| 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 | 49.2 | Very low | 50.4 | Low | 233 Ų | 233 | 149.5 Ų | 149.5 | 100% | 1.148 | 81% | 0.811 | S | S | * | * | 0 | 96.1 | 0 | -65.3 | 158.7 | 124.2 | 0 | 0 | 106.9 | |||||
| 2 | S | 54.5 | Low | 51.2 | Low | 96 Ų | 96 | 146.8 Ų | 146.8 | 67% | 0.671 | 80% | 0.804 | S | S | * | * | 64.9 | 112.6 | 81.3 | 64.5 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 3 | N | 56.2 | Low | 50.5 | Low | 156 Ų | 156 | 141.3 Ų | 141.3 | 83% | 0.834 | 80% | 0.802 | S | S | * | * | cis | -142 | 160.9 | 15.5 | -77.4 | -45.6 | 0 | 0 | 0 | 114.4 | ||||
| 4 | V | 52.5 | Low | 51.2 | Low | 130 Ų | 130 | 142.9 Ų | 142.9 | 79% | 0.788 | 81% | 0.805 | S | S | * | * | trans | -100.3 | 141.5 | 175.5 | -143.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 5 | R | 55.5 | Low | 51.3 | Low | 238 Ų | 238 | 143.3 Ų | 143.3 | 90% | 0.898 | 80% | 0.804 | S | S | * | * | trans | 156.6 | 121.8 | 161.4 | -88.1 | 146.9 | -173.7 | 153.7 | -0.3 | 106.3 | ||||
| 6 | S | 49 | Very low | 51.7 | Low | 107 Ų | 107 | 144.2 Ų | 144.2 | 75% | 0.748 | 81% | 0.806 | S | S | * | * | cis | 70.3 | 90 | 25.5 | -154.5 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 7 | C | 48.8 | Very low | 51.4 | Low | 120 Ų | 120 | 145.1 Ų | 145.1 | 81% | 0.811 | 81% | 0.809 | S | S | * | * | trans | -164.4 | 122.3 | 153.2 | -157.3 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 8 | C | 48.5 | Very low | 51.7 | Low | 104 Ų | 104 | 144.6 Ų | 144.6 | 70% | 0.703 | 81% | 0.81 | S | S | * | * | cis | 81.1 | 81.5 | 43.4 | -59.8 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 9 | Y | 40.5 | Very low | 51.5 | Low | 222 Ų | 222 | 142.4 Ų | 142.4 | 87% | 0.871 | 81% | 0.805 | S | S | * | * | 47.2 | 132.9 | 120.7 | -119.8 | -44.8 | 0 | 0 | 0 | 121.5 | |||||
| 10 | V | 46.6 | Very low | 51.1 | Low | 110 Ų | 110 | 144.7 Ų | 144.7 | 67% | 0.667 | 81% | 0.806 | S | S | * | * | trans | 76.2 | 146.4 | 157.8 | -160.6 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 11 | T | 53.5 | Low | 50.5 | Low | 128 Ų | 128 | 145.6 Ų | 145.6 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | trans | 66.9 | 150.9 | 165.8 | 20.9 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 12 | T | 60.2 | Low | 50.5 | Low | 118 Ų | 118 | 140 Ų | 140 | 72% | 0.724 | 79% | 0.788 | S | S | * | * | cis | -115 | 173.6 | -7.8 | 56.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 13 | G | 41.8 | Very low | 50.2 | Low | 75 Ų | 75 | 141.1 Ų | 141.1 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | cis | 94.9 | 63 | 17.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 14 | L | 59.6 | Low | 49.3 | Very low | 163 Ų | 163 | 135.5 Ų | 135.5 | 85% | 0.853 | 77% | 0.766 | S | S | * | * | trans | -145.5 | 132.9 | 174.4 | -117.5 | 168.5 | 0 | 0 | 0 | 110.9 | ||||
| 15 | L | 53 | Low | 49 | Very low | 150 Ų | 150 | 136.2 Ų | 136.2 | 79% | 0.785 | 76% | 0.761 | S | S | * | * | trans | -82.4 | 151.9 | 173.8 | -61.4 | 113.9 | 0 | 0 | 0 | 110.3 | ||||
| 16 | N | 58.3 | Low | 48.1 | Very low | 157 Ų | 157 | 129.5 Ų | 129.5 | 84% | 0.84 | 75% | 0.75 | S | S | * | * | trans | -155.5 | 132 | 144.7 | -102.4 | -37.6 | 0 | 0 | 0 | 110.8 | ||||
| 17 | N | 45.5 | Very low | 47.8 | Very low | 159 Ų | 159 | 130.8 Ų | 130.8 | 85% | 0.85 | 75% | 0.748 | S | S | * | * | trans | -85.5 | 120.2 | 173.9 | -86.4 | -76.8 | 0 | 0 | 0 | 109.2 | ||||
| 18 | V | 56.6 | Low | 47.6 | Very low | 137 Ų | 137 | 131.2 Ų | 131.2 | 83% | 0.83 | 75% | 0.746 | S | S | * | * | trans | -128.2 | 128.4 | 166.4 | -179.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 19 | S | 49.1 | Very low | 47.5 | Very low | 103 Ų | 103 | 130.6 Ų | 130.6 | 72% | 0.72 | 73% | 0.731 | S | S | * | * | trans | -25.2 | 120.7 | -174.2 | -162.9 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 20 | K | 43 | Very low | 47.6 | Very low | 187 Ų | 187 | 124.3 Ų | 124.3 | 81% | 0.813 | 71% | 0.713 | S | S | * | * | -2.4 | 120.3 | 129.4 | -55.4 | 172.2 | -175.5 | 176.8 | 0 | 114.8 | |||||
| 21 | N | 39.1 | Very low | 47.6 | Very low | 165 Ų | 165 | 123.8 Ų | 123.8 | 88% | 0.882 | 71% | 0.71 | S | S | * | * | trans | -160.4 | 98.1 | 139.9 | -106.5 | -13.3 | 0 | 0 | 0 | 108.6 | ||||
| 22 | T | 49.4 | Very low | 47.3 | Very low | 115 Ų | 115 | 120.9 Ų | 120.9 | 71% | 0.706 | 70% | 0.695 | S | S | * | * | trans | -106.7 | 118.7 | 177.8 | 45.5 | 0 | 0 | 0 | 0 | 109.4 | S24 | T22-S24 PolarHBondContact O-N 3.21Š| ||
| 23 | P | 48.5 | Very low | 46.5 | Very low | 119 Ų | 119 | 121.1 Ų | 121.1 | 77% | 0.773 | 70% | 0.696 | S | S | * | * | trans | -70.2 | 113.3 | 154.5 | 29.9 | -29 | 0 | 0 | 0 | 106.5 | Q25 | P23-Q25 PolarHBondContact O-N 3.35Š| ||
| 24 | S | 35.6 | Very low | 46.6 | Very low | 38 Ų | 38 | 125.8 Ų | 125.8 | 27% | 0.266 | 70% | 0.703 | S | S | . | * | trans | -74.4 | 124.1 | 176.3 | -35.4 | 0 | 0 | 0 | 0 | 107.7 | T22 E113 A114 | T22-S24 PolarHBondContact O-N 3.21Å; S24-E113 WeakPolarHBondContact CA-OE1 3.3Å; S24-E113 WeakPolarHBondContact CB-OE1 3.22Å; S24-E113 PolarHBondContact N-OE1 3.48Å; S24-E113 VanDerWaalsContact O-CG 3.23Å; S24-E113 WeakPolarHBondContact O-CG 3.34Å; S24-E113 PolarHBondContact OG-OE1 3.5Å; S24-A114 WeakPolarHBondContact OG-CB 3.44Å | ||
| 25 | Q | 47.7 | Very low | 45.5 | Very low | 146 Ų | 146 | 121.5 Ų | 121.5 | 68% | 0.682 | 70% | 0.698 | S | S | * | * | trans | -129.6 | 117.4 | 152.2 | -74.9 | -163.3 | 11.9 | 0 | 0 | 109.1 | P23 I27 P111 | P23-Q25 PolarHBondContact O-N 3.35Å; Q25-I27 PolarHBondContact O-N 3.45Å; Q25-P111 VanDerWaalsContact NE2-CG 3.26Å | ||
| 26 | S | 36.5 | Very low | 45.1 | Very low | 96 Ų | 96 | 118.8 Ų | 118.8 | 67% | 0.671 | 71% | 0.706 | S | S | * | * | trans | -46.6 | 124 | 168.8 | 46.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 27 | I | 42.7 | Very low | 44.9 | Very low | 135 Ų | 135 | 116.2 Ų | 116.2 | 69% | 0.692 | 70% | 0.701 | S | S | * | * | -170.5 | 128.9 | 110.7 | -88.8 | 147.9 | 0 | 0 | 0 | 107.3 | Q25 K29 | Q25-I27 PolarHBondContact O-N 3.45Å; I27-K29 VanDerWaalsContact C-N 3.34Å; I27-K29 HydrophobicContact CG2-CG 3.85Å; I27-K29 PolarHBondContact O-N 3.34Å | |||
| 28 | V | 44.1 | Very low | 45.4 | Very low | 128 Ų | 128 | 119.7 Ų | 119.7 | 78% | 0.776 | 70% | 0.702 | S | S | * | * | trans | -70.6 | 92.4 | 163.1 | -79.4 | 0 | 0 | 0 | 0 | 108.4 | D30 | V28-D30 VanDerWaalsContact C-N 3.25Å; V28-D30 PolarHBondContact O-N 3.45Å | ||
| 29 | K | 46.8 | Very low | 45.9 | Very low | 91 Ų | 91 | 120.5 Ų | 120.5 | 40% | 0.396 | 69% | 0.69 | S | S | . | * | trans | -72.7 | 87.7 | 166.3 | -75.1 | -171.5 | 178.1 | 177.5 | 0 | 107.3 | I27 T31 D45 | I27-K29 VanDerWaalsContact C-N 3.34Å; I27-K29 HydrophobicContact CG2-CG 3.85Å; I27-K29 PolarHBondContact O-N 3.34Å; K29-T31 PolarHBondContact O-N 3.35Å; K29-D45 IonicContact NZ-OD1 3.8Å; K29-D45 PolarHBondContact NZ-OD1 3.36Å; K29-D45 IonicContact NZ-OD2 2.72Å; K29-D45 PolarHBondContact NZ-OD2 3.24Å | ||
| 30 | D | 40.9 | Very low | 47.5 | Very low | 91 Ų | 91 | 121.4 Ų | 121.4 | 49% | 0.487 | 69% | 0.691 | S | S | . | * | trans | -48.9 | 129.5 | -171.5 | -67.9 | -50.7 | 0 | 0 | 0 | 112.6 | V28 S32 R39 | V28-D30 VanDerWaalsContact C-N 3.25Å; V28-D30 PolarHBondContact O-N 3.45Å; D30-S32 WeakPolarHBondContact CB-OG 3.39Å; D30-S32 PolarHBondContact O-N 3.16Å; D30-R39 PolarHBondContact O-NH1 3.31Å | ||
| 31 | T | 47.9 | Very low | 49.6 | Very low | 99 Ų | 99 | 117.5 Ų | 117.5 | 61% | 0.607 | 67% | 0.672 | S | S | * | * | trans | -89.1 | 25.1 | 179.3 | 53.4 | 0 | 0 | 0 | 0 | 112.6 | K29 T33 V65 | K29-T31 PolarHBondContact O-N 3.35Å; T31-T33 PolarHBondContact O-OG1 3.34Å; T31-V65 HydrophobicContact CG2-CG1 3.57Å | ||
| 32 | S | 45.9 | Very low | 52.2 | Low | 67 Ų | 67 | 112.2 Ų | 112.2 | 47% | 0.469 | 65% | 0.648 | S | S | . | * | trans | -68.3 | 123.2 | 154.5 | 40.9 | 0 | 0 | 0 | 0 | 108.4 | D30 | D30-S32 WeakPolarHBondContact CB-OG 3.39Å; D30-S32 PolarHBondContact O-N 3.16Å | ||
| 33 | T | 44.1 | Very low | 54.2 | Low | 122 Ų | 122 | 112.8 Ų | 112.8 | 75% | 0.748 | 64% | 0.641 | S | S | * | * | cis | 55.8 | 106.4 | 31.6 | -44.4 | 0 | 0 | 0 | 0 | 110.5 | T31 | T31-T33 PolarHBondContact O-OG1 3.34Š| ||
