2.93Å; K131-V201 CarbonylContact C-O 3.51Å; K131-V201 WeakPolarHBondContact CA-O 3.4Å |
| 132 | V | 97.4 | Very high | 89.2 | Confident | 30 Ų | 30 | 89.1 Ų | 89.1 | 18% | 0.182 | 43% | 0.425 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.9 | 118.1 | 177.5 | -174.7 | 0 | 0 | 0 | 0 | 108.9 | H200 V201 I203 L220 L223 L227 | V132-H200 CarbonylContact O-C 3.48Å; V132-H200 VanDerWaalsContact O-CA 3.23Å; V132-H200 WeakPolarHBondContact O-CA 3.26Å; V132-H200 WeakPolarHBondContact O-CB 3.32Å; V132-V201 PolarHBondContact N-O 3.27Å; V132-V201 PolarHBondContact O-N 3.31Å; V132-I203 HydrophobicContact CG2-CD1 4.19Å; V132-L220 HydrophobicContact CG2-CD2 3.57Å; V132-L223 HydrophobicContact CB-CD2 3.9Å; V132-L223 HydrophobicContact CG1-CD2 4Å; V132-L223 HydrophobicContact CG2-CD2 3.92Å; V132-L227 HydrophobicContact CG1-CD1 3.57Å |
| 133 | L | 97.2 | Very high | 90.8 | Very high | 122 Ų | 122 | 87 Ų | 87 | 64% | 0.639 | 41% | 0.414 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -65.5 | 134.3 | 178.4 | -72.4 | 170 | 0 | 0 | 0 | 111.2 | P198 | L133-P198 HydrophobicContact CD2-CB 4.05Å |
| 134 | V | 96.5 | Very high | 92.2 | Very high | 11 Ų | 11 | 85.8 Ų | 85.8 | 7% | 0.067 | 40% | 0.404 | C | S | . | . | trans | -85.1 | 129.5 | 172.7 | -177.9 | 0 | 0 | 0 | 0 | 108.9 | V136 F144 L199 V201 L227 | V134-V136 HydrophobicContact CB-CG1 4.37Å; V134-V136 HydrophobicContact CG1-CG1 3.85Å; V134-V136 PolarHBondContact O-N 2.8Å; V134-F144 HydrophobicContact CG1-CB 3.42Å; V134-F144 VanDerWaalsContact CG1-CB 3.42Å; V134-F144 HydrophobicContact CG1-CD1 4.17Å; V134-F144 HydrophobicContact CG1-CD2 3.67Å; V134-F144 HydrophobicContact CG1-CE2 4.48Å; V134-F144 HydrophobicContact CG1-CG 3.47Å; V134-F144 VanDerWaalsContact CG1-CG 3.47Å; V134-L199 HydrophobicContact CB-CB 4.34Å; V134-L199 HydrophobicContact CB-CD2 3.86Å; V134-L199 HydrophobicContact CB-CG 3.96Å; V134-L199 HydrophobicContact CG1-CD2 3.81Å; V134-L199 HydrophobicContact CG1-CG 4.45Å; V134-L199 HydrophobicContact CG2-CD2 4.16Å; V134-L199 HydrophobicContact CG2-CG 3.95Å; V134-L199 PolarHBondContact N-O 3.01Å; V134-V201 HydrophobicContact CG2-CG2 4.05Å; V134-L227 HydrophobicContact CB-CD2 4.45Å; V134-L227 HydrophobicContact CG1-CD2 4.17Å; V134-L227 HydrophobicContact CG2-CD2 4.04Å | ||
| 135 | P | 94.9 | Very high | 93 | Very high | 18 Ų | 18 | 80.6 Ų | 80.6 | 12% | 0.117 | 38% | 0.382 | C | S | . | . | trans | -79.1 | 51.6 | -171.3 | 32.7 | -35.7 | 0 | 0 | 0 | 113.5 | Q137 R138 N139 F144 L227 | P135-Q137 PolarHBondContact O-N 3.3Å; P135-R138 PolarHBondContact O-N 3.19Å; P135-N139 PolarHBondContact O-N 3Å; P135-N139 VanDerWaalsContact O-N 3.15Å; P135-F144 HydrophobicContact CG-CE1 3.89Å; P135-F144 HydrophobicContact CG-CE2 4.35Å; P135-F144 HydrophobicContact CG-CZ 3.74Å; P135-L227 VanDerWaalsContact CG-O 3.3Å; P135-L227 WeakPolarHBondContact CG-O 3.49Å | ||
| 136 | V | 93.6 | Very high | 93.3 | Very high | 55 Ų | 55 | 78.6 Ų | 78.6 | 33% | 0.333 | 37% | 0.374 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.4 | -34.6 | 179.6 | -64.3 | 0 | 0 | 0 | 0 | 112.8 | V134 R138 N139 P140 F144 L199 | V134-V136 HydrophobicContact CB-CG1 4.37Å; V134-V136 HydrophobicContact CG1-CG1 3.85Å; V134-V136 PolarHBondContact O-N 2.8Å; V136-R138 VanDerWaalsContact C-N 3.33Å; V136-R138 PolarHBondContact O-N 2.98Å; V136-N139 CarbonylContact O-C 3.6Å; V136-N139 PolarHBondContact O-N 2.95Å; V136-P140 WeakPolarHBondContact O-CA 3.35Å; V136-F144 HydrophobicContact CG1-CD2 4.05Å; V136-L199 HydrophobicContact CG1-CD2 3.57Å |
| 137 | Q | 91.6 | Very high | 93.6 | Very high | 186 Ų | 186 | 79.9 Ų | 79.9 | 87% | 0.869 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | -38 | 178.8 | -66.3 | -179.9 | 2.4 | 0 | 0 | 111.8 | P135 | P135-Q137 PolarHBondContact O-N 3.3Š|
| 138 | R | 91.2 | Very high | 93.8 | Very high | 205 Ų | 205 | 76.3 Ų | 76.3 | 77% | 0.774 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.6 | -26.5 | 177.6 | -69 | -175.6 | -80.3 | 165.6 | -6.1 | 112.6 | P135 V136 | P135-R138 PolarHBondContact O-N 3.19Å; V136-R138 VanDerWaalsContact C-N 3.33Å; V136-R138 PolarHBondContact O-N 2.98Å |
| 139 | N | 90.3 | Very high | 94 | Very high | 50 Ų | 50 | 79.3 Ų | 79.3 | 27% | 0.267 | 38% | 0.382 | S | S | . | . | trans | -138.1 | 65.5 | -175.7 | -58.1 | -83.8 | 0 | 0 | 0 | 111.4 | P135 V136 R141 F142 F144 P229 | P135-N139 PolarHBondContact O-N 3Å; P135-N139 VanDerWaalsContact O-N 3.15Å; V136-N139 CarbonylContact O-C 3.6Å; V136-N139 PolarHBondContact O-N 2.95Å; N139-R141 PolarHBondContact O-N 2.88Å; N139-R141 VanDerWaalsContact O-N 3.14Å; N139-F142 HydrophobicContact CB-CB 4.07Å; N139-F142 PolarHBondContact O-N 2.85Å; N139-F142 VanDerWaalsContact O-N 3.09Å; N139-F144 HydrophobicContact CB-CE2 3.84Å; N139-F144 HydrophobicContact CB-CZ 3.73Å; N139-P229 WeakPolarHBondContact OD1-CG 3.36Å | ||
| 140 | P | 91 | Very high | 94 | Very high | 106 Ų | 106 | 76.6 Ų | 76.6 | 69% | 0.688 | 37% | 0.374 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66 | -22.7 | -169.8 | 24.6 | -34.8 | 0 | 0 | 0 | 113.9 | V136 | V136-P140 WeakPolarHBondContact O-CA 3.35Š|
| 141 | R | 89 | Confident | 94.1 | Very high | 248 Ų | 248 | 76.6 Ų | 76.6 | 94% | 0.936 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.4 | -5 | 179.5 | -62.7 | -171.4 | -71.7 | -147.2 | -0.9 | 113.8 | N139 | N139-R141 PolarHBondContact O-N 2.88Å; N139-R141 VanDerWaalsContact O-N 3.14Å |
| 142 | F | 92 | Very high | 93.9 | Very high | 54 Ų | 54 | 75 Ų | 75 | 24% | 0.237 | 40% | 0.403 | C | S | . | . | S | Bend | trans | -97.1 | 130.1 | -175.7 | -170.7 | -95.5 | 0 | 0 | 0 | 111.9 | N139 F144 K147 P229 V230 | N139-F142 HydrophobicContact CB-CB 4.07Å; N139-F142 PolarHBondContact O-N 2.85Å; N139-F142 VanDerWaalsContact O-N 3.09Å; F142-F144 HydrophobicContact CB-CD2 4.49Å; F142-F144 HydrophobicContact CB-CE2 4.01Å; F142-F144 HydrophobicContact CB-CZ 4.19Å; F142-F144 HydrophobicContact CD1-CB 4.46Å; F142-F144 AromaticContact CD1-CD1 3.47Å; F142-F144 HydrophobicContact CD1-CD1 3.47Å; F142-F144 VanDerWaalsContact CD1-CD1 3.47Å; F142-F144 AromaticContact CD1-CD2 3.81Å; F142-F144 HydrophobicContact CD1-CD2 3.81Å; F142-F144 AromaticContact CD1-CE1 3.41Å; F142-F144 HydrophobicContact CD1-CE1 3.41Å; F142-F144 VanDerWaalsContact CD1-CE1 3.41Å; F142-F144 AromaticContact CD1-CE2 3.78Å; F142-F144 HydrophobicContact CD1-CE2 3.78Å; F142-F144 AromaticContact CD1-CG 3.67Å; F142-F144 HydrophobicContact CD1-CG 3.67Å; F142-F144 AromaticContact CD1-CZ 3.57Å; F142-F144 HydrophobicContact CD1-CZ 3.57Å; F142-F144 AromaticContact CE1-CD1 3.65Å; F142-F144 HydrophobicContact CE1-CD1 3.65Å; F142-F144 AromaticContact CE1-CE1 3.79Å; F142-F144 HydrophobicContact CE1-CE1 3.79Å; F142-F144 HydrophobicContact CE1-CG 4.12Å; F142-F144 HydrophobicContact CE1-CZ 4.39Å; F142-F144 HydrophobicContact CG-CE1 4.41Å; F142-F144 HydrophobicContact CG-CE2 4.36Å; F142-F144 HydrophobicContact CG-CZ 4.22Å; F142-F144 WeakPolarHBondContact O-CD2 3.47Å; F142-F144 PolarHBondContact O-N 3.43Å; F142-F144 VanDerWaalsContact O-N 3.14Å; F142-K147 HydrophobicContact CE1-CB 4.24Å; F142-K147 HydrophobicContact CE1-CD 3.87Å; F142-K147 HydrophobicContact CZ-CB 4.3Å; F142-K147 HydrophobicContact CZ-CD 3.57Å; F142-P229 HydrophobicContact CB-CB 4.5Å; F142-P229 HydrophobicContact CD1-CB 4.39Å; F142-P229 HydrophobicContact CD2-CB 3.96Å; F142-P229 HydrophobicContact CE2-CB 4.29Å; F142-P229 HydrophobicContact CG-CB 4.01Å; F142-V230 HydrophobicContact CE2-CB 4.31Å; F142-V230 HydrophobicContact CE2-CG2 4.44Å; F142-V230 HydrophobicContact CZ-CG2 4.24Å |
| 143 | N | 93 | Very high | 93.8 | Very high | 112 Ų | 112 | 74.5 Ų | 74.5 | 60% | 0.599 | 40% | 0.404 | S | S | * | . | trans | -85.7 | 82.3 | 178.2 | -173.7 | 2.4 | 0 | 0 | 0 | 111.7 | V145 G146 K147 | N143-V145 PolarHBondContact OD1-N 3.34Å; N143-G146 PolarHBondContact OD1-N 2.91Å; N143-K147 PolarHBondContact O-N 3.03Å; N143-K147 VanDerWaalsContact O-N 3.11Å | ||
| 144 | F | 95 | Very high | 93.8 | Very high | 5 Ų | 5 | 76 Ų | 76 | 2% | 0.022 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -62.2 | -42.7 | 176.6 | -67.9 | -77.1 | 0 | 0 | 0 | 113.1 | V134 P135 V136 N139 F142 G146 K147 L148 L227 | V134-F144 HydrophobicContact CG1-CB 3.42Å; V134-F144 VanDerWaalsContact CG1-CB 3.42Å; V134-F144 HydrophobicContact CG1-CD1 4.17Å; V134-F144 HydrophobicContact CG1-CD2 3.67Å; V134-F144 HydrophobicContact CG1-CE2 4.48Å; V134-F144 HydrophobicContact CG1-CG 3.47Å; V134-F144 VanDerWaalsContact CG1-CG 3.47Å; P135-F144 HydrophobicContact CG-CE1 3.89Å; P135-F144 HydrophobicContact CG-CE2 4.35Å; P135-F144 HydrophobicContact CG-CZ 3.74Å; V136-F144 HydrophobicContact CG1-CD2 4.05Å; N139-F144 HydrophobicContact CB-CE2 3.84Å; N139-F144 HydrophobicContact CB-CZ 3.73Å; F142-F144 HydrophobicContact CB-CD2 4.49Å; F142-F144 HydrophobicContact CB-CE2 4.01Å; F142-F144 HydrophobicContact CB-CZ 4.19Å; F142-F144 HydrophobicContact CD1-CB 4.46Å; F142-F144 AromaticContact CD1-CD1 3.47Å; F142-F144 HydrophobicContact CD1-CD1 3.47Å; F142-F144 VanDerWaalsContact CD1-CD1 3.47Å; F142-F144 AromaticContact CD1-CD2 3.81Å; F142-F144 HydrophobicContact CD1-CD2 3.81Å; F142-F144 AromaticContact CD1-CE1 3.41Å; F142-F144 HydrophobicContact CD1-CE1 3.41Å; F142-F144 VanDerWaalsContact CD1-CE1 3.41Å; F142-F144 AromaticContact CD1-CE2 3.78Å; F142-F144 HydrophobicContact CD1-CE2 3.78Å; F142-F144 AromaticContact CD1-CG 3.67Å; F142-F144 HydrophobicContact CD1-CG 3.67Å; F142-F144 AromaticContact CD1-CZ 3.57Å; F142-F144 HydrophobicContact CD1-CZ 3.57Å; F142-F144 AromaticContact CE1-CD1 3.65Å; F142-F144 HydrophobicContact CE1-CD1 3.65Å; F142-F144 AromaticContact CE1-CE1 3.79Å; F142-F144 HydrophobicContact CE1-CE1 3.79Å; F142-F144 HydrophobicContact CE1-CG 4.12Å; F142-F144 HydrophobicContact CE1-CZ 4.39Å; F142-F144 HydrophobicContact CG-CE1 4.41Å; F142-F144 HydrophobicContact CG-CE2 4.36Å; F142-F144 HydrophobicContact CG-CZ 4.22Å; F142-F144 WeakPolarHBondContact O-CD2 3.47Å; F142-F144 PolarHBondContact O-N 3.43Å; F142-F144 VanDerWaalsContact O-N 3.14Å; F144-G146 PolarHBondContact O-N 3.47Å; F144-K147 PolarHBondContact O-N 3.14Å; F144-L148 WeakPolarHBondContact O-CB 3.44Å; F144-L148 PolarHBondContact O-N 3.38Å; F144-L227 VanDerWaalsContact CE1-O 3.24Å; F144-L227 WeakPolarHBondContact CE1-O 3.38Å |