| 34 | L | 44.4 | Very low | 56.4 | Low | 173 Ų | 173 | 112.6 Ų | 112.6 | 91% | 0.906 | 63% | 0.63 | S | S | * | * | trans | 75.7 | 145.2 | -160.8 | -44.5 | 171.1 | 0 | 0 | 0 | 112.9 | ||||
| 35 | G | 37.2 | Very low | 59.2 | Low | 74 Ų | 74 | 112.2 Ų | 112.2 | 76% | 0.763 | 63% | 0.625 | S | S | * | * | trans | 110.5 | 21.8 | 160.2 | 0 | 0 | 0 | 0 | 0 | 121.2 | S37 | G35-S37 VanDerWaalsContact C-N 3.28Å; G35-S37 PolarHBondContact O-N 3.29Å | ||
| 36 | G | 43.8 | Very low | 61.5 | Low | 92 Ų | 92 | 106.3 Ų | 106.3 | 95% | 0.948 | 60% | 0.598 | S | S | * | * | trans | 62.2 | -24.8 | 149.3 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 37 | S | 54.1 | Low | 64.2 | Low | 104 Ų | 104 | 105.1 Ų | 105.1 | 73% | 0.727 | 58% | 0.581 | S | S | * | * | trans | -80.9 | 123.1 | -171.9 | -171.1 | 0 | 0 | 0 | 0 | 112.2 | G35 R39 | G35-S37 VanDerWaalsContact C-N 3.28Å; G35-S37 PolarHBondContact O-N 3.29Å; S37-R39 VanDerWaalsContact C-N 3.32Å; S37-R39 PolarHBondContact O-N 3.11Å | ||
| 38 | R | 56.7 | Low | 66.7 | Low | 232 Ų | 232 | 100.4 Ų | 100.4 | 88% | 0.875 | 56% | 0.563 | S | S | * | * | trans | -73.8 | 80 | -178.8 | -173.1 | -167.1 | -68.4 | 172.6 | -1 | 110.5 | T40 | R38-T40 PolarHBondContact O-N 2.88Š| ||
| 39 | R | 66.3 | Low | 69.2 | Low | 154 Ų | 154 | 94.3 Ų | 94.3 | 58% | 0.581 | 53% | 0.526 | S | S | * | . | trans | -54.7 | 104.5 | 171.5 | -68.9 | 178.7 | 178.5 | 162 | 0.8 | 110 | D30 S37 | D30-R39 PolarHBondContact O-NH1 3.31Å; S37-R39 VanDerWaalsContact C-N 3.32Å; S37-R39 PolarHBondContact O-N 3.11Å | ||
| 40 | T | 83.5 | Confident | 71.5 | Confident | 122 Ų | 122 | 90.2 Ų | 90.2 | 75% | 0.748 | 51% | 0.508 | S | S | * | . | P | Polyproline II helix | trans | -67.8 | 135 | 169.2 | -57.9 | 0 | 0 | 0 | 0 | 108.9 | R38 | R38-T40 PolarHBondContact O-N 2.88Š|
| 41 | Y | 87.1 | Confident | 74 | Confident | 105 Ų | 105 | 91.1 Ų | 91.1 | 41% | 0.412 | 51% | 0.512 | S | S | . | . | P | Polyproline II helix | trans | -76.3 | 137 | 175.8 | 55.1 | -94 | 0 | 0 | 0 | 110.4 | P70 T73 | Y41-P70 HydrophobicContact CD1-CG 4.2Å; Y41-P70 HydrophobicContact CE1-CG 4.4Å; Y41-T73 HydrophobicContact CE2-CG2 4.35Å |
| 42 | S | 92 | Very high | 76.3 | Confident | 53 Ų | 53 | 87 Ų | 87 | 37% | 0.371 | 49% | 0.487 | S | S | . | . | P | Polyproline II helix | trans | -79.4 | 165.4 | 172.8 | -145.5 | 0 | 0 | 0 | 0 | 111.8 | E44 D45 L46 | S42-E44 VanDerWaalsContact C-N 3.31Å; S42-E44 VanDerWaalsContact CB-OE2 3.29Å; S42-E44 WeakPolarHBondContact CB-OE2 3.47Å; S42-E44 PolarHBondContact OG-OE2 3.18Å; S42-D45 PolarHBondContact N-OD2 3.32Å; S42-L46 WeakPolarHBondContact O-CB 3.46Å; S42-L46 PolarHBondContact O-N 3.46Å; S42-L46 VanDerWaalsContact O-N 3.15Å |
| 43 | K | 93.3 | Very high | 78.6 | Confident | 127 Ų | 127 | 85.1 Ų | 85.1 | 55% | 0.552 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -68.2 | -36.8 | 174.2 | 178.6 | -165.1 | 166.8 | -158.5 | 0 | 110.7 | L46 E47 | K43-L46 WeakPolarHBondContact O-CB 3.21Å; K43-L46 PolarHBondContact O-N 3.04Å; K43-E47 VanDerWaalsContact CE-OE2 3.31Å; K43-E47 WeakPolarHBondContact CE-OE2 2.95Å; K43-E47 WeakPolarHBondContact O-CG 3.41Å; K43-E47 PolarHBondContact O-N 2.6Å |
| 44 | E | 94.3 | Very high | 80.9 | Confident | 116 Ų | 116 | 84.6 Ų | 84.6 | 54% | 0.542 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -67.9 | -46.3 | -178.9 | -57.8 | 62.7 | -130.8 | 0 | 0 | 109.7 | S42 L46 E47 A48 | S42-E44 VanDerWaalsContact C-N 3.31Å; S42-E44 VanDerWaalsContact CB-OE2 3.29Å; S42-E44 WeakPolarHBondContact CB-OE2 3.47Å; S42-E44 PolarHBondContact OG-OE2 3.18Å; E44-L46 VanDerWaalsContact C-N 3.31Å; E44-L46 PolarHBondContact O-N 3.27Å; E44-E47 PolarHBondContact O-N 3.07Å; E44-A48 VanDerWaalsContact O-CB 3.3Å; E44-A48 WeakPolarHBondContact O-CB 3.45Å; E44-A48 PolarHBondContact O-N 3.3Å |
| 45 | D | 95 | Very high | 83.2 | Confident | 30 Ų | 30 | 80.2 Ų | 80.2 | 16% | 0.16 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -53.9 | -46.2 | 169.2 | -79.8 | -49 | 0 | 0 | 0 | 111.7 | K29 S42 E47 A49 V69 | K29-D45 IonicContact NZ-OD1 3.8Å; K29-D45 PolarHBondContact NZ-OD1 3.36Å; K29-D45 IonicContact NZ-OD2 2.72Å; K29-D45 PolarHBondContact NZ-OD2 3.24Å; S42-D45 PolarHBondContact N-OD2 3.32Å; D45-E47 PolarHBondContact O-N 2.9Å; D45-A49 WeakPolarHBondContact O-CB 3.47Å; D45-A49 PolarHBondContact O-N 3.2Å; D45-V69 HydrophobicContact CB-CG2 4.09Å |
| 46 | L | 94.3 | Very high | 85.8 | Confident | 22 Ų | 22 | 79.8 Ų | 79.8 | 12% | 0.115 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -65.4 | -36.2 | 179.9 | 173.1 | 63.6 | 0 | 0 | 0 | 112.7 | S42 K43 E44 V50 V69 T73 L74 K77 | S42-L46 WeakPolarHBondContact O-CB 3.46Å; S42-L46 PolarHBondContact O-N 3.46Å; S42-L46 VanDerWaalsContact O-N 3.15Å; K43-L46 WeakPolarHBondContact O-CB 3.21Å; K43-L46 PolarHBondContact O-N 3.04Å; E44-L46 VanDerWaalsContact C-N 3.31Å; E44-L46 PolarHBondContact O-N 3.27Å; L46-V50 WeakPolarHBondContact O-CB 3.43Å; L46-V50 VanDerWaalsContact O-CG2 3.26Å; L46-V50 WeakPolarHBondContact O-CG2 3.21Å; L46-V50 PolarHBondContact O-N 3.03Å; L46-V69 HydrophobicContact CB-CG2 4.5Å; L46-V69 HydrophobicContact CD1-CG1 3.78Å; L46-T73 HydrophobicContact CD1-CG2 3.91Å; L46-T73 HydrophobicContact CD2-CG2 4.46Å; L46-L74 HydrophobicContact CD1-CD2 4.25Å; L46-K77 HydrophobicContact CD1-CB 4.19Å; L46-K77 HydrophobicContact CD1-CG 4.23Å; L46-K77 HydrophobicContact CD2-CD 4.45Å; L46-K77 HydrophobicContact CG-CG 4.44Å |
| 47 | E | 94.9 | Very high | 88.2 | Confident | 71 Ų | 71 | 83.7 Ų | 83.7 | 33% | 0.332 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -83.4 | -40.3 | -177.2 | -71.2 | 179.1 | 168.7 | 0 | 0 | 111.4 | K43 E44 D45 V50 L51 K77 | K43-E47 VanDerWaalsContact CE-OE2 3.31Å; K43-E47 WeakPolarHBondContact CE-OE2 2.95Å; K43-E47 WeakPolarHBondContact O-CG 3.41Å; K43-E47 PolarHBondContact O-N 2.6Å; E44-E47 PolarHBondContact O-N 3.07Å; D45-E47 PolarHBondContact O-N 2.9Å; E47-V50 PolarHBondContact O-N 3.16Å; E47-L51 WeakPolarHBondContact O-CG 3.03Å; E47-L51 PolarHBondContact O-N 2.71Å; E47-K77 IonicContact OE1-NZ 2.76Å; E47-K77 PolarHBondContact OE1-NZ 2.99Å |
| 48 | A | 95.2 | Very high | 90 | Very high | 36 Ų | 36 | 79.8 Ų | 79.8 | 30% | 0.298 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -58.7 | -48.8 | 169 | 0 | 0 | 0 | 0 | 0 | 111.9 | E44 V50 L51 D52 Y67 | E44-A48 VanDerWaalsContact O-CB 3.3Å; E44-A48 WeakPolarHBondContact O-CB 3.45Å; E44-A48 PolarHBondContact O-N 3.3Å; A48-V50 PolarHBondContact O-N 3.41Å; A48-V50 VanDerWaalsContact O-N 3.15Å; A48-L51 PolarHBondContact O-N 3.17Å; A48-D52 PolarHBondContact O-N 3.48Å; A48-Y67 HydrophobicContact CB-CD1 4.22Å; A48-Y67 HydrophobicContact CB-CE1 3.61Å |
| 49 | A | 96 | Very high | 91.7 | Very high | 0 Ų | 0 | 71 Ų | 71 | 0% | 0 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -56.7 | -32.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | D45 I53 A63 Y67 V69 L74 | D45-A49 WeakPolarHBondContact O-CB 3.47Å; D45-A49 PolarHBondContact O-N 3.2Å; A49-I53 WeakPolarHBondContact O-CD1 3.31Å; A49-I53 WeakPolarHBondContact O-CG1 3.43Å; A49-I53 PolarHBondContact O-N 3.26Å; A49-A63 HydrophobicContact CB-CB 4.4Å; A49-Y67 HydrophobicContact CB-CD1 4.37Å; A49-Y67 HydrophobicContact CB-CD2 3.38Å; A49-Y67 HydrophobicContact CB-CE2 3.92Å; A49-Y67 HydrophobicContact CB-CG 3.65Å; A49-V69 HydrophobicContact CB-CG2 4.39Å; A49-L74 HydrophobicContact CB-CD2 3.49Å; A49-L74 VanDerWaalsContact CB-CD2 3.49Å |
| 50 | V | 94.9 | Very high | 93 | Very high | 4 Ų | 4 | 66 Ų | 66 | 2% | 0.024 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -84.8 | -29.4 | -178.3 | 166.8 | 0 | 0 | 0 | 0 | 112.2 | L46 E47 A48 R54 L74 K77 I78 L81 | L46-V50 WeakPolarHBondContact O-CB 3.43Å; L46-V50 VanDerWaalsContact O-CG2 3.26Å; L46-V50 WeakPolarHBondContact O-CG2 3.21Å; L46-V50 PolarHBondContact O-N 3.03Å; E47-V50 PolarHBondContact O-N 3.16Å; A48-V50 PolarHBondContact O-N 3.41Å; A48-V50 VanDerWaalsContact O-N 3.15Å; V50-R54 WeakPolarHBondContact O-CB 3.48Å; V50-R54 VanDerWaalsContact O-CD 3.29Å; V50-R54 WeakPolarHBondContact O-CD 3.14Å; V50-R54 WeakPolarHBondContact O-CG 3.25Å; V50-R54 PolarHBondContact O-N 3.25Å; V50-L74 HydrophobicContact CG2-CD2 4.01Å; V50-K77 HydrophobicContact CB-CG 4.47Å; V50-K77 HydrophobicContact CG1-CG 4.31Å; V50-K77 HydrophobicContact CG2-CB 4.14Å; V50-K77 HydrophobicContact CG2-CG 3.83Å; V50-I78 HydrophobicContact CG1-CG1 4.49Å; V50-I78 HydrophobicContact CG2-CG1 4.19Å; V50-L81 HydrophobicContact CG1-CD1 3.62Å |