| 145 | V | 95.1 | Very high | 93.8 | Very high | 23 Ų | 23 | 77.5 Ų | 77.5 | 14% | 0.139 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -61.2 | -46.3 | -178.7 | 179 | 0 | 0 | 0 | 0 | 110.3 | N143 L148 L149 V169 L199 | N143-V145 PolarHBondContact OD1-N 3.34Å; V145-L148 PolarHBondContact O-N 2.95Å; V145-L149 HydrophobicContact CG1-CD1 3.65Å; V145-L149 HydrophobicContact CG1-CG 4.3Å; V145-L149 WeakPolarHBondContact O-CB 3.4Å; V145-L149 WeakPolarHBondContact O-CG 3.41Å; V145-L149 PolarHBondContact O-N 3.46Å; V145-V169 HydrophobicContact CG1-CG1 4.31Å; V145-V169 HydrophobicContact CG2-CG1 4.14Å; V145-L199 HydrophobicContact CG2-CD1 4.06Å; V145-L199 HydrophobicContact CG2-CD2 3.87Å |
| 146 | G | 94.4 | Very high | 93.9 | Very high | 33 Ų | 33 | 77.6 Ų | 77.6 | 34% | 0.34 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.3 | -42.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | N143 F144 G150 | N143-G146 PolarHBondContact OD1-N 2.91Å; F144-G146 PolarHBondContact O-N 3.47Å; G146-G150 PolarHBondContact O-N 2.97Å |
| 147 | K | 94.7 | Very high | 94.1 | Very high | 42 Ų | 42 | 79.9 Ų | 79.9 | 18% | 0.183 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -63.4 | -40.5 | 175.5 | 175.4 | 170.1 | 172.2 | -161.4 | 0 | 112.3 | F142 N143 F144 Y225 Y226 Q228 V230 | F142-K147 HydrophobicContact CE1-CB 4.24Å; F142-K147 HydrophobicContact CE1-CD 3.87Å; F142-K147 HydrophobicContact CZ-CB 4.3Å; F142-K147 HydrophobicContact CZ-CD 3.57Å; N143-K147 PolarHBondContact O-N 3.03Å; N143-K147 VanDerWaalsContact O-N 3.11Å; F144-K147 PolarHBondContact O-N 3.14Å; K147-Y225 PolarHBondContact NZ-O 3.2Å; K147-Y226 HydrophobicContact CG-CD1 4.3Å; K147-Q228 PolarHBondContact NZ-O 2.88Å; K147-V230 HydrophobicContact CD-CG2 4.01Å |
| 148 | L | 95.4 | Very high | 94.4 | Very high | 5 Ų | 5 | 72.8 Ų | 72.8 | 3% | 0.026 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -72.9 | -42.3 | -178 | -175.6 | 62.8 | 0 | 0 | 0 | 112.1 | F144 V145 L156 L159 V169 V201 L223 Y226 | F144-L148 WeakPolarHBondContact O-CB 3.44Å; F144-L148 PolarHBondContact O-N 3.38Å; V145-L148 PolarHBondContact O-N 2.95Å; L148-L156 HydrophobicContact CD1-CD1 4.41Å; L148-L156 HydrophobicContact CG-CD1 4.26Å; L148-L156 PolarHBondContact O-N 3.16Å; L148-L159 HydrophobicContact CD1-CD2 4.16Å; L148-V169 HydrophobicContact CD2-CG2 3.56Å; L148-V169 HydrophobicContact CG-CG2 4.41Å; L148-V201 HydrophobicContact CD2-CG2 3.58Å; L148-L223 HydrophobicContact CD1-CD1 3.67Å; L148-L223 HydrophobicContact CD2-CD1 4.3Å; L148-Y226 HydrophobicContact CD1-CD1 4.28Å; L148-Y226 HydrophobicContact CD1-CD2 4.24Å; L148-Y226 HydrophobicContact CD1-CG 3.81Å |
| 149 | L | 95.5 | Very high | 94.6 | Very high | 63 Ų | 63 | 63.1 Ų | 63.1 | 33% | 0.33 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -72.5 | -45.3 | 179 | -69.7 | 173.5 | 0 | 0 | 0 | 112.1 | V145 G153 K154 T155 L156 | V145-L149 HydrophobicContact CG1-CD1 3.65Å; V145-L149 HydrophobicContact CG1-CG 4.3Å; V145-L149 WeakPolarHBondContact O-CB 3.4Å; V145-L149 WeakPolarHBondContact O-CG 3.41Å; V145-L149 PolarHBondContact O-N 3.46Å; L149-G153 CarbonylContact O-C 3.06Å; L149-G153 WeakPolarHBondContact O-CA 3.5Å; L149-K154 PolarHBondContact O-N 3.02Å; L149-T155 WeakPolarHBondContact O-CB 3.47Å; L149-T155 PolarHBondContact O-N 3.15Å; L149-T155 VanDerWaalsContact O-N 3.17Å; L149-L156 HydrophobicContact CD2-CB 4.21Å; L149-L156 HydrophobicContact CD2-CD2 3.59Å; L149-L156 PolarHBondContact O-N 2.92Å |
| 150 | G | 94 | Very high | 95 | Very high | 22 Ų | 22 | 63.2 Ų | 63.2 | 23% | 0.227 | 36% | 0.361 | C | S | . | . | trans | 63 | -175.6 | -170.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | G146 G152 G153 | G146-G150 PolarHBondContact O-N 2.97Å; G150-G152 PolarHBondContact O-N 3.08Å; G150-G153 PolarHBondContact O-N 3.17Å; G150-G153 VanDerWaalsContact O-N 3.14Å | ||
| 151 | P | 97 | Very high | 95.3 | Very high | 110 Ų | 110 | 64 Ų | 64 | 71% | 0.714 | 36% | 0.355 | S | S | * | . | G | 310 helix | trans | -60.3 | 120.7 | -178.2 | -23 | 34.1 | 0 | 0 | 0 | 111.9 | G153 K154 | P151-G153 PolarHBondContact O-N 3.29Å; P151-G153 VanDerWaalsContact O-N 3.16Å; P151-K154 WeakPolarHBondContact O-CB 3.28Å; P151-K154 WeakPolarHBondContact O-CG 3.39Å; P151-K154 PolarHBondContact O-N 3.31Å |
| 152 | G | 94.3 | Very high | 95.6 | Very high | 76 Ų | 76 | 56.9 Ų | 56.9 | 78% | 0.784 | 33% | 0.332 | S | S | * | . | G | 310 helix | trans | 62.3 | 17.6 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | G150 K154 | G150-G152 PolarHBondContact O-N 3.08Å; G152-K154 VanDerWaalsContact C-N 3.25Å; G152-K154 PolarHBondContact O-N 2.64Å |
| 153 | G | 95 | Very high | 95.8 | Very high | 18 Ų | 18 | 54.3 Ų | 54.3 | 19% | 0.186 | 32% | 0.321 | C | S | . | . | G | 310 helix | trans | 77.8 | 5 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | L149 G150 P151 T155 L156 Q157 | L149-G153 CarbonylContact O-C 3.06Å; L149-G153 WeakPolarHBondContact O-CA 3.5Å; G150-G153 PolarHBondContact O-N 3.17Å; G150-G153 VanDerWaalsContact O-N 3.14Å; P151-G153 PolarHBondContact O-N 3.29Å; P151-G153 VanDerWaalsContact O-N 3.16Å; G153-T155 VanDerWaalsContact C-N 3.28Å; G153-T155 PolarHBondContact O-N 3.05Å; G153-L156 PolarHBondContact O-N 3.31Å; G153-Q157 WeakPolarHBondContact O-CG 3.48Å; G153-Q157 PolarHBondContact O-N 2.89Å |
| 154 | K | 96.8 | Very high | 96 | Very high | 155 Ų | 155 | 55.1 Ų | 55.1 | 67% | 0.674 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -63 | -32 | -173.7 | -71.3 | -175.3 | 177.3 | -176.7 | 0 | 113.4 | L149 P151 G152 Q157 G158 | L149-K154 PolarHBondContact O-N 3.02Å; P151-K154 WeakPolarHBondContact O-CB 3.28Å; P151-K154 WeakPolarHBondContact O-CG 3.39Å; P151-K154 PolarHBondContact O-N 3.31Å; G152-K154 VanDerWaalsContact C-N 3.25Å; G152-K154 PolarHBondContact O-N 2.64Å; K154-Q157 PolarHBondContact O-N 3.09Å; K154-G158 PolarHBondContact O-N 2.97Å |
| 155 | T | 96.3 | Very high | 96.1 | Very high | 42 Ų | 42 | 55.1 Ų | 55.1 | 26% | 0.258 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -67.2 | -49.2 | 178.1 | -59.5 | 0 | 0 | 0 | 0 | 110.6 | L149 G153 Q157 G158 L159 Y226 | L149-T155 WeakPolarHBondContact O-CB 3.47Å; L149-T155 PolarHBondContact O-N 3.15Å; L149-T155 VanDerWaalsContact O-N 3.17Å; G153-T155 VanDerWaalsContact C-N 3.28Å; G153-T155 PolarHBondContact O-N 3.05Å; T155-Q157 VanDerWaalsContact C-N 3.32Å; T155-Q157 PolarHBondContact O-N 2.97Å; T155-G158 PolarHBondContact O-N 3.43Å; T155-L159 PolarHBondContact O-N 3.09Å; T155-Y226 HydrophobicContact CG2-CD1 4.26Å; T155-Y226 HydrophobicContact CG2-CE1 3.32Å |
| 156 | L | 97 | Very high | 96.2 | Very high | 19 Ų | 19 | 61.2 Ų | 61.2 | 10% | 0.099 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -63.5 | -40 | 175.7 | -179 | 62.5 | 0 | 0 | 0 | 111.4 | L148 L149 G153 G158 L159 I160 I167 V169 | L148-L156 HydrophobicContact CD1-CD1 4.41Å; L148-L156 HydrophobicContact CG-CD1 4.26Å; L148-L156 PolarHBondContact O-N 3.16Å; L149-L156 HydrophobicContact CD2-CB 4.21Å; L149-L156 HydrophobicContact CD2-CD2 3.59Å; L149-L156 PolarHBondContact O-N 2.92Å; G153-L156 PolarHBondContact O-N 3.31Å; L156-G158 PolarHBondContact O-N 3.31Å; L156-L159 HydrophobicContact CD1-CD2 4.37Å; L156-L159 WeakPolarHBondContact O-CB 3.25Å; L156-L159 PolarHBondContact O-N 3.23Å; L156-I160 HydrophobicContact CD1-CD1 4.49Å; L156-I160 HydrophobicContact CG-CD1 4.06Å; L156-I160 VanDerWaalsContact O-CG1 3.29Å; L156-I160 WeakPolarHBondContact O-CG1 3.2Å; L156-I160 PolarHBondContact O-N 2.9Å; L156-I167 HydrophobicContact CD1-CB 4.08Å; L156-I167 HydrophobicContact CD1-CG2 3.71Å; L156-V169 HydrophobicContact CD2-CG2 4.24Å |
| 157 | Q | 97.4 | Very high | 96.4 | Very high | 104 Ų | 104 | 60.1 Ų | 60.1 | 49% | 0.486 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -59.6 | -46.1 | 174.1 | -73.3 | 175.3 | 2.1 | 0 | 0 | 111.2 | G153 K154 T155 L159 I160 H161 | G153-Q157 WeakPolarHBondContact O-CG 3.48Å; G153-Q157 PolarHBondContact O-N 2.89Å; K154-Q157 PolarHBondContact O-N 3.09Å; T155-Q157 VanDerWaalsContact C-N 3.32Å; T155-Q157 PolarHBondContact O-N 2.97Å; Q157-L159 VanDerWaalsContact C-N 3.32Å; Q157-L159 PolarHBondContact O-N 3.25Å; Q157-I160 PolarHBondContact O-N 3.47Å; Q157-H161 PolarHBondContact O-N 3.14Å; Q157-H161 PolarHBondContact O-ND1 2.94Å |
| 158 | G | 97.3 | Very high | 96.5 | Very high | 36 Ų | 36 | 61.9 Ų | 61.9 | 37% | 0.371 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -56.5 | -46 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | K154 T155 L156 I160 H161 Q162 | K154-G158 PolarHBondContact O-N 2.97Å; T155-G158 PolarHBondContact O-N 3.43Å; L156-G158 PolarHBondContact O-N 3.31Å; G158-I160 PolarHBondContact O-N 2.75Å; G158-H161 PolarHBondContact O-N 2.9Å; G158-Q162 WeakPolarHBondContact O-CB 3.21Å; G158-Q162 PolarHBondContact O-N 2.87Å |
| 159 | L | 97 | Very high | 96.6 | Very high | 3 Ų | 3 | 63 Ų | 63 | 2% | 0.016 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -59.2 | -44.8 | 176.9 | -178.5 | 62.8 | 0 | 0 | 0 | 112.4 | L148 T155 L156 Q157 Q162 T163 I167 E222 L223 Y226 | L148-L159 HydrophobicContact CD1-CD2 4.16Å; T155-L159 PolarHBondContact O-N 3.09Å; L156-L159 HydrophobicContact CD1-CD2 4.37Å; L156-L159 WeakPolarHBondContact O-CB 3.25Å; L156-L159 PolarHBondContact O-N 3.23Å; Q157-L159 VanDerWaalsContact C-N 3.32Å; Q157-L159 PolarHBondContact O-N 3.25Å; L159-Q162 PolarHBondContact O-N 3.5Å; L159-T163 HydrophobicContact CD1-CG2 3.78Å; L159-T163 HydrophobicContact CG-CG2 4.45Å; L159-T163 WeakPolarHBondContact O-CB 3.34Å; L159-T163 VanDerWaalsContact O-CG2 3.27Å; L159-T163 WeakPolarHBondContact O-CG2 3.42Å; L159-T163 PolarHBondContact O-N 2.83Å; L159-T163 PolarHBondContact O-OG1 2.84Å; L159-I167 HydrophobicContact CD2-CD1 3.76Å; L159-I167 HydrophobicContact CG-CD1 3.61Å; L159-E222 HydrophobicContact CD1-CB 3.37Å; L159-E222 HydrophobicContact CD1-CG 4.09Å; L159-L223 HydrophobicContact CD2-CD1 4.45Å; L159-Y226 HydrophobicContact CD1-CE2 4.39Å; L159-Y226 HydrophobicContact CD2-CD2 4.37Å; L159-Y226 HydrophobicContact CD2-CE2 4.36Å |
| 160 | I | 97.6 | Very high | 96.6 | Very high | 52 Ų | 52 | 61.1 Ų | 61.1 | 27% | 0.267 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.8 | -46.3 | 175 | -70.1 | 168.4 | 0 | 0 | 0 | 110.7 | L156 Q157 G158 K164 C165 I167 | L156-I160 HydrophobicContact CD1-CD1 4.49Å; L156-I160 HydrophobicContact CG-CD1 4.06Å; L156-I160 VanDerWaalsContact O-CG1 3.29Å; L156-I160 WeakPolarHBondContact O-CG1 3.2Å; L156-I160 PolarHBondContact O-N 2.9Å; Q157-I160 PolarHBondContact O-N 3.47Å; G158-I160 PolarHBondContact O-N 2.75Å; I160-K164 WeakPolarHBondContact O-CA 3.45Å; I160-K164 PolarHBondContact O-N 2.83Å; I160-C165 VanDerWaalsContact CG2-O 3.26Å; I160-C165 WeakPolarHBondContact CG2-O 3.23Å; I160-I167 HydrophobicContact CD1-CB 4.32Å; I160-I167 HydrophobicContact CG1-CB 3.8Å; I160-I167 HydrophobicContact CG1-CD1 4.14Å; I160-I167 HydrophobicContact CG1-CG1 4Å |
| 161 | H | 97.2 | Very high | 96.7 | Very high | 123 Ų | 123 | 60.1 Ų | 60.1 | 57% | 0.569 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -67.6 | -37.5 | -178.6 | -74.1 | 88.9 | 0 | 0 | 0 | 113.1 | Q157 G158 K164 | Q157-H161 PolarHBondContact O-N 3.14Å; Q157-H161 PolarHBondContact O-ND1 2.94Å; G158-H161 PolarHBondContact O-N 2.9Å; H161-K164 WeakPolarHBondContact O-CD 3.3Å; H161-K164 VanDerWaalsContact O-CE 3.26Å; H161-K164 WeakPolarHBondContact O-CE 3.37Å; H161-K164 PolarHBondContact O-NZ 2.85Å |
| 162 | Q | 96.4 | Very high | 96.6 | Very high | 97 Ų | 97 | 61.8 Ų | 61.8 | 45% | 0.453 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -71.2 | -46.8 | 179.3 | 177.6 | 179.5 | -20.8 | 0 | 0 | 111.5 | G158 L159 H218 E222 | G158-Q162 WeakPolarHBondContact O-CB 3.21Å; G158-Q162 PolarHBondContact O-N 2.87Å; L159-Q162 PolarHBondContact O-N 3.5Å; Q162-H218 PolarHBondContact NE2-NE2 3.22Å; Q162-E222 VanDerWaalsContact NE2-CD 3.29Å; Q162-E222 PolarHBondContact NE2-OE1 2.95Å |
| 163 | T | 96.4 | Very high | 96.5 | Very high | 1 Ų | 1 | 59.5 Ų | 59.5 | 1% | 0.006 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -82.9 | -14.9 | -174.6 | 60.5 | 0 | 0 | 0 | 0 | 113.3 | L159 C165 A219 E222 | L159-T163 HydrophobicContact CD1-CG2 3.78Å; L159-T163 HydrophobicContact CG-CG2 4.45Å; L159-T163 WeakPolarHBondContact O-CB 3.34Å; L159-T163 VanDerWaalsContact O-CG2 3.27Å; L159-T163 WeakPolarHBondContact O-CG2 3.42Å; L159-T163 PolarHBondContact O-N 2.83Å; L159-T163 PolarHBondContact O-OG1 2.84Å; T163-C165 PolarHBondContact O-N 3.04Å; T163-C165 PolarHBondContact O-SG 2.83Å; T163-C165 PolarHBondContact OG1-N 2.78Å; T163-A219 HydrophobicContact CG2-CB 3.92Å; T163-E222 HydrophobicContact CG2-CB 4.47Å; T163-E222 HydrophobicContact CG2-CG 4.27Å |
| 164 | K | 97.1 | Very high | 96.5 | Very high | 129 Ų | 129 | 59.8 Ų | 59.8 | 56% | 0.561 | 29% | 0.287 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.1 | 34.1 | -173.2 | -51.8 | -60.4 | -179 | -160.2 | 0 | 112.4 | I160 H161 | I160-K164 WeakPolarHBondContact O-CA 3.45Å; I160-K164 PolarHBondContact O-N 2.83Å; H161-K164 WeakPolarHBondContact O-CD 3.3Å; H161-K164 VanDerWaalsContact O-CE 3.26Å; H161-K164 WeakPolarHBondContact O-CE 3.37Å; H161-K164 PolarHBondContact O-NZ 2.85Å |
| 165 | C | 97.1 | Very high | 96.2 | Very high | 5 Ų | 5 | 54 Ų | 54 | 3% | 0.034 | 27% | 0.266 | C | S | . | . | trans | -115.5 | 154.3 | 178.9 | -60.8 | 0 | 0 | 0 | 0 | 110.2 | I160 T163 I167 I203 V205 A219 | I160-C165 VanDerWaalsContact CG2-O 3.26Å; I160-C165 WeakPolarHBondContact CG2-O 3.23Å; T163-C165 PolarHBondContact O-N 3.04Å; T163-C165 PolarHBondContact O-SG 2.83Å; T163-C165 PolarHBondContact OG1-N 2.78Å; C165-I167 HydrophobicContact CB-CG1 4.17Å; C165-I203 HydrophobicContact CB-CG2 3.92Å; C165-V205 HydrophobicContact CB-CG2 4.18Å; C165-V205 WeakPolarHBondContact SG-CG2 3.32Å; C165-A219 HydrophobicContact CB-CB 4.34Å | ||
| 166 | R | 96.6 | Very high | 95.7 | Very high | 151 Ų | 151 | 62.9 Ų | 62.9 | 57% | 0.57 | 30% | 0.295 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -85.4 | 127.6 | 164.2 | -62.5 | 177.1 | 177.6 | -178.9 | -0.4 | 108 | Y168 I203 E204 | R166-Y168 HydrophobicContact CB-CE2 3.76Å; R166-I203 CarbonylContact O-C 3.2Å; R166-I203 WeakPolarHBondContact O-CA 3.46Å; R166-E204 HydrophobicContact CB-CB 4.22Å; R166-E204 PolarHBondContact N-O 3.35Å; R166-E204 PolarHBondContact O-N 3.42Å |
| 167 | I | 97.8 | Very high | 95.3 | Very high | 9 Ų | 9 | 64.4 Ų | 64.4 | 5% | 0.046 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.1 | 127.3 | -176.4 | -54.7 | 176.8 | 0 | 0 | 0 | 108.9 | L156 L159 I160 C165 V201 R202 | L156-I167 HydrophobicContact CD1-CB 4.08Å; L156-I167 HydrophobicContact CD1-CG2 3.71Å; L159-I167 HydrophobicContact CD2-CD1 3.76Å; L159-I167 HydrophobicContact CG-CD1 3.61Å; I160-I167 HydrophobicContact CD1-CB 4.32Å; I160-I167 HydrophobicContact CG1-CB 3.8Å; I160-I167 HydrophobicContact CG1-CD1 4.14Å; I160-I167 HydrophobicContact CG1-CG1 4Å; C165-I167 HydrophobicContact CB-CG1 4.17Å; I167-V201 HydrophobicContact CG2-CG1 3.43Å; I167-V201 VanDerWaalsContact CG2-CG1 3.43Å; I167-R202 WeakPolarHBondContact CA-O 3.44Å |
| 168 | Y | 96.9 | Very high | 94.7 | Very high | 80 Ų | 80 | 67 Ų | 67 | 31% | 0.314 | 31% | 0.313 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.9 | 140.1 | -178.1 | -53 | -86.8 | 0 | 0 | 0 | 110.3 | R166 V201 R202 E204 | R166-Y168 HydrophobicContact CB-CE2 3.76Å; Y168-V201 CarbonylContact O-C 3.58Å; Y168-V201 VanDerWaalsContact O-CA 3.24Å; Y168-V201 WeakPolarHBondContact O-CA 3.4Å; Y168-R202 HydrophobicContact CD2-CB 4.41Å; Y168-R202 PolarHBondContact N-O 3.31Å; Y168-R202 PolarHBondContact O-N 3.5Å; Y168-E204 HydrophobicContact CE2-CG 4.34Å |
| 169 | V | 97 | Very high | 94.2 | Very high | 27 Ų | 27 | 69.7 Ų | 69.7 | 16% | 0.164 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 116.5 | 168.3 | -173.5 | 0 | 0 | 0 | 0 | 107.6 | V145 L148 L156 L199 | V145-V169 HydrophobicContact CG1-CG1 4.31Å; V145-V169 HydrophobicContact CG2-CG1 4.14Å; L148-V169 HydrophobicContact CD2-CG2 3.56Å; L148-V169 HydrophobicContact CG-CG2 4.41Å; L156-V169 HydrophobicContact CD2-CG2 4.24Å; V169-L199 HydrophobicContact CG1-CD1 4.38Å |
| 170 | L | 96.6 | Very high | 93.9 | Very high | 25 Ų | 25 | 75 Ų | 75 | 13% | 0.131 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.8 | 177.6 | -171.3 | -58.8 | 175.4 | 0 | 0 | 0 | 110 | H194 L199 H200 R202 | L170-H194 HydrophobicContact CB-CB 4.37Å; L170-L199 WeakPolarHBondContact O-CD1 3.47Å; L170-H200 PolarHBondContact N-O 3.06Å; L170-H200 PolarHBondContact O-N 3.29Å; L170-R202 HydrophobicContact CD1-CB 3.92Å |
| 171 | G | 96.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 72.8 Ų | 72.8 | 0% | 0 | 34% | 0.338 | C | S | . | . | S | Bend | trans | 89 | 176.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | S174 H194 D197 | G171-S174 VanDerWaalsContact O-CB 3.25Å; G171-S174 WeakPolarHBondContact O-CB 3.48Å; G171-S174 PolarHBondContact O-N 2.94Å; G171-S174 PolarHBondContact O-OG 2.79Å; G171-H194 WeakPolarHBondContact CA-O 3.26Å; G171-H194 PolarHBondContact N-ND1 3.25Å; G171-H194 PolarHBondContact N-O 3.08Å; G171-D197 CarbonylContact C-O 3.58Å; G171-D197 VanDerWaalsContact CA-O 3.3Å; G171-D197 WeakPolarHBondContact CA-O 3.41Å |
| 172 | R | 94.2 | Very high | 93.3 | Very high | 146 Ų | 146 | 70.6 Ų | 70.6 | 55% | 0.551 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.6 | 131.2 | 178.1 | -163.4 | 177.6 | -172.9 | 171.3 | 5.7 | 111.5 | S174 E181 E182 L195 D197 L199 | R172-S174 VanDerWaalsContact C-N 3.34Å; R172-E181 WeakPolarHBondContact CA-OE1 3.28Å; R172-E181 WeakPolarHBondContact CG-OE1 3.43Å; R172-E182 IonicContact CZ-OE1 3.68Å; R172-E182 IonicContact NE-OE1 2.78Å; R172-E182 IonicContact NH2-OE1 3.89Å; R172-E182 PolarHBondContact NH2-OE1 3.47Å; R172-L195 WeakPolarHBondContact CB-O 3.3Å; R172-D197 PolarHBondContact N-O 3.25Å; R172-L199 WeakPolarHBondContact O-CB 3.37Å |
| 173 | G | 92.7 | Very high | 93 | Very high | 28 Ų | 28 | 71.4 Ų | 71.4 | 29% | 0.289 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 80 | 10.7 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | S175 E181 | G173-S175 VanDerWaalsContact C-N 3.34Å; G173-E181 WeakPolarHBondContact CA-OE2 3.37Å; G173-E181 VanDerWaalsContact N-CD 3.3Å; G173-E181 PolarHBondContact N-OE1 3.19Å; G173-E181 PolarHBondContact N-OE2 3.44Å; G173-E181 VanDerWaalsContact N-OE2 3.09Å |
| 174 | S | 94.5 | Very high | 92.8 | Very high | 23 Ų | 23 | 73.7 Ų | 73.7 | 16% | 0.161 | 35% | 0.347 | C | S | . | . | trans | -76.9 | -23.7 | 172.5 | 59.4 | 0 | 0 | 0 | 0 | 112.2 | G171 R172 E181 | G171-S174 VanDerWaalsContact O-CB 3.25Å; G171-S174 WeakPolarHBondContact O-CB 3.48Å; G171-S174 PolarHBondContact O-N 2.94Å; G171-S174 PolarHBondContact O-OG 2.79Å; R172-S174 VanDerWaalsContact C-N 3.34Å; S174-E181 PolarHBondContact N-OE2 3.18Å | ||
| 175 | S | 90.2 | Very high | 92.5 | Very high | 35 Ų | 35 | 68.8 Ų | 68.8 | 25% | 0.245 | 33% | 0.327 | C | S | . | . | S | Bend | trans | -75.9 | 144.4 | 179.5 | -56.9 | 0 | 0 | 0 | 0 | 110.9 | G173 D177 E181 | G173-S175 VanDerWaalsContact C-N 3.34Å; S175-D177 VanDerWaalsContact C-N 3.31Å; S175-D177 PolarHBondContact O-N 3.47Å; S175-E181 VanDerWaalsContact CB-OE2 3.22Å; S175-E181 WeakPolarHBondContact CB-OE2 3.36Å; S175-E181 PolarHBondContact N-OE2 3.27Å; S175-E181 VanDerWaalsContact N-OE2 3.15Å; S175-E181 PolarHBondContact OG-OE2 3.31Å |
| 176 | R | 86.3 | Confident | 92.2 | Very high | 227 Ų | 227 | 74.6 Ų | 74.6 | 86% | 0.857 | 36% | 0.357 | S | S | * | . | S | Bend | trans | -62.9 | -42.4 | 174.4 | -171.4 | -178.4 | 72.7 | 176.7 | -1.1 | 111.5 | ||