| 51 | L | 94.3 | Very high | 93.6 | Very high | 111 Ų | 111 | 69.2 Ų | 69.2 | 58% | 0.581 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -64.2 | -43.5 | 166.8 | -69 | 169 | 0 | 0 | 0 | 111.3 | E47 A48 I53 R54 S55 | E47-L51 WeakPolarHBondContact O-CG 3.03Å; E47-L51 PolarHBondContact O-N 2.71Å; A48-L51 PolarHBondContact O-N 3.17Å; L51-I53 VanDerWaalsContact C-N 3.32Å; L51-I53 PolarHBondContact O-N 3.49Å; L51-R54 PolarHBondContact O-N 3.02Å; L51-S55 WeakPolarHBondContact O-CB 3.31Å; L51-S55 PolarHBondContact O-N 3.32Å; L51-S55 PolarHBondContact O-OG 3.18Å |
| 52 | D | 95 | Very high | 94 | Very high | 12 Ų | 12 | 72.8 Ų | 72.8 | 6% | 0.064 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -63.3 | -32.7 | 177.1 | -96.5 | 60.1 | 0 | 0 | 0 | 114.1 | A48 S55 R57 L58 Y67 | A48-D52 PolarHBondContact O-N 3.48Å; D52-S55 WeakPolarHBondContact CA-OG 3.06Å; D52-S55 PolarHBondContact O-OG 3.38Å; D52-R57 VanDerWaalsContact CG-NH2 3.29Å; D52-R57 PolarHBondContact O-N 3.48Å; D52-R57 IonicContact OD1-CZ 2.67Å; D52-R57 IonicContact OD1-NE 3.12Å; D52-R57 IonicContact OD1-NH2 3.34Å; D52-R57 PolarHBondContact OD1-NH2 3.5Å; D52-R57 IonicContact OD2-CZ 3.49Å; D52-R57 IonicContact OD2-NE 3.54Å; D52-R57 PolarHBondContact OD2-NE 3.49Å; D52-R57 IonicContact OD2-NH2 2.7Å; D52-R57 PolarHBondContact OD2-NH2 3.42Å; D52-R57 VanDerWaalsContact OD2-NH2 3.12Å; D52-L58 HydrophobicContact CB-CB 4.22Å; D52-L58 HydrophobicContact CB-CD1 3.92Å; D52-L58 HydrophobicContact CB-CG 4.2Å; D52-L58 PolarHBondContact O-N 3.39Å; D52-L58 VanDerWaalsContact OD2-CD1 3.27Å; D52-L58 WeakPolarHBondContact OD2-CD1 3.41Å; D52-Y67 HydrophobicContact CB-CE2 4.36Å; D52-Y67 PolarHBondContact OD1-OH 3.21Å |
| 53 | I | 94.7 | Very high | 94.1 | Very high | 28 Ų | 28 | 70.2 Ų | 70.2 | 14% | 0.144 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -80.3 | -36.7 | 177.2 | -60.9 | 156.6 | 0 | 0 | 0 | 111.1 | A49 L51 G56 L58 T60 A63 L74 I78 | A49-I53 WeakPolarHBondContact O-CD1 3.31Å; A49-I53 WeakPolarHBondContact O-CG1 3.43Å; A49-I53 PolarHBondContact O-N 3.26Å; L51-I53 VanDerWaalsContact C-N 3.32Å; L51-I53 PolarHBondContact O-N 3.49Å; I53-G56 PolarHBondContact O-N 3.43Å; I53-L58 VanDerWaalsContact CA-O 3.31Å; I53-L58 WeakPolarHBondContact CA-O 3.13Å; I53-L58 WeakPolarHBondContact CG1-O 3.41Å; I53-T60 HydrophobicContact CD1-CG2 4.38Å; I53-T60 HydrophobicContact CG2-CG2 4.19Å; I53-A63 HydrophobicContact CD1-CB 3.63Å; I53-A63 HydrophobicContact CG1-CB 3.8Å; I53-L74 HydrophobicContact CD1-CB 4.37Å; I53-L74 HydrophobicContact CD1-CD1 4.11Å; I53-L74 HydrophobicContact CD1-CD2 4.22Å; I53-L74 HydrophobicContact CD1-CG 4.47Å; I53-I78 HydrophobicContact CB-CD1 4.22Å; I53-I78 HydrophobicContact CD1-CD1 3.68Å; I53-I78 HydrophobicContact CG1-CD1 4.5Å; I53-I78 HydrophobicContact CG2-CD1 3.71Å; I53-I78 HydrophobicContact CG2-CG1 4.37Å |
| 54 | R | 92.3 | Very high | 94.2 | Very high | 111 Ų | 111 | 65.2 Ų | 65.2 | 42% | 0.419 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -70.4 | -33.3 | 177 | -76 | 165.2 | 129.2 | -152.6 | -8.1 | 113.5 | V50 L51 G56 L81 | V50-R54 WeakPolarHBondContact O-CB 3.48Å; V50-R54 VanDerWaalsContact O-CD 3.29Å; V50-R54 WeakPolarHBondContact O-CD 3.14Å; V50-R54 WeakPolarHBondContact O-CG 3.25Å; V50-R54 PolarHBondContact O-N 3.25Å; L51-R54 PolarHBondContact O-N 3.02Å; R54-G56 PolarHBondContact O-N 2.96Å; R54-L81 PolarHBondContact NH2-O 2.93Å |
| 55 | S | 92 | Very high | 94.2 | Very high | 81 Ų | 81 | 63.9 Ų | 63.9 | 57% | 0.566 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.1 | -2.1 | 172.2 | 53.9 | 0 | 0 | 0 | 0 | 113.4 | L51 D52 R57 | L51-S55 WeakPolarHBondContact O-CB 3.31Å; L51-S55 PolarHBondContact O-N 3.32Å; L51-S55 PolarHBondContact O-OG 3.18Å; D52-S55 WeakPolarHBondContact CA-OG 3.06Å; D52-S55 PolarHBondContact O-OG 3.38Å; S55-R57 PolarHBondContact O-N 3.14Å |
| 56 | G | 92.3 | Very high | 94.1 | Very high | 64 Ų | 64 | 66.3 Ų | 66.3 | 66% | 0.66 | 35% | 0.346 | S | S | * | . | S | Bend | trans | 73 | -3.9 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | I53 R54 L58 | I53-G56 PolarHBondContact O-N 3.43Å; R54-G56 PolarHBondContact O-N 2.96Å; G56-L58 VanDerWaalsContact C-N 3.3Å; G56-L58 PolarHBondContact O-N 2.85Å |
| 57 | R | 93.9 | Very high | 94.1 | Very high | 175 Ų | 175 | 66.9 Ų | 66.9 | 66% | 0.66 | 35% | 0.347 | S | S | * | . | S | Bend | trans | -61.2 | -35.8 | -176.9 | -169.2 | 164.9 | 72.8 | 176.7 | 1.8 | 112.6 | D52 S55 | D52-R57 VanDerWaalsContact CG-NH2 3.29Å; D52-R57 PolarHBondContact O-N 3.48Å; D52-R57 IonicContact OD1-CZ 2.67Å; D52-R57 IonicContact OD1-NE 3.12Å; D52-R57 IonicContact OD1-NH2 3.34Å; D52-R57 PolarHBondContact OD1-NH2 3.5Å; D52-R57 IonicContact OD2-CZ 3.49Å; D52-R57 IonicContact OD2-NE 3.54Å; D52-R57 PolarHBondContact OD2-NE 3.49Å; D52-R57 IonicContact OD2-NH2 2.7Å; D52-R57 PolarHBondContact OD2-NH2 3.42Å; D52-R57 VanDerWaalsContact OD2-NH2 3.12Å; S55-R57 PolarHBondContact O-N 3.14Å |
| 58 | L | 92.1 | Very high | 94.1 | Very high | 22 Ų | 22 | 65.4 Ų | 65.4 | 12% | 0.115 | 35% | 0.351 | C | S | . | . | S | Bend | trans | -134.1 | 132.3 | 177.4 | -63.1 | 176.1 | 0 | 0 | 0 | 112.6 | D52 I53 G56 R62 A63 I66 Y67 | D52-L58 HydrophobicContact CB-CB 4.22Å; D52-L58 HydrophobicContact CB-CD1 3.92Å; D52-L58 HydrophobicContact CB-CG 4.2Å; D52-L58 PolarHBondContact O-N 3.39Å; D52-L58 VanDerWaalsContact OD2-CD1 3.27Å; D52-L58 WeakPolarHBondContact OD2-CD1 3.41Å; I53-L58 VanDerWaalsContact CA-O 3.31Å; I53-L58 WeakPolarHBondContact CA-O 3.13Å; I53-L58 WeakPolarHBondContact CG1-O 3.41Å; G56-L58 VanDerWaalsContact C-N 3.3Å; G56-L58 PolarHBondContact O-N 2.85Å; L58-R62 HydrophobicContact CB-CB 4.48Å; L58-R62 HydrophobicContact CD2-CB 4Å; L58-A63 HydrophobicContact CB-CB 4.17Å; L58-A63 HydrophobicContact CD1-CB 4.31Å; L58-I66 HydrophobicContact CD1-CD1 3.69Å; L58-I66 HydrophobicContact CD2-CD1 3.83Å; L58-I66 HydrophobicContact CG-CD1 4.45Å; L58-Y67 HydrophobicContact CD1-CE2 3.85Å |
| 59 | G | 92.6 | Very high | 93.9 | Very high | 48 Ų | 48 | 63.7 Ų | 63.7 | 50% | 0.495 | 34% | 0.336 | S | S | . | . | trans | -72.3 | 155.1 | 165.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | R61 R62 A63 | G59-R61 PolarHBondContact O-N 2.91Å; G59-R62 PolarHBondContact O-N 3.04Å; G59-A63 PolarHBondContact O-N 3.31Å; G59-A63 VanDerWaalsContact O-N 3.16Å | ||
| 60 | T | 93.7 | Very high | 93.8 | Very high | 49 Ų | 49 | 66.1 Ų | 66.1 | 30% | 0.301 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -54 | -17.2 | -178.4 | 66 | 0 | 0 | 0 | 0 | 115.7 | I53 S64 R71 I78 | I53-T60 HydrophobicContact CD1-CG2 4.38Å; I53-T60 HydrophobicContact CG2-CG2 4.19Å; T60-S64 WeakPolarHBondContact O-CB 3.38Å; T60-R71 PolarHBondContact O-NE 3.12Å; T60-R71 PolarHBondContact OG1-NH2 3.32Å; T60-I78 HydrophobicContact CG2-CD1 3.81Å |
| 61 | R | 95.4 | Very high | 93.8 | Very high | 189 Ų | 189 | 71.8 Ų | 71.8 | 71% | 0.713 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -77.4 | -46.8 | 171.4 | -168.5 | 177.6 | -177.7 | -174 | 0 | 111.9 | G59 | G59-R61 PolarHBondContact O-N 2.91Å |
| 62 | R | 95.6 | Very high | 93.7 | Very high | 179 Ų | 179 | 70.1 Ų | 70.1 | 68% | 0.675 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -70.8 | -47.6 | -177.4 | -76.3 | -170.6 | 166 | -169.6 | -4.9 | 111.4 | L58 G59 S64 V65 I66 | L58-R62 HydrophobicContact CB-CB 4.48Å; L58-R62 HydrophobicContact CD2-CB 4Å; G59-R62 PolarHBondContact O-N 3.04Å; R62-S64 PolarHBondContact O-N 3.27Å; R62-V65 PolarHBondContact O-N 3.17Å; R62-I66 HydrophobicContact CB-CD1 4.25Å; R62-I66 WeakPolarHBondContact O-CG1 3.38Å; R62-I66 PolarHBondContact O-N 3.37Å |
| 63 | A | 95.2 | Very high | 93.6 | Very high | 0 Ų | 0 | 71.2 Ų | 71.2 | 0% | 0 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -57.6 | -36.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | A49 I53 L58 G59 V65 I66 Y67 L74 | A49-A63 HydrophobicContact CB-CB 4.4Å; I53-A63 HydrophobicContact CD1-CB 3.63Å; I53-A63 HydrophobicContact CG1-CB 3.8Å; L58-A63 HydrophobicContact CB-CB 4.17Å; L58-A63 HydrophobicContact CD1-CB 4.31Å; G59-A63 PolarHBondContact O-N 3.31Å; G59-A63 VanDerWaalsContact O-N 3.16Å; A63-V65 VanDerWaalsContact C-N 3.31Å; A63-V65 PolarHBondContact O-N 3.34Å; A63-I66 PolarHBondContact O-N 3.27Å; A63-Y67 HydrophobicContact CB-CD2 4.15Å; A63-Y67 HydrophobicContact CB-CE2 4.41Å; A63-Y67 WeakPolarHBondContact O-CD2 3.41Å; A63-Y67 PolarHBondContact O-N 3.36Å; A63-L74 HydrophobicContact CB-CD1 4.09Å |
| 64 | S | 95 | Very high | 93.6 | Very high | 22 Ų | 22 | 69.9 Ų | 69.9 | 15% | 0.154 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -65.9 | -31.7 | 177.2 | -173.4 | 0 | 0 | 0 | 0 | 113.9 | T60 R62 G68 V69 R71 | T60-S64 WeakPolarHBondContact O-CB 3.38Å; R62-S64 PolarHBondContact O-N 3.27Å; S64-G68 CarbonylContact O-C 3.56Å; S64-G68 WeakPolarHBondContact O-CA 3.47Å; S64-G68 PolarHBondContact O-N 2.99Å; S64-V69 WeakPolarHBondContact CA-O 3.35Å; S64-V69 VanDerWaalsContact CB-O 3.25Å; S64-V69 WeakPolarHBondContact CB-O 3.14Å; S64-V69 PolarHBondContact OG-O 2.82Å; S64-R71 VanDerWaalsContact CB-CG 3.43Å; S64-R71 WeakPolarHBondContact OG-CG 3.42Å; S64-R71 PolarHBondContact OG-N 2.9Å |
| 65 | V | 93.7 | Very high | 93.6 | Very high | 87 Ų | 87 | 71.8 Ų | 71.8 | 53% | 0.527 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -77.8 | -45.2 | 175 | 174.6 | 0 | 0 | 0 | 0 | 110.6 | T31 R62 A63 | T31-V65 HydrophobicContact CG2-CG1 3.57Å; R62-V65 PolarHBondContact O-N 3.17Å; A63-V65 VanDerWaalsContact C-N 3.31Å; A63-V65 PolarHBondContact O-N 3.34Å |
| 66 | I | 93.9 | Very high | 93.6 | Very high | 81 Ų | 81 | 72.5 Ų | 72.5 | 42% | 0.415 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -68.2 | -49 | -174.8 | -68.8 | 162.7 | 0 | 0 | 0 | 112 | L58 R62 A63 | L58-I66 HydrophobicContact CD1-CD1 3.69Å; L58-I66 HydrophobicContact CD2-CD1 3.83Å; L58-I66 HydrophobicContact CG-CD1 4.45Å; R62-I66 HydrophobicContact CB-CD1 4.25Å; R62-I66 WeakPolarHBondContact O-CG1 3.38Å; R62-I66 PolarHBondContact O-N 3.37Å; A63-I66 PolarHBondContact O-N 3.27Å |
| 67 | Y | 94.4 | Very high | 93.6 | Very high | 35 Ų | 35 | 71.9 Ų | 71.9 | 14% | 0.137 | 36% | 0.355 | C | S | . | . | S | Bend | trans | -92.8 | -1 | -176.9 | -60.1 | -83.6 | 0 | 0 | 0 | 113.3 | A48 A49 D52 L58 A63 V69 | A48-Y67 HydrophobicContact CB-CD1 4.22Å; A48-Y67 HydrophobicContact CB-CE1 3.61Å; A49-Y67 HydrophobicContact CB-CD1 4.37Å; A49-Y67 HydrophobicContact CB-CD2 3.38Å; A49-Y67 HydrophobicContact CB-CE2 3.92Å; A49-Y67 HydrophobicContact CB-CG 3.65Å; D52-Y67 HydrophobicContact CB-CE2 4.36Å; D52-Y67 PolarHBondContact OD1-OH 3.21Å; L58-Y67 HydrophobicContact CD1-CE2 3.85Å; A63-Y67 HydrophobicContact CB-CD2 4.15Å; A63-Y67 HydrophobicContact CB-CE2 4.41Å; A63-Y67 WeakPolarHBondContact O-CD2 3.41Å; A63-Y67 PolarHBondContact O-N 3.36Å; Y67-V69 PolarHBondContact O-N 2.87Å; Y67-V69 VanDerWaalsContact O-N 3.09Å |
| 68 | G | 93.1 | Very high | 93.4 | Very high | 40 Ų | 40 | 64 Ų | 64 | 41% | 0.412 | 33% | 0.325 | S | S | . | . | trans | 67.1 | 2 | -174.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | S64 | S64-G68 CarbonylContact O-C 3.56Å; S64-G68 WeakPolarHBondContact O-CA 3.47Å; S64-G68 PolarHBondContact O-N 2.99Å | ||
| 69 | V | 92.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 66.7 Ų | 66.7 | 0% | 0 | 34% | 0.337 | C | S | . | . | trans | -76.5 | 130 | -175.5 | -172.4 | 0 | 0 | 0 | 0 | 110.5 | D45 L46 A49 S64 Y67 R71 T73 L74 | D45-V69 HydrophobicContact CB-CG2 4.09Å; L46-V69 HydrophobicContact CB-CG2 4.5Å; L46-V69 HydrophobicContact CD1-CG1 3.78Å; A49-V69 HydrophobicContact CB-CG2 4.39Å; S64-V69 WeakPolarHBondContact CA-O 3.35Å; S64-V69 VanDerWaalsContact CB-O 3.25Å; S64-V69 WeakPolarHBondContact CB-O 3.14Å; S64-V69 PolarHBondContact OG-O 2.82Å; Y67-V69 PolarHBondContact O-N 2.87Å; Y67-V69 VanDerWaalsContact O-N 3.09Å; V69-R71 PolarHBondContact O-N 2.88Å; V69-T73 HydrophobicContact CG1-CG2 4.1Å; V69-L74 HydrophobicContact CB-CD1 4.31Å; V69-L74 HydrophobicContact CB-CD2 3.88Å; V69-L74 HydrophobicContact CB-CG 3.97Å; V69-L74 HydrophobicContact CG1-CD2 3.65Å; V69-L74 HydrophobicContact CG1-CG 3.71Å; V69-L74 HydrophobicContact CG2-CD2 4.42Å | ||
| 70 | P | 94.1 | Very high | 92.6 | Very high | 51 Ų | 51 | 72 Ų | 72 | 33% | 0.331 | 35% | 0.347 | S | S | . | . | trans | -58.2 | 138.3 | 177.9 | -26.2 | 34.6 | 0 | 0 | 0 | 113.6 | Y41 S72 T73 L74 | Y41-P70 HydrophobicContact CD1-CG 4.2Å; Y41-P70 HydrophobicContact CE1-CG 4.4Å; P70-S72 PolarHBondContact O-N 3.28Å; P70-S72 VanDerWaalsContact O-N 3.12Å; P70-T73 WeakPolarHBondContact O-CA 3.23Å; P70-T73 WeakPolarHBondContact O-CB 3.39Å; P70-T73 PolarHBondContact O-N 3.01Å; P70-L74 PolarHBondContact O-N 3.11Å | ||
| 71 | R | 93.4 | Very high | 91.9 | Very high | 123 Ų | 123 | 72.1 Ų | 72.1 | 46% | 0.464 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -55.3 | -33 | -177.8 | -61.3 | -166.4 | 72.1 | -168.8 | -5.5 | 114 | T60 S64 V69 R75 | T60-R71 PolarHBondContact O-NE 3.12Å; T60-R71 PolarHBondContact OG1-NH2 3.32Å; S64-R71 VanDerWaalsContact CB-CG 3.43Å; S64-R71 WeakPolarHBondContact OG-CG 3.42Å; S64-R71 PolarHBondContact OG-N 2.9Å; V69-R71 PolarHBondContact O-N 2.88Å; R71-R75 WeakPolarHBondContact O-CB 3.49Å; R71-R75 PolarHBondContact O-N 2.87Å |
| 72 | S | 92.7 | Very high | 90.8 | Very high | 75 Ų | 75 | 68.2 Ų | 68.2 | 52% | 0.524 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -67.1 | -46.4 | 174.1 | 45 | 0 | 0 | 0 | 0 | 111.9 | P70 L74 R75 N76 | P70-S72 PolarHBondContact O-N 3.28Å; P70-S72 VanDerWaalsContact O-N 3.12Å; S72-L74 PolarHBondContact O-N 3.32Å; S72-R75 PolarHBondContact O-N 3.32Å; S72-N76 WeakPolarHBondContact O-CB 3.16Å; S72-N76 PolarHBondContact O-N 2.78Å; S72-N76 PolarHBondContact O-ND2 3.28Å; S72-N76 PolarHBondContact O-OD1 2.91Å |
| 73 | T | 94.2 | Very high | 89.3 | Confident | 35 Ų | 35 | 65 Ų | 65 | 22% | 0.215 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59.3 | -46.3 | 175.5 | -50.3 | 0 | 0 | 0 | 0 | 111.1 | Y41 L46 V69 P70 N76 K77 | Y41-T73 HydrophobicContact CE2-CG2 4.35Å; L46-T73 HydrophobicContact CD1-CG2 3.91Å; L46-T73 HydrophobicContact CD2-CG2 4.46Å; V69-T73 HydrophobicContact CG1-CG2 4.1Å; P70-T73 WeakPolarHBondContact O-CA 3.23Å; P70-T73 WeakPolarHBondContact O-CB 3.39Å; P70-T73 PolarHBondContact O-N 3.01Å; T73-N76 PolarHBondContact O-N 3.32Å; T73-K77 PolarHBondContact O-N 2.76Å |
| 74 | L | 94.4 | Very high | 87.6 | Confident | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -58 | -55.3 | 173.9 | -67.9 | 175.3 | 0 | 0 | 0 | 110.9 | L46 A49 V50 I53 A63 V69 P70 S72 N76 K77 I78 | L46-L74 HydrophobicContact CD1-CD2 4.25Å; A49-L74 HydrophobicContact CB-CD2 3.49Å; A49-L74 VanDerWaalsContact CB-CD2 3.49Å; V50-L74 HydrophobicContact CG2-CD2 4.01Å; I53-L74 HydrophobicContact CD1-CB 4.37Å; I53-L74 HydrophobicContact CD1-CD1 4.11Å; I53-L74 HydrophobicContact CD1-CD2 4.22Å; I53-L74 HydrophobicContact CD1-CG 4.47Å; A63-L74 HydrophobicContact CB-CD1 4.09Å; V69-L74 HydrophobicContact CB-CD1 4.31Å; V69-L74 HydrophobicContact CB-CD2 3.88Å; V69-L74 HydrophobicContact CB-CG 3.97Å; V69-L74 HydrophobicContact CG1-CD2 3.65Å; V69-L74 HydrophobicContact CG1-CG 3.71Å; V69-L74 HydrophobicContact CG2-CD2 4.42Å; P70-L74 PolarHBondContact O-N 3.11Å; S72-L74 PolarHBondContact O-N 3.32Å; L74-N76 VanDerWaalsContact C-N 3.26Å; L74-N76 PolarHBondContact O-N 3.14Å; L74-K77 PolarHBondContact O-N 3.35Å; L74-K77 VanDerWaalsContact O-N 3.16Å; L74-I78 HydrophobicContact CB-CD1 4.25Å; L74-I78 WeakPolarHBondContact O-CB 3.06Å; L74-I78 VanDerWaalsContact O-CD1 3.3Å; L74-I78 WeakPolarHBondContact O-CD1 3.31Å; L74-I78 WeakPolarHBondContact O-CG1 3.29Å; L74-I78 PolarHBondContact O-N 3.19Å |
| 75 | R | 92.6 | Very high | 85.7 | Confident | 152 Ų | 152 | 68.5 Ų | 68.5 | 57% | 0.574 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -55.1 | -40.9 | 179.3 | -173.5 | 179.2 | -177.7 | -156.6 | -1 | 112.5 | R71 S72 I78 H79 | R71-R75 WeakPolarHBondContact O-CB 3.49Å; R71-R75 PolarHBondContact O-N 2.87Å; S72-R75 PolarHBondContact O-N 3.32Å; R75-I78 PolarHBondContact O-N 3.17Å; R75-H79 WeakPolarHBondContact CG-NE2 3.39Å; R75-H79 PolarHBondContact NE-CE1 2.84Å; R75-H79 PolarHBondContact NE-NE2 3.44Å; R75-H79 PolarHBondContact O-CD2 2.94Å; R75-H79 VanDerWaalsContact O-CG 3.27Å; R75-H79 PolarHBondContact O-N 3.12Å |