| 177 | D | 89.2 | Confident | 91.9 | Very high | 52 Ų | 52 | 70.7 Ų | 70.7 | 28% | 0.278 | 35% | 0.353 | S | S | . | . | trans | -100.3 | 91.1 | -175 | -59.1 | -12.1 | 0 | 0 | 0 | 109 | S175 S179 K180 E181 | S175-D177 VanDerWaalsContact C-N 3.31Å; S175-D177 PolarHBondContact O-N 3.47Å; D177-S179 PolarHBondContact O-N 3.29Å; D177-K180 HydrophobicContact CB-CB 4.23Å; D177-K180 HydrophobicContact CB-CD 3.92Å; D177-K180 HydrophobicContact CB-CG 4.12Å; D177-K180 PolarHBondContact O-N 3.47Å; D177-K180 IonicContact OD2-NZ 2.83Å; D177-K180 PolarHBondContact OD2-NZ 3.37Å; D177-E181 PolarHBondContact O-N 2.97Å | ||
| 178 | K | 85.5 | Confident | 91.4 | Very high | 158 Ų | 158 | 73.2 Ų | 73.2 | 69% | 0.687 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -59.6 | -30.8 | -176.7 | -64.1 | -176.3 | -179.9 | -175.2 | 0 | 113.9 | E181 | K178-E181 WeakPolarHBondContact O-CB 3.44Å; K178-E181 PolarHBondContact O-N 3.12Å |
| 179 | S | 86.6 | Confident | 91 | Very high | 93 Ų | 93 | 72.7 Ų | 72.7 | 65% | 0.65 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -65.1 | -42.6 | 177.7 | 48.6 | 0 | 0 | 0 | 0 | 112.1 | D177 E181 | D177-S179 PolarHBondContact O-N 3.29Å; S179-E181 VanDerWaalsContact C-N 3.25Å; S179-E181 PolarHBondContact O-N 2.98Å |
| 180 | K | 90.5 | Very high | 90.6 | Very high | 114 Ų | 114 | 76.6 Ų | 76.6 | 50% | 0.496 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -71.8 | -23.1 | 178 | -63.4 | 180 | -174.6 | 159.4 | 0 | 112.3 | D177 E182 D183 L184 | D177-K180 HydrophobicContact CB-CB 4.23Å; D177-K180 HydrophobicContact CB-CD 3.92Å; D177-K180 HydrophobicContact CB-CG 4.12Å; D177-K180 PolarHBondContact O-N 3.47Å; D177-K180 IonicContact OD2-NZ 2.83Å; D177-K180 PolarHBondContact OD2-NZ 3.37Å; K180-E182 VanDerWaalsContact C-N 3.31Å; K180-E182 PolarHBondContact O-N 2.89Å; K180-D183 PolarHBondContact O-N 2.96Å; K180-L184 VanDerWaalsContact O-CG 3.28Å; K180-L184 WeakPolarHBondContact O-CG 3.22Å; K180-L184 PolarHBondContact O-N 3.25Å |
| 181 | E | 90.9 | Very high | 90.2 | Very high | 6 Ų | 6 | 81.9 Ų | 81.9 | 3% | 0.028 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -60.2 | -41.7 | -178.5 | -163.6 | 176.1 | 100.9 | 0 | 0 | 111.7 | R172 G173 S174 S175 D177 K178 S179 L184 I185 L195 | R172-E181 WeakPolarHBondContact CA-OE1 3.28Å; R172-E181 WeakPolarHBondContact CG-OE1 3.43Å; G173-E181 WeakPolarHBondContact CA-OE2 3.37Å; G173-E181 VanDerWaalsContact N-CD 3.3Å; G173-E181 PolarHBondContact N-OE1 3.19Å; G173-E181 PolarHBondContact N-OE2 3.44Å; G173-E181 VanDerWaalsContact N-OE2 3.09Å; S174-E181 PolarHBondContact N-OE2 3.18Å; S175-E181 VanDerWaalsContact CB-OE2 3.22Å; S175-E181 WeakPolarHBondContact CB-OE2 3.36Å; S175-E181 PolarHBondContact N-OE2 3.27Å; S175-E181 VanDerWaalsContact N-OE2 3.15Å; S175-E181 PolarHBondContact OG-OE2 3.31Å; D177-E181 PolarHBondContact O-N 2.97Å; K178-E181 WeakPolarHBondContact O-CB 3.44Å; K178-E181 PolarHBondContact O-N 3.12Å; S179-E181 VanDerWaalsContact C-N 3.25Å; S179-E181 PolarHBondContact O-N 2.98Å; E181-L184 PolarHBondContact O-N 3.42Å; E181-I185 HydrophobicContact CG-CD1 4.28Å; E181-I185 VanDerWaalsContact O-CG1 3.25Å; E181-I185 WeakPolarHBondContact O-CG1 3.41Å; E181-I185 PolarHBondContact O-N 2.78Å; E181-L195 HydrophobicContact CG-CB 4.49Å; E181-L195 HydrophobicContact CG-CD1 3.76Å; E181-L195 HydrophobicContact CG-CD2 3.79Å; E181-L195 HydrophobicContact CG-CG 4.23Å |
| 182 | E | 89.9 | Confident | 90 | Very high | 77 Ų | 77 | 84.7 Ų | 84.7 | 36% | 0.36 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.9 | -39.2 | 177.7 | -63.5 | -69.2 | 154 | 0 | 0 | 111.6 | R172 K180 L184 I185 N186 | R172-E182 IonicContact CZ-OE1 3.68Å; R172-E182 IonicContact NE-OE1 2.78Å; R172-E182 IonicContact NH2-OE1 3.89Å; R172-E182 PolarHBondContact NH2-OE1 3.47Å; K180-E182 VanDerWaalsContact C-N 3.31Å; K180-E182 PolarHBondContact O-N 2.89Å; E182-L184 VanDerWaalsContact C-N 3.34Å; E182-L184 PolarHBondContact O-N 3.26Å; E182-I185 PolarHBondContact O-N 3.17Å; E182-N186 WeakPolarHBondContact O-CB 3.4Å; E182-N186 VanDerWaalsContact O-CG 3.3Å; E182-N186 PolarHBondContact O-N 3.47Å; E182-N186 PolarHBondContact O-ND2 2.74Å |
| 183 | D | 91.9 | Very high | 89.9 | Confident | 113 Ų | 113 | 80.3 Ų | 80.3 | 60% | 0.604 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -62.9 | -40.9 | 173.6 | -60.8 | -34.1 | 0 | 0 | 0 | 111.4 | K180 N186 S187 | K180-D183 PolarHBondContact O-N 2.96Å; D183-N186 PolarHBondContact O-N 3.09Å; D183-S187 PolarHBondContact O-N 3.24Å |
| 184 | L | 91.7 | Very high | 89.9 | Confident | 50 Ų | 50 | 81.3 Ų | 81.3 | 26% | 0.262 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -66.9 | -37.6 | 176.8 | -67.8 | 173.7 | 0 | 0 | 0 | 112 | K180 E181 E182 N186 S187 Y192 L195 | K180-L184 VanDerWaalsContact O-CG 3.28Å; K180-L184 WeakPolarHBondContact O-CG 3.22Å; K180-L184 PolarHBondContact O-N 3.25Å; E181-L184 PolarHBondContact O-N 3.42Å; E182-L184 VanDerWaalsContact C-N 3.34Å; E182-L184 PolarHBondContact O-N 3.26Å; L184-N186 VanDerWaalsContact C-N 3.33Å; L184-S187 WeakPolarHBondContact O-CB 3.25Å; L184-S187 PolarHBondContact O-N 2.65Å; L184-S187 PolarHBondContact O-OG 3.29Å; L184-Y192 HydrophobicContact CB-CD1 4.2Å; L184-Y192 HydrophobicContact CB-CD2 4.39Å; L184-Y192 HydrophobicContact CB-CG 4.04Å; L184-Y192 HydrophobicContact CD1-CD1 4.03Å; L184-Y192 HydrophobicContact CD1-CE1 3.88Å; L184-Y192 HydrophobicContact CD2-CD1 4.34Å; L184-Y192 HydrophobicContact CD2-CD2 4.01Å; L184-Y192 HydrophobicContact CD2-CE1 4.05Å; L184-Y192 HydrophobicContact CD2-CE2 3.75Å; L184-Y192 HydrophobicContact CD2-CG 4.31Å; L184-Y192 HydrophobicContact CG-CD1 4.43Å; L184-Y192 HydrophobicContact CG-CE1 4.43Å; L184-L195 HydrophobicContact CB-CD1 3.79Å; L184-L195 HydrophobicContact CD1-CD1 4.48Å |
| 185 | I | 89.7 | Confident | 89.9 | Confident | 26 Ų | 26 | 80.3 Ų | 80.3 | 13% | 0.133 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -62.1 | -43.6 | 173.5 | -69.8 | 161.6 | 0 | 0 | 0 | 110.6 | E181 E182 S187 L195 K196 | E181-I185 HydrophobicContact CG-CD1 4.28Å; E181-I185 VanDerWaalsContact O-CG1 3.25Å; E181-I185 WeakPolarHBondContact O-CG1 3.41Å; E181-I185 PolarHBondContact O-N 2.78Å; E182-I185 PolarHBondContact O-N 3.17Å; I185-S187 VanDerWaalsContact C-N 3.33Å; I185-L195 HydrophobicContact CD1-CB 3.93Å; I185-L195 HydrophobicContact CG1-CB 3.4Å; I185-L195 VanDerWaalsContact CG1-CB 3.4Å; I185-L195 HydrophobicContact CG1-CD1 3.95Å; I185-L195 HydrophobicContact CG1-CG 4.34Å; I185-K196 HydrophobicContact CG2-CG 4.07Å |
| 186 | N | 90.5 | Very high | 90 | Very high | 126 Ų | 126 | 85.8 Ų | 85.8 | 67% | 0.674 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -76.7 | -18.5 | -177.9 | -68.6 | -35.1 | 0 | 0 | 0 | 113.5 | E182 D183 L184 G188 | E182-N186 WeakPolarHBondContact O-CB 3.4Å; E182-N186 VanDerWaalsContact O-CG 3.3Å; E182-N186 PolarHBondContact O-N 3.47Å; E182-N186 PolarHBondContact O-ND2 2.74Å; D183-N186 PolarHBondContact O-N 3.09Å; L184-N186 VanDerWaalsContact C-N 3.33Å; N186-G188 PolarHBondContact O-N 3.15Å |
| 187 | S | 90.5 | Very high | 90.4 | Very high | 69 Ų | 69 | 77.6 Ų | 77.6 | 48% | 0.483 | 42% | 0.42 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.3 | -25.5 | 177.1 | 75.1 | 0 | 0 | 0 | 0 | 113.7 | D183 L184 I185 D189 | D183-S187 PolarHBondContact O-N 3.24Å; L184-S187 WeakPolarHBondContact O-CB 3.25Å; L184-S187 PolarHBondContact O-N 2.65Å; L184-S187 PolarHBondContact O-OG 3.29Å; I185-S187 VanDerWaalsContact C-N 3.33Å; S187-D189 PolarHBondContact O-N 3.5Å; S187-D189 PolarHBondContact OG-N 3Å |
| 188 | G | 87.3 | Confident | 90.7 | Very high | 62 Ų | 62 | 79.2 Ų | 79.2 | 64% | 0.639 | 43% | 0.433 | S | S | * | . | trans | 74.1 | 1 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | N186 | N186-G188 PolarHBondContact O-N 3.15Š| ||
| 189 | D | 89.6 | Confident | 91.2 | Very high | 69 Ų | 69 | 72.4 Ų | 72.4 | 37% | 0.369 | 40% | 0.404 | S | S | . | . | trans | -67.1 | 124.9 | 178.9 | 175.9 | -7.1 | 0 | 0 | 0 | 110.4 | S187 K191 Y192 | S187-D189 PolarHBondContact O-N 3.5Å; S187-D189 PolarHBondContact OG-N 3Å; D189-K191 PolarHBondContact O-N 3.29Å; D189-K191 VanDerWaalsContact O-N 3.09Å; D189-K191 WeakPolarHBondContact OD1-CB 3.39Å; D189-K191 PolarHBondContact OD1-N 3.15Å; D189-Y192 HydrophobicContact CB-CD2 3.98Å; D189-Y192 PolarHBondContact O-N 2.69Å | ||
| 190 | P | 87.8 | Confident | 91.8 | Very high | 109 Ų | 109 | 68.2 Ų | 68.2 | 71% | 0.708 | 38% | 0.375 | S | S | * | . | G | 310 helix | trans | -57.3 | -25.6 | -179.1 | 23.6 | -35.3 | 0 | 0 | 0 | 113.3 | Y192 A193 | P190-Y192 PolarHBondContact O-N 3.47Å; P190-A193 VanDerWaalsContact O-CB 3.3Å; P190-A193 WeakPolarHBondContact O-CB 3.29Å; P190-A193 PolarHBondContact O-N 3Å; P190-A193 VanDerWaalsContact O-N 3.17Å |
| 191 | K | 89.3 | Confident | 92.1 | Very high | 137 Ų | 137 | 62.8 Ų | 62.8 | 60% | 0.596 | 35% | 0.351 | S | S | * | . | G | 310 helix | trans | -56.7 | -32.8 | 174.5 | -177.7 | -178.2 | 173.7 | -169.1 | 0 | 112.6 | D189 H194 | D189-K191 PolarHBondContact O-N 3.29Å; D189-K191 VanDerWaalsContact O-N 3.09Å; D189-K191 WeakPolarHBondContact OD1-CB 3.39Å; D189-K191 PolarHBondContact OD1-N 3.15Å; K191-H194 PolarHBondContact O-CD2 3.04Å; K191-H194 VanDerWaalsContact O-CD2 3.23Å |
| 192 | Y | 92 | Very high | 92.4 | Very high | 59 Ų | 59 | 65.9 Ų | 65.9 | 23% | 0.231 | 36% | 0.362 | C | S | . | . | G | 310 helix | trans | -104.1 | 6.4 | -177 | -59 | -68.6 | 0 | 0 | 0 | 113 | L184 D189 P190 H194 L195 | L184-Y192 HydrophobicContact CB-CD1 4.2Å; L184-Y192 HydrophobicContact CB-CD2 4.39Å; L184-Y192 HydrophobicContact CB-CG 4.04Å; L184-Y192 HydrophobicContact CD1-CD1 4.03Å; L184-Y192 HydrophobicContact CD1-CE1 3.88Å; L184-Y192 HydrophobicContact CD2-CD1 4.34Å; L184-Y192 HydrophobicContact CD2-CD2 4.01Å; L184-Y192 HydrophobicContact CD2-CE1 4.05Å; L184-Y192 HydrophobicContact CD2-CE2 3.75Å; L184-Y192 HydrophobicContact CD2-CG 4.31Å; L184-Y192 HydrophobicContact CG-CD1 4.43Å; L184-Y192 HydrophobicContact CG-CE1 4.43Å; D189-Y192 HydrophobicContact CB-CD2 3.98Å; D189-Y192 PolarHBondContact O-N 2.69Å; P190-Y192 PolarHBondContact O-N 3.47Å; Y192-H194 PolarHBondContact O-N 3.45Å; Y192-H194 VanDerWaalsContact O-N 3.09Å; Y192-L195 HydrophobicContact CD1-CD1 4.19Å; Y192-L195 HydrophobicContact CG-CD1 4.43Å; Y192-L195 WeakPolarHBondContact O-CB 3.46Å; Y192-L195 WeakPolarHBondContact O-CG 3.24Å; Y192-L195 PolarHBondContact O-N 3.38Å |