| 76 | N | 91.5 | Very high | 83.8 | Confident | 95 Ų | 95 | 67.2 Ų | 67.2 | 51% | 0.508 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -68.2 | -41.3 | 179.1 | -70.1 | -11.8 | 0 | 0 | 0 | 112.8 | S72 T73 L74 K80 | S72-N76 WeakPolarHBondContact O-CB 3.16Å; S72-N76 PolarHBondContact O-N 2.78Å; S72-N76 PolarHBondContact O-ND2 3.28Å; S72-N76 PolarHBondContact O-OD1 2.91Å; T73-N76 PolarHBondContact O-N 3.32Å; L74-N76 VanDerWaalsContact C-N 3.26Å; L74-N76 PolarHBondContact O-N 3.14Å; N76-K80 VanDerWaalsContact O-CG 3.32Å; N76-K80 WeakPolarHBondContact O-CG 3.14Å; N76-K80 PolarHBondContact O-N 3.26Å |
| 77 | K | 91.4 | Very high | 81.9 | Confident | 52 Ų | 52 | 66.9 Ų | 66.9 | 23% | 0.226 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -70.7 | -36.8 | 175.6 | -176.3 | 82.7 | 168.9 | -161.7 | 0 | 110.7 | L46 E47 V50 T73 L74 L81 | L46-K77 HydrophobicContact CD1-CB 4.19Å; L46-K77 HydrophobicContact CD1-CG 4.23Å; L46-K77 HydrophobicContact CD2-CD 4.45Å; L46-K77 HydrophobicContact CG-CG 4.44Å; E47-K77 IonicContact OE1-NZ 2.76Å; E47-K77 PolarHBondContact OE1-NZ 2.99Å; V50-K77 HydrophobicContact CB-CG 4.47Å; V50-K77 HydrophobicContact CG1-CG 4.31Å; V50-K77 HydrophobicContact CG2-CB 4.14Å; V50-K77 HydrophobicContact CG2-CG 3.83Å; T73-K77 PolarHBondContact O-N 2.76Å; L74-K77 PolarHBondContact O-N 3.35Å; L74-K77 VanDerWaalsContact O-N 3.16Å; K77-L81 HydrophobicContact CG-CD1 4.24Å; K77-L81 WeakPolarHBondContact O-CD1 3.49Å; K77-L81 WeakPolarHBondContact O-CG 3.31Å; K77-L81 PolarHBondContact O-N 3.14Å |
| 78 | I | 90.4 | Very high | 79.8 | Confident | 9 Ų | 9 | 72.1 Ų | 72.1 | 5% | 0.046 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62.2 | -55.8 | 173.9 | -68.9 | 159.1 | 0 | 0 | 0 | 111.3 | V50 I53 T60 L74 R75 K80 L81 E82 | V50-I78 HydrophobicContact CG1-CG1 4.49Å; V50-I78 HydrophobicContact CG2-CG1 4.19Å; I53-I78 HydrophobicContact CB-CD1 4.22Å; I53-I78 HydrophobicContact CD1-CD1 3.68Å; I53-I78 HydrophobicContact CG1-CD1 4.5Å; I53-I78 HydrophobicContact CG2-CD1 3.71Å; I53-I78 HydrophobicContact CG2-CG1 4.37Å; T60-I78 HydrophobicContact CG2-CD1 3.81Å; L74-I78 HydrophobicContact CB-CD1 4.25Å; L74-I78 WeakPolarHBondContact O-CB 3.06Å; L74-I78 VanDerWaalsContact O-CD1 3.3Å; L74-I78 WeakPolarHBondContact O-CD1 3.31Å; L74-I78 WeakPolarHBondContact O-CG1 3.29Å; L74-I78 PolarHBondContact O-N 3.19Å; R75-I78 PolarHBondContact O-N 3.17Å; I78-K80 VanDerWaalsContact C-N 3.3Å; I78-K80 PolarHBondContact O-N 3.22Å; I78-L81 CarbonylContact O-C 3.39Å; I78-L81 WeakPolarHBondContact O-CA 3.35Å; I78-L81 PolarHBondContact O-N 3.29Å; I78-E82 HydrophobicContact CG2-CG 3.98Å; I78-E82 WeakPolarHBondContact CG2-OE1 3.42Å; I78-E82 WeakPolarHBondContact CG2-OE2 3.44Å; I78-E82 WeakPolarHBondContact O-CG 3.38Å; I78-E82 PolarHBondContact O-N 3.28Å |
| 79 | H | 86.9 | Confident | 77.7 | Confident | 78 Ų | 78 | 78.5 Ų | 78.5 | 36% | 0.361 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -56.3 | -43.8 | -179.6 | -69.7 | -179.1 | 0 | 0 | 0 | 112 | R75 L81 E82 V83 | R75-H79 WeakPolarHBondContact CG-NE2 3.39Å; R75-H79 PolarHBondContact NE-CE1 2.84Å; R75-H79 PolarHBondContact NE-NE2 3.44Å; R75-H79 PolarHBondContact O-CD2 2.94Å; R75-H79 VanDerWaalsContact O-CG 3.27Å; R75-H79 PolarHBondContact O-N 3.12Å; H79-L81 VanDerWaalsContact C-N 3.32Å; H79-E82 IonicContact CD2-OE2 3.82Å; H79-E82 PolarHBondContact O-N 2.71Å; H79-V83 WeakPolarHBondContact O-CG2 3.28Å; H79-V83 PolarHBondContact O-N 2.75Å |
| 80 | K | 81.9 | Confident | 76.1 | Confident | 161 Ų | 161 | 82.2 Ų | 82.2 | 70% | 0.7 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -60 | -45.1 | 172.7 | -71.6 | 177.2 | 178.3 | -170.2 | 0 | 110.9 | N76 I78 A84 | N76-K80 VanDerWaalsContact O-CG 3.32Å; N76-K80 WeakPolarHBondContact O-CG 3.14Å; N76-K80 PolarHBondContact O-N 3.26Å; I78-K80 VanDerWaalsContact C-N 3.3Å; I78-K80 PolarHBondContact O-N 3.22Å; K80-A84 WeakPolarHBondContact O-CB 3.29Å; K80-A84 PolarHBondContact O-N 3.4Å |
| 81 | L | 77.8 | Confident | 73.7 | Confident | 51 Ų | 51 | 89.9 Ų | 89.9 | 27% | 0.267 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -56.1 | -43.3 | 176 | 67.3 | 62.5 | 0 | 0 | 0 | 113.8 | V50 R54 K77 I78 H79 A84 C85 | V50-L81 HydrophobicContact CG1-CD1 3.62Å; R54-L81 PolarHBondContact NH2-O 2.93Å; K77-L81 HydrophobicContact CG-CD1 4.24Å; K77-L81 WeakPolarHBondContact O-CD1 3.49Å; K77-L81 WeakPolarHBondContact O-CG 3.31Å; K77-L81 PolarHBondContact O-N 3.14Å; I78-L81 CarbonylContact O-C 3.39Å; I78-L81 WeakPolarHBondContact O-CA 3.35Å; I78-L81 PolarHBondContact O-N 3.29Å; H79-L81 VanDerWaalsContact C-N 3.32Å; L81-A84 HydrophobicContact CB-CB 3.98Å; L81-C85 WeakPolarHBondContact O-CB 3.18Å; L81-C85 PolarHBondContact O-N 3.32Å |
| 82 | E | 73.5 | Confident | 71 | Confident | 107 Ų | 107 | 88.1 Ų | 88.1 | 50% | 0.5 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -75.1 | -45.3 | -177 | -71.9 | 165.8 | 155.7 | 0 | 0 | 110.9 | I78 H79 A84 C85 G86 | I78-E82 HydrophobicContact CG2-CG 3.98Å; I78-E82 WeakPolarHBondContact CG2-OE1 3.42Å; I78-E82 WeakPolarHBondContact CG2-OE2 3.44Å; I78-E82 WeakPolarHBondContact O-CG 3.38Å; I78-E82 PolarHBondContact O-N 3.28Å; H79-E82 IonicContact CD2-OE2 3.82Å; H79-E82 PolarHBondContact O-N 2.71Å; E82-A84 VanDerWaalsContact C-N 3.26Å; E82-A84 PolarHBondContact O-N 2.91Å; E82-C85 PolarHBondContact O-N 2.86Å; E82-G86 PolarHBondContact O-N 2.9Å |
| 83 | V | 64.2 | Low | 68.4 | Low | 112 Ų | 112 | 87.7 Ų | 87.7 | 68% | 0.679 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.3 | -37.6 | 172.7 | 171.9 | 0 | 0 | 0 | 0 | 111 | H79 S87 | H79-V83 WeakPolarHBondContact O-CG2 3.28Å; H79-V83 PolarHBondContact O-N 2.75Å; V83-S87 WeakPolarHBondContact O-CB 3.46Å; V83-S87 PolarHBondContact O-N 3.47Å |
| 84 | A | 59 | Low | 66.1 | Low | 38 Ų | 38 | 94.6 Ų | 94.6 | 31% | 0.314 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.1 | -50.6 | 172 | 0 | 0 | 0 | 0 | 0 | 112 | K80 L81 E82 S87 M88 | K80-A84 WeakPolarHBondContact O-CB 3.29Å; K80-A84 PolarHBondContact O-N 3.4Å; L81-A84 HydrophobicContact CB-CB 3.98Å; E82-A84 VanDerWaalsContact C-N 3.26Å; E82-A84 PolarHBondContact O-N 2.91Å; A84-S87 PolarHBondContact O-N 3.46Å; A84-M88 WeakPolarHBondContact O-CB 3.5Å; A84-M88 VanDerWaalsContact O-CG 3.25Å; A84-M88 WeakPolarHBondContact O-CG 3.21Å; A84-M88 PolarHBondContact O-N 3.01Å |
| 85 | C | 54.9 | Low | 64 | Low | 56 Ų | 56 | 103.9 Ų | 103.9 | 38% | 0.378 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -68.2 | -41.5 | -172.7 | -168.9 | 0 | 0 | 0 | 0 | 113.4 | L81 E82 S87 M88 | L81-C85 WeakPolarHBondContact O-CB 3.18Å; L81-C85 PolarHBondContact O-N 3.32Å; E82-C85 PolarHBondContact O-N 2.86Å; C85-S87 PolarHBondContact O-N 3.46Å; C85-M88 PolarHBondContact O-N 3.38Å |
| 86 | G | 54.1 | Low | 61.5 | Low | 61 Ų | 61 | 102.3 Ų | 102.3 | 63% | 0.629 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -68.5 | -20.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | E82 | E82-G86 PolarHBondContact O-N 2.9Å |
| 87 | S | 53.3 | Low | 59.2 | Low | 73 Ų | 73 | 105.1 Ų | 105.1 | 51% | 0.51 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -89.4 | -34.1 | 174.8 | -169.5 | 0 | 0 | 0 | 0 | 112.6 | V83 A84 C85 M89 A90 R91 | V83-S87 WeakPolarHBondContact O-CB 3.46Å; V83-S87 PolarHBondContact O-N 3.47Å; A84-S87 PolarHBondContact O-N 3.46Å; C85-S87 PolarHBondContact O-N 3.46Å; S87-M89 VanDerWaalsContact C-N 3.3Å; S87-M89 PolarHBondContact O-N 2.95Å; S87-A90 WeakPolarHBondContact O-CB 3.42Å; S87-A90 PolarHBondContact O-N 3Å; S87-R91 PolarHBondContact O-N 2.95Å |
| 88 | M | 49.8 | Very low | 56.8 | Low | 146 Ų | 146 | 110.1 Ų | 110.1 | 72% | 0.719 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -66.6 | -25.7 | -179.1 | -78.4 | 175 | 71.2 | 0 | 0 | 113.9 | A84 C85 A90 | A84-M88 WeakPolarHBondContact O-CB 3.5Å; A84-M88 VanDerWaalsContact O-CG 3.25Å; A84-M88 WeakPolarHBondContact O-CG 3.21Å; A84-M88 PolarHBondContact O-N 3.01Å; C85-M88 PolarHBondContact O-N 3.38Å; M88-A90 PolarHBondContact O-N 3.04Å |
| 89 | M | 50.6 | Low | 54.3 | Low | 173 Ų | 173 | 117.9 Ų | 117.9 | 85% | 0.852 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -15.5 | 170.8 | -67.3 | -173.8 | -179.7 | 0 | 0 | 113.3 | S87 | S87-M89 VanDerWaalsContact C-N 3.3Å; S87-M89 PolarHBondContact O-N 2.95Å |
| 90 | A | 56.7 | Low | 52.1 | Low | 79 Ų | 79 | 122.8 Ų | 122.8 | 65% | 0.653 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.5 | -21.1 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | S87 M88 | S87-A90 WeakPolarHBondContact O-CB 3.42Å; S87-A90 PolarHBondContact O-N 3Å; M88-A90 PolarHBondContact O-N 3.04Å |
| 91 | R | 44.8 | Very low | 50.1 | Low | 212 Ų | 212 | 120.8 Ų | 120.8 | 80% | 0.8 | 68% | 0.684 | S | S | * | * | trans | -146 | 113.3 | 178.1 | -68.7 | -167.8 | 174.4 | -159.3 | -5.1 | 113 | S87 | S87-R91 PolarHBondContact O-N 2.95Š| ||
| 92 | G | 36.1 | Very low | 48.8 | Very low | 86 Ų | 86 | 126.3 Ų | 126.3 | 89% | 0.887 | 71% | 0.708 | S | S | * | * | trans | -62.7 | 135.2 | 151.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 93 | G | 39.2 | Very low | 47.4 | Very low | 65 Ų | 65 | 131.3 Ų | 131.3 | 67% | 0.67 | 73% | 0.729 | S | S | * | * | trans | 161.4 | 90.6 | -174.9 | 0 | 0 | 0 | 0 | 0 | 112 | K95 | G93-K95 PolarHBondContact O-N 2.88Š| ||
| 94 | H | 45.3 | Very low | 46.3 | Very low | 181 Ų | 181 | 129.6 Ų | 129.6 | 84% | 0.838 | 73% | 0.734 | S | S | * | * | trans | -59.3 | 133 | 172.3 | -72.4 | -109.5 | 0 | 0 | 0 | 110.2 | ||||
| 95 | K | 50.1 | Low | 45.3 | Very low | 194 Ų | 194 | 138.2 Ų | 138.2 | 84% | 0.843 | 76% | 0.758 | S | S | * | * | trans | -119.2 | 80 | 159.3 | -74.3 | -161.9 | 172 | -168.5 | 0 | 109.2 | G93 N97 | G93-K95 PolarHBondContact O-N 2.88Å; K95-N97 PolarHBondContact O-N 3.44Å; K95-N97 VanDerWaalsContact O-N 3.14Å | ||
| 96 | T | 40.4 | Very low | 44.9 | Very low | 120 Ų | 120 | 141.9 Ų | 141.9 | 74% | 0.736 | 77% | 0.773 | S | S | * | * | trans | -68.5 | 96.3 | 165.7 | 46.1 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 97 | N | 43.7 | Very low | 44.2 | Very low | 153 Ų | 153 | 146.4 Ų | 146.4 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | -91.5 | 118.3 | 159.4 | -75.2 | 14.6 | 0 | 0 | 0 | 107 | K95 | K95-N97 PolarHBondContact O-N 3.44Å; K95-N97 VanDerWaalsContact O-N 3.14Å | ||
| 98 | N | 40.6 | Very low | 43.4 | Very low | 158 Ų | 158 | 147 Ų | 147 | 85% | 0.845 | 78% | 0.782 | S | S | * | * | trans | -82 | -168 | -174.4 | -154.4 | 3.4 | 0 | 0 | 0 | 110.9 | ||||
| 99 | E | 38.1 | Very low | 43 | Very low | 171 Ų | 171 | 145.7 Ų | 145.7 | 80% | 0.799 | 79% | 0.788 | S | S | * | * | trans | 84.3 | 67.3 | 151.2 | -146.5 | 163.1 | 118.8 | 0 | 0 | 117.7 | ||||
| 100 | F | 40.7 | Very low | 42.7 | Very low | 181 Ų | 181 | 146.8 Ų | 146.8 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | -141.3 | 114.7 | 130 | -162.2 | -104.7 | 0 | 0 | 0 | 110.3 | E102 | F100-E102 HydrophobicContact CE1-CB 4.34Å; F100-E102 WeakPolarHBondContact CE1-OE2 3.25Å | |||
| 101 | S | 38.5 | Very low | 42.1 | Very low | 119 Ų | 119 | 147.1 Ų | 147.1 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | trans | -96 | 107.2 | -176.8 | -67.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 102 | E | 50.9 | Low | 42.2 | Very low | 167 Ų | 167 | 142.2 Ų | 142.2 | 78% | 0.78 | 78% | 0.784 | S | S | * | * | trans | -131.2 | 155.5 | 165.6 | -147 | 169.8 | 125.9 | 0 | 0 | 111.2 | F100 | F100-E102 HydrophobicContact CE1-CB 4.34Å; F100-E102 WeakPolarHBondContact CE1-OE2 3.25Å | ||
| 103 | K | 45.3 | Very low | 42.4 | Very low | 212 Ų | 212 | 143.8 Ų | 143.8 | 92% | 0.922 | 77% | 0.769 | S | S | * | * | trans | -113.7 | 143.9 | -159 | -62.5 | 174.3 | -179.6 | 173.9 | 0 | 112.6 | ||||
| 104 | G | 39.3 | Very low | 42.5 | Very low | 77 Ų | 77 | 143.6 Ų | 143.6 | 79% | 0.794 | 76% | 0.76 | S | S | * | * | trans | 110.9 | 125.5 | 169.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 105 | R | 38.3 | Very low | 42.5 | Very low | 219 Ų | 219 | 139.8 Ų | 139.8 | 83% | 0.826 | 76% | 0.761 | S | S | * | * | cis | 108.4 | 115.5 | 12.8 | -176.3 | 166.8 | -174.9 | -179.7 | 3.4 | 113.3 | ||||
| 106 | L | 46.2 | Very low | 42.4 | Very low | 132 Ų | 132 | 134.4 Ų | 134.4 | 69% | 0.691 | 75% | 0.752 | S | S | * | * | trans | 68.9 | 149.7 | 174.2 | -56.5 | 158.5 | 0 | 0 | 0 | 113.8 | ||||
| 107 | E | 40.8 | Very low | 43.3 | Very low | 157 Ų | 157 | 135.4 Ų | 135.4 | 73% | 0.734 | 76% | 0.758 | S | S | * | * | cis | -157.2 | 136.7 | -11.2 | -117.3 | -160.6 | 73.9 | 0 | 0 | 108 | ||||
| 108 | S | 36.7 | Very low | 43.7 | Very low | 85 Ų | 85 | 133.7 Ų | 133.7 | 59% | 0.594 | 76% | 0.755 | S | S | * | * | 103.7 | 150.7 | 81.2 | 78.5 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 109 | S | 41.2 | Very low | 43.9 | Very low | 119 Ų | 119 | 130.4 Ų | 130.4 | 83% | 0.832 | 75% | 0.75 | S | S | * | * | trans | 82 | 163.4 | 161.2 | -51.8 | 0 | 0 | 0 | 0 | 121 | ||||
| 110 | Q | 42.8 | Very low | 44.5 | Very low | 196 Ų | 196 | 128.4 Ų | 128.4 | 92% | 0.916 | 75% | 0.749 | S | S | * | * | trans | -137.7 | 173.6 | -153.7 | -83.8 | -171.2 | -69.8 | 0 | 0 | 115.9 | ||||
| 111 | P | 46 | Very low | 44.9 | Very low | 86 Ų | 86 | 124.8 Ų | 124.8 | 56% | 0.558 | 75% | 0.746 | S | S | * | * | trans | -123.7 | 171.7 | -160.9 | 43.8 | -33.1 | 0 | 0 | 0 | 118.6 | Q25 | Q25-P111 VanDerWaalsContact NE2-CG 3.26Š| ||
| 112 | S | 47 | Very low | 45.7 | Very low | 109 Ų | 109 | 124.8 Ų | 124.8 | 76% | 0.762 | 74% | 0.743 | S | S | * | * | trans | -163.7 | 134.4 | 166.8 | 38.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 113 | E | 39.1 | Very low | 45.5 | Very low | 119 Ų | 119 | 123.2 Ų | 123.2 | 56% | 0.556 | 74% | 0.74 | S | S | * | * | 74.5 | 134.2 | 80.8 | -70.1 | -144.9 | 101 | 0 | 0 | 116.2 | S24 | S24-E113 WeakPolarHBondContact CA-OE1 3.3Å; S24-E113 WeakPolarHBondContact CB-OE1 3.22Å; S24-E113 PolarHBondContact N-OE1 3.48Å; S24-E113 VanDerWaalsContact O-CG 3.23Å; S24-E113 WeakPolarHBondContact O-CG 3.34Å; S24-E113 PolarHBondContact OG-OE1 3.5Å | |||
| 114 | A | 42.2 | Very low | 45.8 | Very low | 60 Ų | 60 | 119.4 Ų | 119.4 | 50% | 0.496 | 73% | 0.726 | S | S | . | * | cis | -167.1 | -172.7 | -6.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | S24 | S24-A114 WeakPolarHBondContact OG-CB 3.44Š| ||
| 115 | A | 45.5 | Very low | 46.5 | Very low | 102 Ų | 102 | 122.6 Ų | 122.6 | 84% | 0.843 | 72% | 0.72 | S | S | * | * | trans | 71.4 | 158.3 | 159.7 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 116 | A | 46.3 | Very low | 46.8 | Very low | 81 Ų | 81 | 117.7 Ų | 117.7 | 67% | 0.669 | 71% | 0.71 | S | S | * | * | cis | -171.1 | 141.4 | -19.3 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 117 | V | 59.8 | Low | 47.3 | Very low | 140 Ų | 140 | 119.4 Ų | 119.4 | 85% | 0.848 | 72% | 0.715 | S | S | * | * | trans | 71 | 178.3 | 139.1 | -51 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 118 | P | 52.8 | Low | 47.7 | Very low | 118 Ų | 118 | 117.7 Ų | 117.7 | 77% | 0.766 | 72% | 0.72 | S | S | * | * | -146 | -163.7 | -106.8 | 44.5 | -20.2 | 0 | 0 | 0 | 119.2 | |||||
| 119 | A | 44.9 | Very low | 48.3 | Very low | 88 Ų | 88 | 117 Ų | 117 | 73% | 0.727 | 73% | 0.726 | S | S | * | * | trans | 120.7 | 144.8 | 137.8 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 120 | V | 50.9 | Low | 48.5 | Very low | 129 Ų | 129 | 119.3 Ų | 119.3 | 78% | 0.782 | 72% | 0.723 | S | S | * | * | trans | 63.1 | 121.9 | 158 | 172.6 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 121 | S | 49.4 | Very low | 48.9 | Very low | 105 Ų | 105 | 115.2 Ų | 115.2 | 73% | 0.734 | 71% | 0.712 | S | S | * | * | cis | 88.5 | 153.8 | 46.4 | -63.5 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 122 | P | 54.8 | Low | 49.4 | Very low | 119 Ų | 119 | 116.6 Ų | 116.6 | 77% | 0.773 | 72% | 0.719 | S | S | * | * | cis | -133.7 | -143 | -36.6 | 41.8 | -22.7 | 0 | 0 | 0 | 113.2 | ||||
| 123 | N | 46.4 | Very low | 49.7 | Very low | 135 Ų | 135 | 117.2 Ų | 117.2 | 72% | 0.722 | 72% | 0.72 | S | S | * | * | trans | 83.4 | 149.3 | 173 | -88.4 | 25.9 | 0 | 0 | 0 | 120 | ||||
| 124 | E | 52.1 | Low | 50.4 | Low | 131 Ų | 131 | 118.4 Ų | 118.4 | 61% | 0.612 | 74% | 0.735 | S | S | * | * | cis | -166.5 | 157.6 | -22.7 | -128.9 | -168 | 124.5 | 0 | 0 | 112.7 | ||||
| 125 | Q | 52.2 | Low | 50.9 | Low | 145 Ų | 145 | 122.4 Ų | 122.4 | 68% | 0.678 | 75% | 0.753 | S | S | * | * | trans | 59.1 | 170.3 | 155.6 | -65.4 | -172.8 | 30.9 | 0 | 0 | 118.9 | ||||