| 193 | A | 90.8 | Very high | 92.7 | Very high | 53 Ų | 53 | 62.2 Ų | 62.2 | 44% | 0.438 | 35% | 0.345 | S | S | . | . | G | 310 helix | trans | -55.8 | -31.4 | 180 | 0 | 0 | 0 | 0 | 0 | 112.8 | P190 L195 K196 | P190-A193 VanDerWaalsContact O-CB 3.3Å; P190-A193 WeakPolarHBondContact O-CB 3.29Å; P190-A193 PolarHBondContact O-N 3Å; P190-A193 VanDerWaalsContact O-N 3.17Å; A193-L195 PolarHBondContact O-N 3.48Å; A193-L195 VanDerWaalsContact O-N 3.17Å; A193-K196 PolarHBondContact O-N 3.28Å |
| 194 | H | 92.7 | Very high | 92.9 | Very high | 50 Ų | 50 | 57.1 Ų | 57.1 | 23% | 0.231 | 32% | 0.318 | C | S | . | . | G | 310 helix | trans | -61.7 | -20.7 | 177.5 | 69.4 | 77.4 | 0 | 0 | 0 | 113.9 | L170 G171 K191 Y192 K196 D197 | L170-H194 HydrophobicContact CB-CB 4.37Å; G171-H194 WeakPolarHBondContact CA-O 3.26Å; G171-H194 PolarHBondContact N-ND1 3.25Å; G171-H194 PolarHBondContact N-O 3.08Å; K191-H194 PolarHBondContact O-CD2 3.04Å; K191-H194 VanDerWaalsContact O-CD2 3.23Å; Y192-H194 PolarHBondContact O-N 3.45Å; Y192-H194 VanDerWaalsContact O-N 3.09Å; H194-K196 PolarHBondContact O-N 3.49Å; H194-D197 WeakPolarHBondContact O-CB 3.27Å; H194-D197 PolarHBondContact O-N 3.47Å; H194-D197 VanDerWaalsContact O-N 3.09Å |
| 195 | L | 94.7 | Very high | 93.1 | Very high | 1 Ų | 1 | 54.9 Ų | 54.9 | 1% | 0.005 | 31% | 0.306 | C | S | . | . | G | 310 helix | trans | -68.4 | -15.6 | -179.2 | -64.8 | 177 | 0 | 0 | 0 | 112.9 | R172 E181 L184 I185 Y192 A193 D197 | R172-L195 WeakPolarHBondContact CB-O 3.3Å; E181-L195 HydrophobicContact CG-CB 4.49Å; E181-L195 HydrophobicContact CG-CD1 3.76Å; E181-L195 HydrophobicContact CG-CD2 3.79Å; E181-L195 HydrophobicContact CG-CG 4.23Å; L184-L195 HydrophobicContact CB-CD1 3.79Å; L184-L195 HydrophobicContact CD1-CD1 4.48Å; I185-L195 HydrophobicContact CD1-CB 3.93Å; I185-L195 HydrophobicContact CG1-CB 3.4Å; I185-L195 VanDerWaalsContact CG1-CB 3.4Å; I185-L195 HydrophobicContact CG1-CD1 3.95Å; I185-L195 HydrophobicContact CG1-CG 4.34Å; Y192-L195 HydrophobicContact CD1-CD1 4.19Å; Y192-L195 HydrophobicContact CG-CD1 4.43Å; Y192-L195 WeakPolarHBondContact O-CB 3.46Å; Y192-L195 WeakPolarHBondContact O-CG 3.24Å; Y192-L195 PolarHBondContact O-N 3.38Å; A193-L195 PolarHBondContact O-N 3.48Å; A193-L195 VanDerWaalsContact O-N 3.17Å; L195-D197 VanDerWaalsContact C-N 3.34Å |
| 196 | K | 92.4 | Very high | 93.3 | Very high | 150 Ų | 150 | 57.4 Ų | 57.4 | 65% | 0.652 | 32% | 0.323 | S | S | * | . | G | 310 helix | trans | -77.7 | -19.7 | 172.6 | -62.5 | 177.8 | -178 | 176.1 | 0 | 112.8 | I185 A193 H194 | I185-K196 HydrophobicContact CG2-CG 4.07Å; A193-K196 PolarHBondContact O-N 3.28Å; H194-K196 PolarHBondContact O-N 3.49Å |
| 197 | D | 94.3 | Very high | 93.3 | Very high | 55 Ų | 55 | 51.7 Ų | 51.7 | 29% | 0.294 | 29% | 0.293 | S | S | . | . | S | Bend | trans | -79.2 | 156 | 177.5 | -69.8 | -11 | 0 | 0 | 0 | 111.1 | K131 G171 R172 H194 L195 H200 | K131-D197 IonicContact NZ-OD2 3.66Å; K131-D197 PolarHBondContact NZ-OD2 2.93Å; G171-D197 CarbonylContact C-O 3.58Å; G171-D197 VanDerWaalsContact CA-O 3.3Å; G171-D197 WeakPolarHBondContact CA-O 3.41Å; R172-D197 PolarHBondContact N-O 3.25Å; H194-D197 WeakPolarHBondContact O-CB 3.27Å; H194-D197 PolarHBondContact O-N 3.47Å; H194-D197 VanDerWaalsContact O-N 3.09Å; L195-D197 VanDerWaalsContact C-N 3.34Å; D197-H200 IonicContact OD2-CE1 3.27Å |
| 198 | P | 95.9 | Very high | 93.3 | Very high | 86 Ų | 86 | 51 Ų | 51 | 56% | 0.558 | 29% | 0.286 | S | S | * | . | P | Polyproline II helix | trans | -57 | 153 | 168.5 | -22 | 33 | 0 | 0 | 0 | 112.1 | L133 H200 | L133-P198 HydrophobicContact CD2-CB 4.05Å; P198-H200 PolarHBondContact O-N 3.21Å; P198-H200 VanDerWaalsContact O-N 3.14Å; P198-H200 PolarHBondContact O-ND1 3.26Å |
| 199 | L | 97 | Very high | 93.5 | Very high | 15 Ų | 15 | 48.2 Ų | 48.2 | 8% | 0.079 | 26% | 0.258 | C | S | . | . | S | Bend | trans | -54.6 | 121.1 | 175.5 | -171.3 | 69.6 | 0 | 0 | 0 | 110.9 | V134 V136 V145 V169 L170 R172 | V134-L199 HydrophobicContact CB-CB 4.34Å; V134-L199 HydrophobicContact CB-CD2 3.86Å; V134-L199 HydrophobicContact CB-CG 3.96Å; V134-L199 HydrophobicContact CG1-CD2 3.81Å; V134-L199 HydrophobicContact CG1-CG 4.45Å; V134-L199 HydrophobicContact CG2-CD2 4.16Å; V134-L199 HydrophobicContact CG2-CG 3.95Å; V134-L199 PolarHBondContact N-O 3.01Å; V136-L199 HydrophobicContact CG1-CD2 3.57Å; V145-L199 HydrophobicContact CG2-CD1 4.06Å; V145-L199 HydrophobicContact CG2-CD2 3.87Å; V169-L199 HydrophobicContact CG1-CD1 4.38Å; L170-L199 WeakPolarHBondContact O-CD1 3.47Å; R172-L199 WeakPolarHBondContact O-CB 3.37Å |
| 200 | H | 97.6 | Very high | 93.5 | Very high | 6 Ų | 6 | 48.8 Ų | 48.8 | 3% | 0.028 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.8 | 160.4 | -176.7 | 65.1 | -86.6 | 0 | 0 | 0 | 112.1 | V132 L170 D197 P198 | V132-H200 CarbonylContact O-C 3.48Å; V132-H200 VanDerWaalsContact O-CA 3.23Å; V132-H200 WeakPolarHBondContact O-CA 3.26Å; V132-H200 WeakPolarHBondContact O-CB 3.32Å; L170-H200 PolarHBondContact N-O 3.06Å; L170-H200 PolarHBondContact O-N 3.29Å; D197-H200 IonicContact OD2-CE1 3.27Å; P198-H200 PolarHBondContact O-N 3.21Å; P198-H200 VanDerWaalsContact O-N 3.14Å; P198-H200 PolarHBondContact O-ND1 3.26Å |
| 201 | V | 98 | Very high | 93.8 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 25% | 0.247 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -106.1 | 122.8 | 171.1 | -179.1 | 0 | 0 | 0 | 0 | 108.2 | K131 V132 V134 L148 I167 Y168 I203 L223 | K131-V201 CarbonylContact C-O 3.51Å; K131-V201 WeakPolarHBondContact CA-O 3.4Å; V132-V201 PolarHBondContact N-O 3.27Å; V132-V201 PolarHBondContact O-N 3.31Å; V134-V201 HydrophobicContact CG2-CG2 4.05Å; L148-V201 HydrophobicContact CD2-CG2 3.58Å; I167-V201 HydrophobicContact CG2-CG1 3.43Å; I167-V201 VanDerWaalsContact CG2-CG1 3.43Å; Y168-V201 CarbonylContact O-C 3.58Å; Y168-V201 VanDerWaalsContact O-CA 3.24Å; Y168-V201 WeakPolarHBondContact O-CA 3.4Å; V201-I203 HydrophobicContact CG1-CG1 4.49Å; V201-L223 HydrophobicContact CB-CD2 3.92Å; V201-L223 HydrophobicContact CG1-CD1 4.23Å; V201-L223 HydrophobicContact CG1-CD2 3.83Å; V201-L223 HydrophobicContact CG2-CD1 4.3Å; V201-L223 HydrophobicContact CG2-CD2 4.39Å |
| 202 | R | 96.8 | Very high | 94 | Very high | 71 Ų | 71 | 40.2 Ų | 40.2 | 27% | 0.268 | 22% | 0.219 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -96.1 | 123.5 | 174 | -176.7 | 177.4 | 69.6 | 170 | 6.5 | 109.4 | M129 R130 I167 Y168 L170 E204 | M129-R202 HydrophobicContact CG-CG 4.01Å; M129-R202 HydrophobicContact SD-CG 4.11Å; R130-R202 WeakPolarHBondContact O-CA 3.3Å; I167-R202 WeakPolarHBondContact CA-O 3.44Å; Y168-R202 HydrophobicContact CD2-CB 4.41Å; Y168-R202 PolarHBondContact N-O 3.31Å; Y168-R202 PolarHBondContact O-N 3.5Å; L170-R202 HydrophobicContact CD1-CB 3.92Å; R202-E204 WeakPolarHBondContact CD-OE1 3.17Å; R202-E204 HydrophobicContact CG-CG 4.2Å; R202-E204 IonicContact CZ-OE1 3.19Å; R202-E204 IonicContact NE-OE1 3.61Å; R202-E204 PolarHBondContact NE-OE1 3.18Å; R202-E204 IonicContact NH1-OE1 3.63Å; R202-E204 PolarHBondContact NH1-OE1 3.23Å; R202-E204 IonicContact NH2-OE1 2.98Å; R202-E204 PolarHBondContact NH2-OE1 3.23Å |
| 203 | I | 97.4 | Very high | 94.2 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 23% | 0.227 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -105.8 | 129 | 173.5 | -54.3 | 170.6 | 0 | 0 | 0 | 107.6 | M129 R130 V132 C165 R166 V201 V205 L216 A219 L220 L223 | M129-I203 WeakPolarHBondContact CA-O 3.24Å; R130-I203 PolarHBondContact N-O 3.47Å; R130-I203 PolarHBondContact O-N 3.17Å; V132-I203 HydrophobicContact CG2-CD1 4.19Å; C165-I203 HydrophobicContact CB-CG2 3.92Å; R166-I203 CarbonylContact O-C 3.2Å; R166-I203 WeakPolarHBondContact O-CA 3.46Å; V201-I203 HydrophobicContact CG1-CG1 4.49Å; I203-V205 HydrophobicContact CG2-CG2 4.29Å; I203-L216 HydrophobicContact CB-CD1 4.19Å; I203-L216 HydrophobicContact CG2-CD1 3.82Å; I203-A219 HydrophobicContact CD1-CB 4.1Å; I203-A219 HydrophobicContact CG2-CB 4.04Å; I203-L220 HydrophobicContact CD1-CD2 3.82Å; I203-L220 HydrophobicContact CD1-CG 4.27Å; I203-L223 HydrophobicContact CD1-CD2 4.05Å |
| 204 | E | 95.7 | Very high | 94.5 | Very high | 6 Ų | 6 | 46 Ų | 46 | 3% | 0.028 | 24% | 0.236 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -125.8 | 136.2 | 172.8 | -60 | -176.9 | -172.5 | 0 | 0 | 110.8 | R127 L128 M129 R166 Y168 R202 | R127-E204 IonicContact CZ-OE2 2.8Å; R127-E204 IonicContact NE-OE2 3.3Å; R127-E204 VanDerWaalsContact NH2-CD 3.26Å; R127-E204 IonicContact NH2-OE1 2.86Å; R127-E204 PolarHBondContact NH2-OE1 3.27Å; R127-E204 IonicContact NH2-OE2 3.67Å; R127-E204 PolarHBondContact NH2-OE2 3.49Å; L128-E204 WeakPolarHBondContact O-CA 3.3Å; M129-E204 HydrophobicContact CB-CG 4.36Å; M129-E204 HydrophobicContact CG-CG 3.9Å; R166-E204 HydrophobicContact CB-CB 4.22Å; R166-E204 PolarHBondContact N-O 3.35Å; R166-E204 PolarHBondContact O-N 3.42Å; Y168-E204 HydrophobicContact CE2-CG 4.34Å; R202-E204 WeakPolarHBondContact CD-OE1 3.17Å; R202-E204 HydrophobicContact CG-CG 4.2Å; R202-E204 IonicContact CZ-OE1 3.19Å; R202-E204 IonicContact NE-OE1 3.61Å; R202-E204 PolarHBondContact NE-OE1 3.18Å; R202-E204 IonicContact NH1-OE1 3.63Å; R202-E204 PolarHBondContact NH1-OE1 3.23Å; R202-E204 IonicContact NH2-OE1 2.98Å; R202-E204 PolarHBondContact NH2-OE1 3.23Å |