| 126 | N | 46.1 | Very low | 51.1 | Low | 115 Ų | 115 | 120.9 Ų | 120.9 | 62% | 0.615 | 75% | 0.748 | S | S | * | * | cis | -165.9 | 165.6 | -23.5 | -108.2 | -33.9 | 0 | 0 | 0 | 107.2 | ||||
| 127 | Q | 55.3 | Low | 51.4 | Low | 169 Ų | 169 | 125.1 Ų | 125.1 | 79% | 0.79 | 76% | 0.756 | S | S | * | * | cis | -166.1 | -176.7 | -24.8 | -142.7 | -174 | 100.5 | 0 | 0 | 109.6 | ||||
| 128 | S | 50.3 | Low | 51.2 | Low | 120 Ų | 120 | 126.7 Ų | 126.7 | 84% | 0.839 | 76% | 0.759 | S | S | * | * | trans | 70.9 | 141.9 | 175.3 | -160.2 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 129 | G | 49.8 | Very low | 51.4 | Low | 70 Ų | 70 | 129 Ų | 129 | 72% | 0.722 | 76% | 0.759 | S | S | * | * | cis | 177.9 | -169.2 | 3.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 130 | H | 44.8 | Very low | 51.9 | Low | 169 Ų | 169 | 134.2 Ų | 134.2 | 78% | 0.782 | 77% | 0.765 | S | S | * | * | cis | -171.3 | 133.1 | -15.2 | -171.5 | 70.2 | 0 | 0 | 0 | 109.9 | ||||
| 131 | V | 50.3 | Low | 52.2 | Low | 110 Ų | 110 | 133.6 Ų | 133.6 | 67% | 0.667 | 77% | 0.767 | S | S | * | * | trans | 52.5 | 162.4 | 164.1 | -58 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 132 | T | 57.6 | Low | 53.2 | Low | 115 Ų | 115 | 136.2 Ų | 136.2 | 71% | 0.706 | 77% | 0.771 | S | S | * | * | cis | -163.5 | 151.7 | -28.3 | 31.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 133 | P | 53 | Low | 53.4 | Low | 122 Ų | 122 | 135 Ų | 135 | 79% | 0.792 | 76% | 0.763 | S | S | * | * | trans | -95.6 | 151.9 | 166.7 | 36.7 | -31.8 | 0 | 0 | 0 | 113.3 | ||||
| 134 | V | 54.9 | Low | 54.1 | Low | 143 Ų | 143 | 138 Ų | 138 | 87% | 0.867 | 77% | 0.766 | S | S | * | * | trans | -129 | 139.6 | 171 | 173.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 135 | T | 52.4 | Low | 54.2 | Low | 144 Ų | 144 | 138.4 Ų | 138.4 | 88% | 0.883 | 77% | 0.769 | S | S | * | * | trans | -114.7 | 136.9 | -173.7 | -57.6 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 136 | G | 48.5 | Very low | 54.6 | Low | 71 Ų | 71 | 134.8 Ų | 134.8 | 73% | 0.732 | 76% | 0.764 | S | S | * | * | trans | 126.8 | 112.7 | 153.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 137 | M | 53 | Low | 55.4 | Low | 170 Ų | 170 | 137 Ų | 137 | 84% | 0.837 | 77% | 0.773 | S | S | * | * | trans | -156.4 | 106.9 | 146.7 | -90.7 | -111 | 88.3 | 0 | 0 | 107.2 | ||||
| 138 | L | 54.8 | Low | 55.9 | Low | 173 Ų | 173 | 134.9 Ų | 134.9 | 91% | 0.906 | 77% | 0.774 | S | S | * | * | trans | -88.2 | 118.6 | 177 | -173.9 | 78.8 | 0 | 0 | 0 | 109.3 | ||||
| 139 | Q | 57.5 | Low | 56.7 | Low | 167 Ų | 167 | 135.7 Ų | 135.7 | 78% | 0.78 | 77% | 0.774 | S | S | * | * | trans | -117.9 | 150.2 | 172.3 | -71.9 | -168.9 | -14.4 | 0 | 0 | 111.8 | ||||
| 140 | K | 55.5 | Low | 57.1 | Low | 196 Ų | 196 | 137.6 Ų | 137.6 | 85% | 0.852 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 148.3 | -156.6 | -73.5 | 84.3 | 171.9 | -175.2 | 0 | 113.3 | ||
| 141 | S | 58.3 | Low | 57.6 | Low | 116 Ų | 116 | 137.2 Ų | 137.2 | 81% | 0.811 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 142.3 | 163.7 | 43.4 | 0 | 0 | 0 | 0 | 111.1 | ||
| 142 | I | 70.2 | Confident | 57.5 | Low | 160 Ų | 160 | 136 Ų | 136 | 82% | 0.821 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -100.8 | 120.5 | 173.1 | -57.1 | 173.2 | 0 | 0 | 0 | 107.7 | ||
| 143 | P | 59.4 | Low | 56.9 | Low | 93 Ų | 93 | 136.1 Ų | 136.1 | 60% | 0.604 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 130.1 | 170.8 | 31 | -32 | 0 | 0 | 0 | 109.6 | M145 | P143-M145 HydrophobicContact CB-CE 4.08Å; P143-M145 HydrophobicContact CG-CE 4.04Å |
| 144 | Y | 59.4 | Low | 56.6 | Low | 199 Ų | 199 | 139.1 Ų | 139.1 | 78% | 0.78 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 135.5 | 166.3 | 95.2 | -83 | 0 | 0 | 0 | 108.8 | A146 | Y144-A146 HydrophobicContact CE2-CB 4.02Š|
| 145 | M | 55 | Low | 56.5 | Low | 139 Ų | 139 | 137.8 Ų | 137.8 | 69% | 0.685 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 126 | 172.9 | -67.8 | -66.2 | 123.1 | 0 | 0 | 109.2 | P143 | P143-M145 HydrophobicContact CB-CE 4.08Å; P143-M145 HydrophobicContact CG-CE 4.04Å |
| 146 | A | 61.1 | Low | 56 | Low | 70 Ų | 70 | 137.3 Ų | 137.3 | 58% | 0.579 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 133.9 | 172 | 0 | 0 | 0 | 0 | 0 | 110 | Y144 | Y144-A146 HydrophobicContact CE2-CB 4.02Š|
| 147 | M | 63.3 | Low | 56.2 | Low | 161 Ų | 161 | 138.2 Ų | 138.2 | 79% | 0.793 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 122.9 | -179.9 | -62.7 | -64.1 | 171.7 | 0 | 0 | 110.6 | T149 | M147-T149 PolarHBondContact O-N 3.48Š|
| 148 | P | 64.3 | Low | 55.7 | Low | 125 Ų | 125 | 137.5 Ų | 137.5 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | trans | -85.2 | 104.7 | 175.6 | 32.3 | -31.6 | 0 | 0 | 0 | 111 | ||||
| 149 | T | 66.7 | Low | 56 | Low | 137 Ų | 137 | 137.2 Ų | 137.2 | 84% | 0.84 | 79% | 0.79 | S | S | * | * | trans | -85.3 | 108.4 | 165.8 | 47.5 | 0 | 0 | 0 | 0 | 109.7 | M147 N151 | M147-T149 PolarHBondContact O-N 3.48Å; T149-N151 PolarHBondContact O-N 3.24Å | ||
| 150 | S | 59.6 | Low | 55.7 | Low | 109 Ų | 109 | 134 Ų | 134 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | trans | -69 | 118.6 | 174.3 | 53.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 151 | N | 55.6 | Low | 55.5 | Low | 162 Ų | 162 | 132.8 Ų | 132.8 | 87% | 0.866 | 78% | 0.783 | S | S | * | * | trans | -172.2 | 111.2 | 142.9 | -92.8 | -21.2 | 0 | 0 | 0 | 108 | T149 | T149-N151 PolarHBondContact O-N 3.24Š| ||
| 152 | G | 47.2 | Very low | 54.8 | Low | 83 Ų | 83 | 135.7 Ų | 135.7 | 86% | 0.856 | 78% | 0.782 | S | S | * | * | trans | -96.1 | 113.8 | -173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 153 | T | 46 | Very low | 53.8 | Low | 118 Ų | 118 | 133.2 Ų | 133.2 | 72% | 0.724 | 78% | 0.777 | S | S | * | * | trans | -132.1 | 94.5 | 165.2 | -48.9 | 0 | 0 | 0 | 0 | 109.4 | V155 | T153-V155 HydrophobicContact CG2-CG1 4.09Å; T153-V155 HydrophobicContact CG2-CG2 4.01Å; T153-V155 PolarHBondContact O-N 3.04Å | ||
| 154 | L | 46.2 | Very low | 53.2 | Low | 186 Ų | 186 | 132.4 Ų | 132.4 | 97% | 0.974 | 77% | 0.772 | S | S | * | * | trans | -82 | 96.3 | 166.2 | -85 | 168 | 0 | 0 | 0 | 108.8 | ||||
| 155 | V | 51.5 | Low | 52.8 | Low | 115 Ų | 115 | 130.8 Ų | 130.8 | 70% | 0.697 | 78% | 0.776 | S | S | * | * | trans | -128.4 | 121.5 | 164.1 | -68.7 | 0 | 0 | 0 | 0 | 109.5 | T153 | T153-V155 HydrophobicContact CG2-CG1 4.09Å; T153-V155 HydrophobicContact CG2-CG2 4.01Å; T153-V155 PolarHBondContact O-N 3.04Å | ||
| 156 | S | 42 | Very low | 52.9 | Low | 133 Ų | 133 | 132 Ų | 132 | 93% | 0.93 | 79% | 0.785 | S | S | * | * | trans | -76.9 | 121.4 | 169.8 | -59.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 157 | A | 52.9 | Low | 52.9 | Low | 90 Ų | 90 | 134.4 Ų | 134.4 | 74% | 0.744 | 79% | 0.789 | S | S | * | * | trans | -146.6 | 132.7 | 170 | 0 | 0 | 0 | 0 | 0 | 109.4 | I159 | A157-I159 PolarHBondContact O-N 3.32Š| ||
| 158 | D | 44.2 | Very low | 52.7 | Low | 156 Ų | 156 | 133.1 Ų | 133.1 | 83% | 0.834 | 79% | 0.792 | S | S | * | * | trans | -67.2 | 126.3 | -178.5 | -71.4 | -84.1 | 0 | 0 | 0 | 112.7 | ||||
| 159 | I | 60.1 | Low | 52.1 | Low | 166 Ų | 166 | 133 Ų | 133 | 85% | 0.851 | 79% | 0.785 | S | S | * | * | trans | -124.1 | 93.6 | 148 | -62.1 | -175.1 | 0 | 0 | 0 | 107.6 | A157 H161 | A157-I159 PolarHBondContact O-N 3.32Å; I159-H161 PolarHBondContact O-N 3.47Å; I159-H161 VanDerWaalsContact O-N 3.1Å | ||
| 160 | S | 50.4 | Low | 51.8 | Low | 101 Ų | 101 | 130.7 Ų | 130.7 | 71% | 0.706 | 77% | 0.774 | S | S | * | * | trans | -73.8 | 94.5 | 177.6 | 43.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 161 | H | 51.8 | Low | 51.6 | Low | 169 Ų | 169 | 133.8 Ų | 133.8 | 78% | 0.782 | 77% | 0.774 | S | S | * | * | trans | -123.4 | 39.4 | 155.3 | -135.2 | 66.6 | 0 | 0 | 0 | 112.8 | I159 C163 | I159-H161 PolarHBondContact O-N 3.47Å; I159-H161 VanDerWaalsContact O-N 3.1Å; H161-C163 PolarHBondContact O-N 3.08Å | ||
| 162 | F | 44.9 | Very low | 51.8 | Low | 178 Ų | 178 | 136.3 Ų | 136.3 | 78% | 0.781 | 78% | 0.777 | S | S | * | * | trans | -79.5 | 98.7 | 163.9 | -173.1 | -109.9 | 0 | 0 | 0 | 108.4 | P164 | F162-P164 HydrophobicContact CD1-CB 4.12Å; F162-P164 HydrophobicContact CD1-CG 3.97Å; F162-P164 HydrophobicContact CE1-CB 3.6Å; F162-P164 HydrophobicContact CE1-CG 3.78Å; F162-P164 HydrophobicContact CZ-CB 3.94Å; F162-P164 WeakPolarHBondContact O-CD 3.4Å | ||