| 205 | V | 95.4 | Very high | 94.7 | Very high | 2 Ų | 2 | 47.5 Ų | 47.5 | 1% | 0.012 | 24% | 0.239 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -130.9 | 133.4 | -179.8 | -168.8 | 0 | 0 | 0 | 0 | 109.1 | R127 L128 C165 I203 A207 A212 R215 L216 | R127-V205 CarbonylContact C-O 3.58Å; R127-V205 VanDerWaalsContact CA-O 3.31Å; R127-V205 WeakPolarHBondContact CA-O 3.17Å; L128-V205 HydrophobicContact CB-CB 4.45Å; L128-V205 PolarHBondContact N-O 2.91Å; L128-V205 PolarHBondContact O-N 3.28Å; C165-V205 HydrophobicContact CB-CG2 4.18Å; C165-V205 WeakPolarHBondContact SG-CG2 3.32Å; I203-V205 HydrophobicContact CG2-CG2 4.29Å; V205-A207 HydrophobicContact CG1-CB 4.45Å; V205-A212 HydrophobicContact CG1-CB 4.22Å; V205-R215 HydrophobicContact CG1-CB 3.89Å; V205-L216 HydrophobicContact CG2-CB 4.16Å; V205-L216 HydrophobicContact CG2-CD1 4.46Å |
| 206 | V | 93 | Very high | 94.8 | Very high | 80 Ų | 80 | 48 Ų | 48 | 49% | 0.485 | 24% | 0.242 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -125 | 111.2 | 170.5 | -177.9 | 0 | 0 | 0 | 0 | 108 | P125 I126 R127 | P125-V206 HydrophobicContact CB-CG1 3.89Å; I126-V206 WeakPolarHBondContact O-CA 3.4Å; R127-V206 HydrophobicContact CB-CG2 4.29Å; R127-V206 HydrophobicContact CG-CG2 4.06Å |
| 207 | A | 91.9 | Very high | 95.1 | Very high | 5 Ų | 5 | 43.6 Ų | 43.6 | 4% | 0.041 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -166.5 | 167.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 110 | P125 I126 V205 I211 A212 | P125-A207 CarbonylContact C-O 3.55Å; P125-A207 WeakPolarHBondContact CA-O 3.44Å; I126-A207 PolarHBondContact N-O 3.12Å; I126-A207 PolarHBondContact O-N 3.14Å; V205-A207 HydrophobicContact CG1-CB 4.45Å; A207-I211 HydrophobicContact CB-CB 4.18Å; A207-I211 HydrophobicContact CB-CG2 3.96Å; A207-A212 HydrophobicContact CB-CB 4.06Å |
| 208 | P | 90.7 | Very high | 95.3 | Very high | 54 Ų | 54 | 44.5 Ų | 44.5 | 35% | 0.351 | 24% | 0.236 | S | C | . | . | trans | -53.6 | 147.1 | 166.6 | -25.9 | 35.7 | 0 | 0 | 0 | 111.2 | I211 A212 | P208-I211 PolarHBondContact O-N 2.94Å; P208-A212 PolarHBondContact O-N 3.5Å | ||
| 209 | A | 89.9 | Confident | 95.4 | Very high | 4 Ų | 4 | 40.4 Ų | 40.4 | 3% | 0.033 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -45 | -56.1 | -169.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | L117 I126 I211 A212 Y213 | L117-A209 HydrophobicContact CD1-CB 4.26Å; L117-A209 HydrophobicContact CD2-CB 4.02Å; I126-A209 HydrophobicContact CD1-CB 3.87Å; I126-A209 HydrophobicContact CG1-CB 4.44Å; A209-I211 VanDerWaalsContact C-N 3.3Å; A209-I211 PolarHBondContact O-N 3.45Å; A209-A212 PolarHBondContact O-N 2.71Å; A209-A212 VanDerWaalsContact O-N 3.13Å; A209-Y213 WeakPolarHBondContact O-CD2 3.33Å; A209-Y213 PolarHBondContact O-N 3.14Å; A209-Y213 VanDerWaalsContact O-N 3.12Å |
| 210 | P | 91.1 | Very high | 95.4 | Very high | 82 Ų | 82 | 43.1 Ų | 43.1 | 53% | 0.532 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60.8 | -39.7 | -177.7 | 22.7 | -33.8 | 0 | 0 | 0 | 112.6 | Q214 | P210-Q214 WeakPolarHBondContact O-CB 3.14Å; P210-Q214 PolarHBondContact O-N 3.46Å; P210-Q214 VanDerWaalsContact O-N 3.14Å |
| 211 | I | 93.4 | Very high | 95.4 | Very high | 65 Ų | 65 | 49.4 Ų | 49.4 | 33% | 0.333 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -71.4 | -36.6 | 178.9 | -57.6 | -58.3 | 0 | 0 | 0 | 111.2 | A207 P208 A209 Q214 R215 | A207-I211 HydrophobicContact CB-CB 4.18Å; A207-I211 HydrophobicContact CB-CG2 3.96Å; P208-I211 PolarHBondContact O-N 2.94Å; A209-I211 VanDerWaalsContact C-N 3.3Å; A209-I211 PolarHBondContact O-N 3.45Å; I211-Q214 PolarHBondContact O-N 3.2Å; I211-R215 HydrophobicContact CG2-CG 4.29Å; I211-R215 WeakPolarHBondContact O-CB 3.48Å; I211-R215 VanDerWaalsContact O-CG 3.28Å; I211-R215 WeakPolarHBondContact O-CG 3.44Å; I211-R215 PolarHBondContact O-N 3.32Å |
| 212 | A | 93.9 | Very high | 95.2 | Very high | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -62.5 | -49.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | I126 L128 V205 A207 P208 A209 R215 L216 | I126-A212 HydrophobicContact CD1-CB 4.08Å; I126-A212 HydrophobicContact CG1-CB 3.77Å; L128-A212 HydrophobicContact CD1-CB 3.68Å; L128-A212 HydrophobicContact CG-CB 4.07Å; V205-A212 HydrophobicContact CG1-CB 4.22Å; A207-A212 HydrophobicContact CB-CB 4.06Å; P208-A212 PolarHBondContact O-N 3.5Å; A209-A212 PolarHBondContact O-N 2.71Å; A209-A212 VanDerWaalsContact O-N 3.13Å; A212-R215 PolarHBondContact O-N 2.88Å; A212-L216 WeakPolarHBondContact O-CB 3.47Å; A212-L216 PolarHBondContact O-N 2.92Å |
| 213 | Y | 95.1 | Very high | 95.2 | Very high | 104 Ų | 104 | 48.4 Ų | 48.4 | 41% | 0.408 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -63.6 | -42.3 | 177.2 | -74.3 | -73.2 | 0 | 0 | 0 | 112.1 | L117 I126 L128 A209 R215 L216 A217 | L117-Y213 HydrophobicContact CD1-CE2 3.91Å; I126-Y213 HydrophobicContact CD1-CD2 4.49Å; I126-Y213 HydrophobicContact CD1-CE2 3.89Å; L128-Y213 HydrophobicContact CD1-CD1 3.73Å; L128-Y213 HydrophobicContact CD1-CD2 4.34Å; L128-Y213 HydrophobicContact CD1-CE1 3.9Å; L128-Y213 HydrophobicContact CD1-CE2 4.47Å; L128-Y213 HydrophobicContact CD1-CG 3.95Å; L128-Y213 HydrophobicContact CD2-CE1 4.08Å; A209-Y213 WeakPolarHBondContact O-CD2 3.33Å; A209-Y213 PolarHBondContact O-N 3.14Å; A209-Y213 VanDerWaalsContact O-N 3.12Å; Y213-R215 PolarHBondContact O-N 3.48Å; Y213-L216 PolarHBondContact O-N 3.25Å; Y213-A217 WeakPolarHBondContact O-CB 3.3Å; Y213-A217 PolarHBondContact O-N 3.41Å |
| 214 | Q | 97.1 | Very high | 95 | Very high | 130 Ų | 130 | 53.7 Ų | 53.7 | 61% | 0.607 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -59.8 | -46 | 176.5 | -175.7 | -174.9 | -5 | 0 | 0 | 112 | P210 I211 A217 H218 | P210-Q214 WeakPolarHBondContact O-CB 3.14Å; P210-Q214 PolarHBondContact O-N 3.46Å; P210-Q214 VanDerWaalsContact O-N 3.14Å; I211-Q214 PolarHBondContact O-N 3.2Å; Q214-A217 PolarHBondContact O-N 2.97Å; Q214-H218 WeakPolarHBondContact O-CB 3.34Å; Q214-H218 PolarHBondContact O-N 3.28Å |
| 215 | R | 98 | Very high | 94.8 | Very high | 81 Ų | 81 | 60.7 Ų | 60.7 | 31% | 0.306 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -64.6 | -42.8 | 178 | -75.9 | 176.9 | -178.5 | 175.8 | 5.2 | 111.9 | V205 I211 A212 Y213 H218 A219 | V205-R215 HydrophobicContact CG1-CB 3.89Å; I211-R215 HydrophobicContact CG2-CG 4.29Å; I211-R215 WeakPolarHBondContact O-CB 3.48Å; I211-R215 VanDerWaalsContact O-CG 3.28Å; I211-R215 WeakPolarHBondContact O-CG 3.44Å; I211-R215 PolarHBondContact O-N 3.32Å; A212-R215 PolarHBondContact O-N 2.88Å; Y213-R215 PolarHBondContact O-N 3.48Å; R215-H218 PolarHBondContact O-N 3.02Å; R215-A219 WeakPolarHBondContact O-CB 3.49Å; R215-A219 PolarHBondContact O-N 2.9Å |
| 216 | L | 97.5 | Very high | 94.7 | Very high | 12 Ų | 12 | 62.6 Ų | 62.6 | 6% | 0.063 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61.3 | -45.9 | 176.6 | -179.7 | 61.4 | 0 | 0 | 0 | 111.2 | L128 R130 I203 V205 A212 Y213 A219 L220 | L128-L216 HydrophobicContact CB-CD2 4.17Å; L128-L216 HydrophobicContact CD1-CB 4.39Å; L128-L216 HydrophobicContact CD1-CD2 4.01Å; R130-L216 HydrophobicContact CB-CD1 4.34Å; R130-L216 HydrophobicContact CG-CD1 4.29Å; R130-L216 HydrophobicContact CG-CD2 3.98Å; I203-L216 HydrophobicContact CB-CD1 4.19Å; I203-L216 HydrophobicContact CG2-CD1 3.82Å; V205-L216 HydrophobicContact CG2-CB 4.16Å; V205-L216 HydrophobicContact CG2-CD1 4.46Å; A212-L216 WeakPolarHBondContact O-CB 3.47Å; A212-L216 PolarHBondContact O-N 2.92Å; Y213-L216 PolarHBondContact O-N 3.25Å; L216-A219 PolarHBondContact O-N 3.19Å; L216-L220 HydrophobicContact CD1-CD1 4.42Å; L216-L220 HydrophobicContact CD1-CG 4.43Å; L216-L220 HydrophobicContact CG-CD1 4.19Å; L216-L220 VanDerWaalsContact O-CG 3.3Å; L216-L220 WeakPolarHBondContact O-CG 3.39Å; L216-L220 PolarHBondContact O-N 3.44Å |
| 217 | A | 97.9 | Very high | 94.8 | Very high | 58 Ų | 58 | 59.6 Ų | 59.6 | 48% | 0.479 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -60.4 | -45.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | Y213 Q214 A219 L220 H221 | Y213-A217 WeakPolarHBondContact O-CB 3.3Å; Y213-A217 PolarHBondContact O-N 3.41Å; Q214-A217 PolarHBondContact O-N 2.97Å; A217-A219 PolarHBondContact O-N 2.97Å; A217-L220 PolarHBondContact O-N 3.25Å; A217-H221 PolarHBondContact O-N 3.09Å |
| 218 | H | 98.1 | Very high | 94.7 | Very high | 73 Ų | 73 | 63.2 Ų | 63.2 | 34% | 0.338 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -60.6 | -44.1 | 175.7 | -177.5 | -166.9 | 0 | 0 | 0 | 111.6 | Q162 Q214 R215 L220 H221 E222 | Q162-H218 PolarHBondContact NE2-NE2 3.22Å; Q214-H218 WeakPolarHBondContact O-CB 3.34Å; Q214-H218 PolarHBondContact O-N 3.28Å; R215-H218 PolarHBondContact O-N 3.02Å; H218-L220 PolarHBondContact O-N 2.87Å; H218-H221 PolarHBondContact O-N 3.49Å; H218-E222 IonicContact NE2-OE1 2.83Å; H218-E222 WeakPolarHBondContact O-CG 3.1Å; H218-E222 PolarHBondContact O-N 3.41Å |
| 219 | A | 97.9 | Very high | 94.5 | Very high | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -63.2 | -40.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113 | T163 C165 I203 R215 L216 A217 L223 | T163-A219 HydrophobicContact CG2-CB 3.92Å; C165-A219 HydrophobicContact CB-CB 4.34Å; I203-A219 HydrophobicContact CD1-CB 4.1Å; I203-A219 HydrophobicContact CG2-CB 4.04Å; R215-A219 WeakPolarHBondContact O-CB 3.49Å; R215-A219 PolarHBondContact O-N 2.9Å; L216-A219 PolarHBondContact O-N 3.19Å; A217-A219 PolarHBondContact O-N 2.97Å; A219-L223 WeakPolarHBondContact O-CB 3.39Å; A219-L223 PolarHBondContact O-N 2.68Å |
| 220 | L | 97.7 | Very high | 93.8 | Very high | 72 Ų | 72 | 65.9 Ų | 65.9 | 38% | 0.377 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.8 | -41.4 | 175.6 | -71.4 | 170 | 0 | 0 | 0 | 111.7 | V132 I203 L216 A217 H218 L223 H224 | V132-L220 HydrophobicContact CG2-CD2 3.57Å; I203-L220 HydrophobicContact CD1-CD2 3.82Å; I203-L220 HydrophobicContact CD1-CG 4.27Å; L216-L220 HydrophobicContact CD1-CD1 4.42Å; L216-L220 HydrophobicContact CD1-CG 4.43Å; L216-L220 HydrophobicContact CG-CD1 4.19Å; L216-L220 VanDerWaalsContact O-CG 3.3Å; L216-L220 WeakPolarHBondContact O-CG 3.39Å; L216-L220 PolarHBondContact O-N 3.44Å; A217-L220 PolarHBondContact O-N 3.25Å; H218-L220 PolarHBondContact O-N 2.87Å; L220-L223 PolarHBondContact O-N 3.41Å; L220-H224 PolarHBondContact O-N 2.87Å; L220-H224 VanDerWaalsContact O-N 3.12Å |
| 221 | H | 96.4 | Very high | 92.3 | Very high | 138 Ų | 138 | 71.7 Ų | 71.7 | 64% | 0.639 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -62.4 | -49.5 | 177.5 | -173.1 | 79.5 | 0 | 0 | 0 | 112 | A217 H218 L223 H224 | A217-H221 PolarHBondContact O-N 3.09Å; H218-H221 PolarHBondContact O-N 3.49Å; H221-L223 PolarHBondContact O-N 2.83Å; H221-H224 VanDerWaalsContact O-CB 3.3Å; H221-H224 WeakPolarHBondContact O-CB 3.35Å; H221-H224 PolarHBondContact O-N 3.16Å |
| 222 | E | 95.4 | Very high | 90.2 | Very high | 48 Ų | 48 | 71.3 Ų | 71.3 | 22% | 0.224 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -63.6 | -42.2 | 177.5 | -71.9 | -65.5 | 141.4 | 0 | 0 | 111.9 | L159 Q162 T163 H218 H224 Y225 Y226 | L159-E222 HydrophobicContact CD1-CB 3.37Å; L159-E222 HydrophobicContact CD1-CG 4.09Å; Q162-E222 VanDerWaalsContact NE2-CD 3.29Å; Q162-E222 PolarHBondContact NE2-OE1 2.95Å; T163-E222 HydrophobicContact CG2-CB 4.47Å; T163-E222 HydrophobicContact CG2-CG 4.27Å; H218-E222 IonicContact NE2-OE1 2.83Å; H218-E222 WeakPolarHBondContact O-CG 3.1Å; H218-E222 PolarHBondContact O-N 3.41Å; E222-H224 PolarHBondContact O-N 3.14Å; E222-Y225 PolarHBondContact O-N 3.38Å; E222-Y226 WeakPolarHBondContact O-CD2 3.48Å |
| 223 | L | 95.5 | Very high | 87.9 | Confident | 3 Ų | 3 | 81.9 Ų | 81.9 | 2% | 0.016 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -62.2 | -31.6 | -179.9 | -174.4 | 62.8 | 0 | 0 | 0 | 112.1 | V132 L148 L159 V201 I203 A219 L220 H221 Y225 Y226 L227 | V132-L223 HydrophobicContact CB-CD2 3.9Å; V132-L223 HydrophobicContact CG1-CD2 4Å; V132-L223 HydrophobicContact CG2-CD2 3.92Å; L148-L223 HydrophobicContact CD1-CD1 3.67Å; L148-L223 HydrophobicContact CD2-CD1 4.3Å; L159-L223 HydrophobicContact CD2-CD1 4.45Å; V201-L223 HydrophobicContact CB-CD2 3.92Å; V201-L223 HydrophobicContact CG1-CD1 4.23Å; V201-L223 HydrophobicContact CG1-CD2 3.83Å; V201-L223 HydrophobicContact CG2-CD1 4.3Å; V201-L223 HydrophobicContact CG2-CD2 4.39Å; I203-L223 HydrophobicContact CD1-CD2 4.05Å; A219-L223 WeakPolarHBondContact O-CB 3.39Å; A219-L223 PolarHBondContact O-N 2.68Å; L220-L223 PolarHBondContact O-N 3.41Å; H221-L223 PolarHBondContact O-N 2.83Å; L223-Y225 PolarHBondContact O-N 2.83Å; L223-Y226 PolarHBondContact O-N 3.14Å; L223-L227 HydrophobicContact CD1-CD1 4.49Å; L223-L227 HydrophobicContact CD1-CG 4.25Å; L223-L227 HydrophobicContact CD2-CD1 4.13Å; L223-L227 HydrophobicContact CG-CD1 3.86Å; L223-L227 HydrophobicContact CG-CG 4.04Å; L223-L227 WeakPolarHBondContact O-CG 3Å; L223-L227 PolarHBondContact O-N 3.19Å; L223-L227 VanDerWaalsContact O-N 3.08Å |
| 224 | H | 93.8 | Very high | 85.6 | Confident | 111 Ų | 111 | 83 Ų | 83 | 51% | 0.514 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -53.4 | -41.9 | 176.9 | -177.6 | -114 | 0 | 0 | 0 | 112.1 | L220 H221 E222 Y226 L227 Q228 | L220-H224 PolarHBondContact O-N 2.87Å; L220-H224 VanDerWaalsContact O-N 3.12Å; H221-H224 VanDerWaalsContact O-CB 3.3Å; H221-H224 WeakPolarHBondContact O-CB 3.35Å; H221-H224 PolarHBondContact O-N 3.16Å; E222-H224 PolarHBondContact O-N 3.14Å; H224-Y226 VanDerWaalsContact C-N 3.33Å; H224-Y226 PolarHBondContact O-N 3.4Å; H224-L227 PolarHBondContact O-N 3.45Å; H224-Q228 PolarHBondContact NE2-NE2 2.94Å; H224-Q228 WeakPolarHBondContact O-CG 3.09Å; H224-Q228 PolarHBondContact O-N 3.3Å |
| 225 | Y | 91.6 | Very high | 83.3 | Confident | 152 Ų | 152 | 81.2 Ų | 81.2 | 60% | 0.596 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -60.4 | -40.6 | 177.2 | 173.4 | -99.9 | 0 | 0 | 0 | 112.9 | K147 E222 L223 Q228 | K147-Y225 PolarHBondContact NZ-O 3.2Å; E222-Y225 PolarHBondContact O-N 3.38Å; L223-Y225 PolarHBondContact O-N 2.83Å; Y225-Q228 PolarHBondContact O-N 3.3Å |
| 226 | Y | 93 | Very high | 81 | Confident | 42 Ų | 42 | 83.9 Ų | 83.9 | 17% | 0.165 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -72.6 | -30.7 | -179 | -66.2 | -79.8 | 0 | 0 | 0 | 112.6 | K147 L148 T155 L159 E222 L223 H224 Q228 | K147-Y226 HydrophobicContact CG-CD1 4.3Å; L148-Y226 HydrophobicContact CD1-CD1 4.28Å; L148-Y226 HydrophobicContact CD1-CD2 4.24Å; L148-Y226 HydrophobicContact CD1-CG 3.81Å; T155-Y226 HydrophobicContact CG2-CD1 4.26Å; T155-Y226 HydrophobicContact CG2-CE1 3.32Å; L159-Y226 HydrophobicContact CD1-CE2 4.39Å; L159-Y226 HydrophobicContact CD2-CD2 4.37Å; L159-Y226 HydrophobicContact CD2-CE2 4.36Å; E222-Y226 WeakPolarHBondContact O-CD2 3.48Å; L223-Y226 PolarHBondContact O-N 3.14Å; H224-Y226 VanDerWaalsContact C-N 3.33Å; H224-Y226 PolarHBondContact O-N 3.4Å; Y226-Q228 VanDerWaalsContact C-N 3.32Å |
| 227 | L | 94.1 | Very high | 78.9 | Confident | 17 Ų | 17 | 87.3 Ų | 87.3 | 9% | 0.089 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -84.3 | -1.2 | 179.4 | -61 | -176.3 | 0 | 0 | 0 | 114.3 | V132 V134 P135 F144 L223 H224 | V132-L227 HydrophobicContact CG1-CD1 3.57Å; V134-L227 HydrophobicContact CB-CD2 4.45Å; V134-L227 HydrophobicContact CG1-CD2 4.17Å; V134-L227 HydrophobicContact CG2-CD2 4.04Å; P135-L227 VanDerWaalsContact CG-O 3.3Å; P135-L227 WeakPolarHBondContact CG-O 3.49Å; F144-L227 VanDerWaalsContact CE1-O 3.24Å; F144-L227 WeakPolarHBondContact CE1-O 3.38Å; L223-L227 HydrophobicContact CD1-CD1 4.49Å; L223-L227 HydrophobicContact CD1-CG 4.25Å; L223-L227 HydrophobicContact CD2-CD1 4.13Å; L223-L227 HydrophobicContact CG-CD1 3.86Å; L223-L227 HydrophobicContact CG-CG 4.04Å; L223-L227 WeakPolarHBondContact O-CG 3Å; L223-L227 PolarHBondContact O-N 3.19Å; L223-L227 VanDerWaalsContact O-N 3.08Å; H224-L227 PolarHBondContact O-N 3.45Å |
| 228 | Q | 90.4 | Very high | 76.9 | Confident | 82 Ų | 82 | 90.5 Ų | 90.5 | 38% | 0.383 | 42% | 0.423 | S | S | . | . | S | Bend | trans | -88.3 | 131.7 | 167.4 | -64.7 | -58.4 | -35.3 | 0 | 0 | 110.4 | K147 H224 Y225 Y226 V230 | K147-Q228 PolarHBondContact NZ-O 2.88Å; H224-Q228 PolarHBondContact NE2-NE2 2.94Å; H224-Q228 WeakPolarHBondContact O-CG 3.09Å; H224-Q228 PolarHBondContact O-N 3.3Å; Y225-Q228 PolarHBondContact O-N 3.3Å; Y226-Q228 VanDerWaalsContact C-N 3.32Å; Q228-V230 PolarHBondContact O-N 3.11Å |
| 229 | P | 87.5 | Confident | 74.9 | Confident | 29 Ų | 29 | 92.8 Ų | 92.8 | 19% | 0.188 | 43% | 0.434 | C | S | . | . | trans | -61.2 | 135.7 | 170.9 | 29 | -35.7 | 0 | 0 | 0 | 108.9 | N139 F142 R231 | N139-P229 WeakPolarHBondContact OD1-CG 3.36Å; F142-P229 HydrophobicContact CB-CB 4.5Å; F142-P229 HydrophobicContact CD1-CB 4.39Å; F142-P229 HydrophobicContact CD2-CB 3.96Å; F142-P229 HydrophobicContact CE2-CB 4.29Å; F142-P229 HydrophobicContact CG-CB 4.01Å; P229-R231 PolarHBondContact O-N 3.17Å | ||
| 230 | V | 74.4 | Confident | 73 | Confident | 84 Ų | 84 | 98.8 Ų | 98.8 | 51% | 0.509 | 46% | 0.46 | S | S | . | . | trans | -67.3 | 105 | 172 | -178.6 | 0 | 0 | 0 | 0 | 106.5 | F142 K147 Q228 S232 | F142-V230 HydrophobicContact CE2-CB 4.31Å; F142-V230 HydrophobicContact CE2-CG2 4.44Å; F142-V230 HydrophobicContact CZ-CG2 4.24Å; K147-V230 HydrophobicContact CD-CG2 4.01Å; Q228-V230 PolarHBondContact O-N 3.11Å; V230-S232 PolarHBondContact O-N 3.07Å; V230-S232 VanDerWaalsContact O-N 3.07Å | ||
| 231 | R | 59.4 | Low | 71.3 | Confident | 205 Ų | 205 | 99.2 Ų | 99.2 | 77% | 0.774 | 46% | 0.46 | S | S | * | . | trans | -64.1 | 110.4 | 160.9 | -62.2 | -172.6 | -175.4 | 100.8 | -0.2 | 104.6 | P229 R233 | P229-R231 PolarHBondContact O-N 3.17Å; R231-R233 PolarHBondContact O-N 3.02Å | ||
| 232 | S | 49.3 | Very low | 70 | Confident | 57 Ų | 57 | 96.5 Ų | 96.5 | 40% | 0.399 | 45% | 0.453 | S | S | . | . | trans | -46.1 | 121.3 | 174.9 | -46 | 0 | 0 | 0 | 0 | 107.1 | V230 L234 I235 | V230-S232 PolarHBondContact O-N 3.07Å; V230-S232 VanDerWaalsContact O-N 3.07Å; S232-L234 PolarHBondContact O-N 3.4Å; S232-I235 PolarHBondContact O-N 2.86Å | ||
| 233 | R | 46.1 | Very low | 69 | Low | 221 Ų | 221 | 98.1 Ų | 98.1 | 83% | 0.834 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -52.4 | -27.8 | 171.6 | -76.3 | -169.3 | -173.4 | -158.7 | 3.1 | 110.1 | R231 I235 F236 V237 | R231-R233 PolarHBondContact O-N 3.02Å; R233-I235 PolarHBondContact O-N 3.02Å; R233-F236 PolarHBondContact O-N 3.47Å; R233-V237 WeakPolarHBondContact O-CB 3.45Å; R233-V237 WeakPolarHBondContact O-CG2 3.27Å; R233-V237 PolarHBondContact O-N 2.74Å |
| 234 | L | 45.8 | Very low | 68 | Low | 128 Ų | 128 | 102.2 Ų | 102.2 | 67% | 0.67 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -58 | -37.2 | 171.7 | -90.3 | 90 | 0 | 0 | 0 | 114.7 | S232 E238 | S232-L234 PolarHBondContact O-N 3.4Å; L234-E238 VanDerWaalsContact O-CB 3.27Å; L234-E238 WeakPolarHBondContact O-CB 2.92Å; L234-E238 WeakPolarHBondContact O-CG 3.1Å; L234-E238 PolarHBondContact O-N 2.8Å |
| 235 | I | 50.3 | Low | 67.2 | Low | 93 Ų | 93 | 100.9 Ų | 100.9 | 48% | 0.477 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -74.1 | -36.3 | -179.8 | -57.6 | 155.8 | 0 | 0 | 0 | 109.6 | S232 R233 Q239 | S232-I235 PolarHBondContact O-N 2.86Å; R233-I235 PolarHBondContact O-N 3.02Å; I235-Q239 HydrophobicContact CG2-CG 3.92Å; I235-Q239 WeakPolarHBondContact O-CB 3.45Å; I235-Q239 WeakPolarHBondContact O-CG 3.17Å; I235-Q239 PolarHBondContact O-N 3.29Å |
| 236 | F | 48.1 | Very low | 66.4 | Low | 137 Ų | 137 | 101.4 Ų | 101.4 | 60% | 0.601 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -69.1 | -44.4 | 175 | -158 | -96.8 | 0 | 0 | 0 | 110.4 | R233 Q239 F240 | R233-F236 PolarHBondContact O-N 3.47Å; F236-Q239 PolarHBondContact O-N 2.86Å; F236-F240 AromaticContact CD1-CD2 3.93Å; F236-F240 HydrophobicContact CD1-CD2 3.93Å; F236-F240 HydrophobicContact CD1-CE2 4.48Å; F236-F240 AromaticContact CE1-CD2 3.34Å; F236-F240 HydrophobicContact CE1-CD2 3.34Å; F236-F240 AromaticContact CE1-CE2 3.48Å; F236-F240 HydrophobicContact CE1-CE2 3.48Å; F236-F240 VanDerWaalsContact CE1-CE2 3.48Å; F236-F240 HydrophobicContact CE1-CG 4.15Å; F236-F240 HydrophobicContact CE1-CZ 4.37Å; F236-F240 HydrophobicContact CE2-CD2 4.32Å; F236-F240 HydrophobicContact CE2-CE2 4.37Å; F236-F240 AromaticContact CZ-CD2 3.58Å; F236-F240 HydrophobicContact CZ-CD2 3.58Å; F236-F240 AromaticContact CZ-CE2 3.42Å; F236-F240 HydrophobicContact CZ-CE2 3.42Å; F236-F240 VanDerWaalsContact CZ-CE2 3.42Å; F236-F240 HydrophobicContact CZ-CZ 4.47Å; F236-F240 WeakPolarHBondContact O-CB 3.47Å; F236-F240 PolarHBondContact O-N 2.88Å |
| 237 | V | 54.1 | Low | 65.5 | Low | 83 Ų | 83 | 109.8 Ų | 109.8 | 50% | 0.503 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.3 | -44.4 | 178.7 | -179.2 | 0 | 0 | 0 | 0 | 111 | R233 Q241 | R233-V237 WeakPolarHBondContact O-CB 3.45Å; R233-V237 WeakPolarHBondContact O-CG2 3.27Å; R233-V237 PolarHBondContact O-N 2.74Å; V237-Q241 WeakPolarHBondContact O-CA 3.13Å; V237-Q241 WeakPolarHBondContact O-CB 3.23Å; V237-Q241 PolarHBondContact O-N 3.36Å |
| 238 | E | 56.3 | Low | 64.9 | Low | 126 Ų | 126 | 114.4 Ų | 114.4 | 59% | 0.589 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -68.3 | -40.9 | 175.6 | -77.7 | -162.3 | 152.2 | 0 | 0 | 112.7 | L234 Q241 V242 | L234-E238 VanDerWaalsContact O-CB 3.27Å; L234-E238 WeakPolarHBondContact O-CB 2.92Å; L234-E238 WeakPolarHBondContact O-CG 3.1Å; L234-E238 PolarHBondContact O-N 2.8Å; E238-Q241 PolarHBondContact O-N 2.76Å; E238-V242 VanDerWaalsContact O-CB 3.23Å; E238-V242 WeakPolarHBondContact O-CB 3.44Å; E238-V242 WeakPolarHBondContact O-CG2 3.2Å; E238-V242 PolarHBondContact O-N 2.76Å |
| 239 | Q | 54.9 | Low | 64 | Low | 120 Ų | 120 | 113.4 Ų | 113.4 | 56% | 0.561 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -68.8 | -41.2 | 176.8 | -68.1 | -80 | -25.1 | 0 | 0 | 111.1 | I235 F236 Q241 V243 | I235-Q239 HydrophobicContact CG2-CG 3.92Å; I235-Q239 WeakPolarHBondContact O-CB 3.45Å; I235-Q239 WeakPolarHBondContact O-CG 3.17Å; I235-Q239 PolarHBondContact O-N 3.29Å; F236-Q239 PolarHBondContact O-N 2.86Å; Q239-Q241 VanDerWaalsContact C-N 3.34Å; Q239-V243 WeakPolarHBondContact O-CB 3.46Å; Q239-V243 WeakPolarHBondContact O-CG2 2.97Å; Q239-V243 PolarHBondContact O-N 3.49Å |
| 240 | F | 58 | Low | 63.2 | Low | 126 Ų | 126 | 118.2 Ų | 118.2 | 55% | 0.553 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -64.8 | -39.8 | 173 | -121 | -104.1 | 0 | 0 | 0 | 111.1 | F236 L244 | F236-F240 AromaticContact CD1-CD2 3.93Å; F236-F240 HydrophobicContact CD1-CD2 3.93Å; F236-F240 HydrophobicContact CD1-CE2 4.48Å; F236-F240 AromaticContact CE1-CD2 3.34Å; F236-F240 HydrophobicContact CE1-CD2 3.34Å; F236-F240 AromaticContact CE1-CE2 3.48Å; F236-F240 HydrophobicContact CE1-CE2 3.48Å; F236-F240 VanDerWaalsContact CE1-CE2 3.48Å; F236-F240 HydrophobicContact CE1-CG 4.15Å; F236-F240 HydrophobicContact CE1-CZ 4.37Å; F236-F240 HydrophobicContact CE2-CD2 4.32Å; F236-F240 HydrophobicContact CE2-CE2 4.37Å; F236-F240 AromaticContact CZ-CD2 3.58Å; F236-F240 HydrophobicContact CZ-CD2 3.58Å; F236-F240 AromaticContact CZ-CE2 3.42Å; F236-F240 HydrophobicContact CZ-CE2 3.42Å; F236-F240 VanDerWaalsContact CZ-CE2 3.42Å; F236-F240 HydrophobicContact CZ-CZ 4.47Å; F236-F240 WeakPolarHBondContact O-CB 3.47Å; F236-F240 PolarHBondContact O-N 2.88Å; F240-L244 WeakPolarHBondContact O-CA 3.46Å; F240-L244 WeakPolarHBondContact O-CB 3.2Å; F240-L244 PolarHBondContact O-N 2.85Å |
| 241 | Q | 63.4 | Low | 62.5 | Low | 82 Ų | 82 | 121.8 Ų | 121.8 | 38% | 0.383 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -71.6 | -39.8 | -179.7 | -177.5 | 169.3 | 9.1 | 0 | 0 | 111.2 | V237 E238 Q239 L244 Y245 | V237-Q241 WeakPolarHBondContact O-CA 3.13Å; V237-Q241 WeakPolarHBondContact O-CB 3.23Å; V237-Q241 PolarHBondContact O-N 3.36Å; E238-Q241 PolarHBondContact O-N 2.76Å; Q239-Q241 VanDerWaalsContact C-N 3.34Å; Q241-L244 PolarHBondContact O-N 3.36Å; Q241-Y245 HydrophobicContact CG-CD2 3.6Å; Q241-Y245 HydrophobicContact CG-CE2 3.18Å; Q241-Y245 PolarHBondContact NE2-OH 3.45Å; Q241-Y245 VanDerWaalsContact NE2-OH 3.12Å; Q241-Y245 VanDerWaalsContact O-CB 3.3Å; Q241-Y245 WeakPolarHBondContact O-CB 3.35Å; Q241-Y245 WeakPolarHBondContact O-CD2 3.25Å; Q241-Y245 VanDerWaalsContact O-CG 3.28Å; Q241-Y245 PolarHBondContact O-N 2.89Å |
| 242 | V | 68.1 | Low | 62.7 | Low | 80 Ų | 80 | 117.7 Ų | 117.7 | 49% | 0.485 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -64.4 | -47.1 | 171.3 | 169.6 | 0 | 0 | 0 | 0 | 110.7 | E238 L244 Y245 F246 | E238-V242 VanDerWaalsContact O-CB 3.23Å; E238-V242 WeakPolarHBondContact O-CB 3.44Å; E238-V242 WeakPolarHBondContact O-CG2 3.2Å; E238-V242 PolarHBondContact O-N 2.76Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 2.74Å; V242-Y245 PolarHBondContact O-N 2.92Å; V242-F246 WeakPolarHBondContact O-CB 2.99Å; V242-F246 PolarHBondContact O-N 3.25Å |
| 243 | V | 74.8 | Confident | 63.4 | Low | 82 Ų | 82 | 120.8 Ų | 120.8 | 50% | 0.497 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -62.9 | -39.3 | 175.6 | 169.6 | 0 | 0 | 0 | 0 | 111.2 | Q239 F246 R247 | Q239-V243 WeakPolarHBondContact O-CB 3.46Å; Q239-V243 WeakPolarHBondContact O-CG2 2.97Å; Q239-V243 PolarHBondContact O-N 3.49Å; V243-F246 PolarHBondContact O-N 3.03Å; V243-R247 VanDerWaalsContact O-CB 3.24Å; V243-R247 WeakPolarHBondContact O-CB 3.24Å; V243-R247 PolarHBondContact O-N 3.46Å |
| 244 | L | 75.8 | Confident | 64.4 | Low | 89 Ų | 89 | 115.3 Ų | 115.3 | 47% | 0.466 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -69.6 | -41.7 | 177.7 | -172.4 | 70.8 | 0 | 0 | 0 | 111.2 | F240 Q241 V242 R247 L248 | F240-L244 WeakPolarHBondContact O-CA 3.46Å; F240-L244 WeakPolarHBondContact O-CB 3.2Å; F240-L244 PolarHBondContact O-N 2.85Å; Q241-L244 PolarHBondContact O-N 3.36Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 2.74Å; L244-R247 PolarHBondContact O-N 2.82Å; L244-L248 HydrophobicContact CD1-CD1 4Å; L244-L248 HydrophobicContact CD1-CG 4.43Å; L244-L248 HydrophobicContact CD2-CD1 4.3Å; L244-L248 HydrophobicContact CG-CD1 3.69Å; L244-L248 HydrophobicContact CG-CG 4.43Å; L244-L248 VanDerWaalsContact O-CB 3.25Å; L244-L248 WeakPolarHBondContact O-CB 3.3Å; L244-L248 VanDerWaalsContact O-CG 3.31Å; L244-L248 WeakPolarHBondContact O-CG 3.31Å; L244-L248 PolarHBondContact O-N 3.12Å |
| 245 | Y | 75.9 | Confident | 65.5 | Low | 83 Ų | 83 | 114.5 Ų | 114.5 | 33% | 0.325 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.3 | -39 | 174.1 | -78 | -52.8 | 0 | 0 | 0 | 112 | Q241 V242 R247 L248 G249 M250 I251 | Q241-Y245 HydrophobicContact CG-CD2 3.6Å; Q241-Y245 HydrophobicContact CG-CE2 3.18Å; Q241-Y245 PolarHBondContact NE2-OH 3.45Å; Q241-Y245 VanDerWaalsContact NE2-OH 3.12Å; Q241-Y245 VanDerWaalsContact O-CB 3.3Å; Q241-Y245 WeakPolarHBondContact O-CB 3.35Å; Q241-Y245 WeakPolarHBondContact O-CD2 3.25Å; Q241-Y245 VanDerWaalsContact O-CG 3.28Å; Q241-Y245 PolarHBondContact O-N 2.89Å; V242-Y245 PolarHBondContact O-N 2.92Å; Y245-R247 VanDerWaalsContact C-N 3.35Å; Y245-L248 PolarHBondContact O-N 3.41Å; Y245-G249 PolarHBondContact O-N 2.78Å; Y245-M250 HydrophobicContact CD1-CB 3.73Å; Y245-M250 HydrophobicContact CD1-CE 4.43Å; Y245-M250 HydrophobicContact CD1-CG 4.32Å; Y245-M250 HydrophobicContact CD1-SD 3.86Å; Y245-M250 HydrophobicContact CE1-CB 4.45Å; Y245-M250 HydrophobicContact CE1-CE 4.07Å; Y245-M250 HydrophobicContact CE1-SD 3.9Å; Y245-M250 PolarHBondContact O-N 3.05Å; Y245-I251 HydrophobicContact CD2-CD1 4.33Å; Y245-I251 HydrophobicContact CG-CD1 4.17Å |
| 246 | F | 75.9 | Confident | 66.4 | Low | 164 Ų | 164 | 115.9 Ų | 115.9 | 72% | 0.719 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -66 | -37.9 | 174 | -147.2 | -92.9 | 0 | 0 | 0 | 111.6 | V242 V243 | V242-F246 WeakPolarHBondContact O-CB 2.99Å; V242-F246 PolarHBondContact O-N 3.25Å; V243-F246 PolarHBondContact O-N 3.03Å |
| 247 | R | 73.5 | Confident | 67.6 | Low | 218 Ų | 218 | 114.5 Ų | 114.5 | 82% | 0.823 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -77.7 | -24.9 | 179 | -155.7 | 176.5 | -167 | 161.3 | 3.3 | 113.4 | V243 L244 Y245 | V243-R247 VanDerWaalsContact O-CB 3.24Å; V243-R247 WeakPolarHBondContact O-CB 3.24Å; V243-R247 PolarHBondContact O-N 3.46Å; L244-R247 PolarHBondContact O-N 2.82Å; Y245-R247 VanDerWaalsContact C-N 3.35Å |
| 248 | L | 81.2 | Confident | 68.6 | Low | 113 Ų | 113 | 116.7 Ų | 116.7 | 59% | 0.592 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.5 | -0.4 | 175.7 | -71.6 | 168.9 | 0 | 0 | 0 | 113.3 | L244 Y245 M250 | L244-L248 HydrophobicContact CD1-CD1 4Å; L244-L248 HydrophobicContact CD1-CG 4.43Å; L244-L248 HydrophobicContact CD2-CD1 4.3Å; L244-L248 HydrophobicContact CG-CD1 3.69Å; L244-L248 HydrophobicContact CG-CG 4.43Å; L244-L248 VanDerWaalsContact O-CB 3.25Å; L244-L248 WeakPolarHBondContact O-CB 3.3Å; L244-L248 VanDerWaalsContact O-CG 3.31Å; L244-L248 WeakPolarHBondContact O-CG 3.31Å; L244-L248 PolarHBondContact O-N 3.12Å; Y245-L248 PolarHBondContact O-N 3.41Å; L248-M250 VanDerWaalsContact C-N 3.33Å; L248-M250 HydrophobicContact CB-CG 4.3Å; L248-M250 PolarHBondContact O-N 3.4Å |
| 249 | G | 71.4 | Confident | 69.5 | Low | 62 Ų | 62 | 116 Ų | 116 | 64% | 0.639 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 65.3 | 31 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y245 | Y245-G249 PolarHBondContact O-N 2.78Š|
| 250 | M | 70.8 | Confident | 70.8 | Confident | 130 Ų | 130 | 115.7 Ų | 115.7 | 64% | 0.64 | 58% | 0.578 | S | S | * | * | trans | -94.1 | 1.2 | -178.2 | -70.9 | -171.5 | 68.9 | 0 | 0 | 113.8 | Y245 L248 | Y245-M250 HydrophobicContact CD1-CB 3.73Å; Y245-M250 HydrophobicContact CD1-CE 4.43Å; Y245-M250 HydrophobicContact CD1-CG 4.32Å; Y245-M250 HydrophobicContact CD1-SD 3.86Å; Y245-M250 HydrophobicContact CE1-CB 4.45Å; Y245-M250 HydrophobicContact CE1-CE 4.07Å; Y245-M250 HydrophobicContact CE1-SD 3.9Å; Y245-M250 PolarHBondContact O-N 3.05Å; L248-M250 VanDerWaalsContact C-N 3.33Å; L248-M250 HydrophobicContact CB-CG 4.3Å; L248-M250 PolarHBondContact O-N 3.4Å | ||
| 251 | I | 60.5 | Low | 71.9 | Confident | 159 Ų | 159 | 114.7 Ų | 114.7 | 82% | 0.815 | 58% | 0.58 | S | S | * | * | trans | -142.2 | 0 | 174.8 | -52.7 | 170.8 | 0 | 0 | 0 | 106.3 | Y245 | Y245-I251 HydrophobicContact CD2-CD1 4.33Å; Y245-I251 HydrophobicContact CG-CD1 4.17Å |
Retrieved 251 of 251 residues in 126 ms
(Link to these results)