| 163 | C | 49.1 | Very low | 52.3 | Low | 107 Ų | 107 | 139.9 Ų | 139.9 | 72% | 0.723 | 77% | 0.774 | S | S | * | * | trans | -98.2 | 96.9 | 165.4 | -71.8 | 0 | 0 | 0 | 0 | 108.6 | H161 | H161-C163 PolarHBondContact O-N 3.08Š| ||
| 164 | P | 46.8 | Very low | 53.5 | Low | 77 Ų | 77 | 145.3 Ų | 145.3 | 50% | 0.5 | 78% | 0.781 | S | S | . | * | trans | -86.6 | 172.4 | -179.8 | 36.2 | -37.5 | 0 | 0 | 0 | 112.9 | F162 | F162-P164 HydrophobicContact CD1-CB 4.12Å; F162-P164 HydrophobicContact CD1-CG 3.97Å; F162-P164 HydrophobicContact CE1-CB 3.6Å; F162-P164 HydrophobicContact CE1-CG 3.78Å; F162-P164 HydrophobicContact CZ-CB 3.94Å; F162-P164 WeakPolarHBondContact O-CD 3.4Å | ||
| 165 | L | 50.9 | Low | 55.1 | Low | 164 Ų | 164 | 147.6 Ų | 147.6 | 86% | 0.859 | 78% | 0.776 | S | S | * | * | trans | 75.2 | 71.2 | 168 | -48.1 | -176.2 | 0 | 0 | 0 | 116.7 | ||||
| 166 | D | 57.1 | Low | 56.1 | Low | 164 Ų | 164 | 151 Ų | 151 | 88% | 0.877 | 78% | 0.782 | S | S | * | * | trans | -118.2 | 138.4 | 152.5 | -84.5 | -51.4 | 0 | 0 | 0 | 109.8 | ||||
| 167 | D | 59.4 | Low | 57.6 | Low | 121 Ų | 121 | 155.7 Ų | 155.7 | 65% | 0.647 | 78% | 0.779 | S | S | * | * | trans | -40.5 | 151 | -163.9 | -70.9 | -72.4 | 0 | 0 | 0 | 120.7 | N169 S170 | D167-N169 HydrophobicContact CB-CB 4.4Å; D167-N169 PolarHBondContact O-N 2.81Å; D167-S170 PolarHBondContact O-N 3.25Å; D167-S170 PolarHBondContact O-OG 3.04Å | ||
| 168 | P | 60.2 | Low | 58.8 | Low | 135 Ų | 135 | 154.3 Ų | 154.3 | 88% | 0.877 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.5 | 0.4 | 167.3 | 31.2 | -36.1 | 0 | 0 | 0 | 114.3 | S170 | P168-S170 PolarHBondContact O-N 3.4Š|
| 169 | N | 52.6 | Low | 60.7 | Low | 123 Ų | 123 | 154.1 Ų | 154.1 | 66% | 0.658 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.2 | 16.8 | 171.6 | -159.4 | 2.2 | 0 | 0 | 0 | 112.8 | D167 K171 | D167-N169 HydrophobicContact CB-CB 4.4Å; D167-N169 PolarHBondContact O-N 2.81Å; N169-K171 PolarHBondContact O-N 3.35Å |
| 170 | S | 58.9 | Low | 61.8 | Low | 87 Ų | 87 | 152.4 Ų | 152.4 | 61% | 0.608 | 75% | 0.752 | S | S | * | * | trans | -69.6 | 66.5 | 173.2 | 45.8 | 0 | 0 | 0 | 0 | 112.5 | D167 P168 K172 | D167-S170 PolarHBondContact O-N 3.25Å; D167-S170 PolarHBondContact O-OG 3.04Å; P168-S170 PolarHBondContact O-N 3.4Å; S170-K172 PolarHBondContact O-N 3.38Å | ||
| 171 | K | 55.7 | Low | 63.2 | Low | 175 Ų | 175 | 157.6 Ų | 157.6 | 76% | 0.761 | 76% | 0.756 | S | S | * | * | trans | -46.6 | 119.1 | 162.7 | -71.5 | 174.8 | -175.9 | 168 | 0 | 107.6 | N169 M173 | N169-K171 PolarHBondContact O-N 3.35Å; K171-M173 PolarHBondContact O-N 3Å | ||
| 172 | K | 60.3 | Low | 64.9 | Low | 215 Ų | 215 | 158.2 Ų | 158.2 | 94% | 0.935 | 76% | 0.756 | S | S | * | * | trans | -69.2 | 63.3 | -174.6 | -67.9 | 179.7 | 178.7 | 175.6 | 0 | 112 | S170 R174 | S170-K172 PolarHBondContact O-N 3.38Å; K172-R174 PolarHBondContact O-N 3.48Å | ||
| 173 | M | 56.8 | Low | 67 | Low | 158 Ų | 158 | 153.7 Ų | 153.7 | 78% | 0.778 | 74% | 0.735 | S | S | * | * | trans | -67.4 | 99.4 | 174 | 177.7 | 160.1 | 59 | 0 | 0 | 107.6 | K171 R175 | K171-M173 PolarHBondContact O-N 3Å; M173-R175 PolarHBondContact O-N 3.28Å | ||
| 174 | R | 71.8 | Confident | 68.9 | Low | 231 Ų | 231 | 154.1 Ų | 154.1 | 87% | 0.872 | 73% | 0.73 | S | S | * | * | trans | -42.4 | 111.1 | 169.8 | 176.5 | 179.1 | -180 | 137.6 | 2.7 | 108.4 | K172 K176 | K172-R174 PolarHBondContact O-N 3.48Å; R174-K176 PolarHBondContact O-N 3.31Å; R174-K176 VanDerWaalsContact O-N 3.14Å | ||
| 175 | R | 79.5 | Confident | 71 | Confident | 234 Ų | 234 | 159.2 Ų | 159.2 | 88% | 0.883 | 74% | 0.744 | S | S | * | * | trans | -45 | 124.6 | 177.9 | -69.1 | 178.2 | 179.1 | 154.2 | -0.8 | 107.5 | M173 R177 | M173-R175 PolarHBondContact O-N 3.28Å; R175-R177 PolarHBondContact O-N 3.06Å | ||
| 176 | K | 73.6 | Confident | 73 | Confident | 187 Ų | 187 | 157.4 Ų | 157.4 | 81% | 0.813 | 74% | 0.735 | S | S | * | * | trans | -53.1 | 140.9 | -176 | -74.3 | -74.5 | -175 | 174.5 | 0 | 108.4 | R174 G178 | R174-K176 PolarHBondContact O-N 3.31Å; R174-K176 VanDerWaalsContact O-N 3.14Å; K176-G178 PolarHBondContact O-N 3.31Å | ||
| 177 | R | 73.3 | Confident | 74.8 | Confident | 231 Ų | 231 | 150.5 Ų | 150.5 | 87% | 0.872 | 70% | 0.701 | S | S | * | * | trans | -42.3 | 124.2 | -177.5 | -176.4 | -175.7 | -173.6 | -170.9 | 4.4 | 109.2 | R175 | R175-R177 PolarHBondContact O-N 3.06Š| ||
| 178 | G | 78.4 | Confident | 76.4 | Confident | 62 Ų | 62 | 145.8 Ų | 145.8 | 64% | 0.639 | 68% | 0.676 | S | S | * | * | trans | -54.4 | 161.2 | -172.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | K176 Y180 | K176-G178 PolarHBondContact O-N 3.31Å; G178-Y180 PolarHBondContact O-N 3.14Å | ||
| 179 | Q | 84.2 | Confident | 78 | Confident | 151 Ų | 151 | 141.4 Ų | 141.4 | 71% | 0.706 | 65% | 0.651 | S | S | * | * | trans | -39.2 | 122.3 | -171.2 | 176.4 | 52.3 | 42.8 | 0 | 0 | 112.4 | R181 | Q179-R181 PolarHBondContact O-N 3.42Š| ||
| 180 | Y | 81.3 | Confident | 80 | Confident | 130 Ų | 130 | 139.7 Ų | 139.7 | 51% | 0.51 | 64% | 0.641 | S | S | . | * | trans | -58.5 | 132.5 | 178.6 | -172.5 | -86.8 | 0 | 0 | 0 | 109.7 | G178 K182 Y183 | G178-Y180 PolarHBondContact O-N 3.14Å; Y180-K182 PolarHBondContact O-N 3.23Å; Y180-Y183 HydrophobicContact CE1-CE1 4.36Å | ||
| 181 | R | 81.2 | Confident | 81.8 | Confident | 211 Ų | 211 | 135.6 Ų | 135.6 | 80% | 0.796 | 61% | 0.612 | S | S | * | * | trans | -54.9 | 105.3 | 177.4 | -85.2 | -179.6 | 151 | 155.5 | -6.9 | 109.5 | Q179 | Q179-R181 PolarHBondContact O-N 3.42Š| ||
| 182 | K | 86.8 | Confident | 83.6 | Confident | 182 Ų | 182 | 127.2 Ų | 127.2 | 79% | 0.791 | 58% | 0.576 | S | S | * | * | trans | -69.6 | 137.7 | 171 | -61.1 | -178.1 | -177.7 | 177.7 | 0 | 107.8 | Y180 | Y180-K182 PolarHBondContact O-N 3.23Š| ||
| 183 | Y | 88.8 | Confident | 85.2 | Confident | 82 Ų | 82 | 121.2 Ų | 121.2 | 32% | 0.322 | 55% | 0.551 | S | S | . | * | trans | -125.9 | 142.7 | 171 | 54.9 | -99.1 | 0 | 0 | 0 | 107.8 | Y180 L188 V211 P212 T215 | Y180-Y183 HydrophobicContact CE1-CE1 4.36Å; Y183-L188 HydrophobicContact CD2-CB 4.33Å; Y183-L188 HydrophobicContact CD2-CD2 4.43Å; Y183-L188 HydrophobicContact CE2-CD2 3.92Å; Y183-V211 HydrophobicContact CG-CG1 4.46Å; Y183-P212 HydrophobicContact CD1-CG 4.18Å; Y183-P212 HydrophobicContact CE1-CG 4.49Å; Y183-T215 HydrophobicContact CE1-CG2 4.33Å; Y183-T215 HydrophobicContact CE2-CG2 4.39Å | ||
| 184 | D | 90 | Very high | 87 | Confident | 117 Ų | 117 | 114.1 Ų | 114.1 | 63% | 0.626 | 52% | 0.518 | S | S | * | . | trans | -76.9 | 145.5 | -176.2 | -64.5 | -57.9 | 0 | 0 | 0 | 112.2 | N186 A187 L188 | D184-N186 PolarHBondContact O-N 3.34Å; D184-A187 HydrophobicContact CB-CB 4Å; D184-A187 PolarHBondContact O-N 3.42Å; D184-L188 WeakPolarHBondContact O-CB 3.36Å; D184-L188 PolarHBondContact O-N 3.1Å | ||
| 185 | K | 90.9 | Very high | 88.1 | Confident | 183 Ų | 183 | 104.3 Ų | 104.3 | 80% | 0.796 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -59.1 | -34.8 | 175.6 | -65.5 | 176.9 | -177.8 | 173.6 | 0 | 111.2 | A189 | K185-A189 PolarHBondContact O-N 2.97Å |
| 186 | N | 92.7 | Very high | 88.6 | Confident | 126 Ų | 126 | 97 Ų | 97 | 67% | 0.674 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -74.5 | -46 | 179.3 | -61.5 | -0.7 | 0 | 0 | 0 | 111 | D184 L188 A189 L190 | D184-N186 PolarHBondContact O-N 3.34Å; N186-L188 VanDerWaalsContact C-N 3.31Å; N186-L188 PolarHBondContact O-N 3.35Å; N186-A189 WeakPolarHBondContact O-CA 3.49Å; N186-A189 WeakPolarHBondContact O-CB 3.15Å; N186-A189 PolarHBondContact O-N 2.95Å; N186-L190 WeakPolarHBondContact O-CG 3.3Å; N186-L190 PolarHBondContact O-N 3.44Å |
| 187 | A | 93.9 | Very high | 89.4 | Confident | 19 Ų | 19 | 95.8 Ų | 95.8 | 16% | 0.157 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -58.1 | -41.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | D184 A189 L190 A191 | D184-A187 HydrophobicContact CB-CB 4Å; D184-A187 PolarHBondContact O-N 3.42Å; A187-A189 VanDerWaalsContact C-N 3.34Å; A187-A189 PolarHBondContact O-N 2.92Å; A187-L190 PolarHBondContact O-N 3.17Å; A187-A191 WeakPolarHBondContact O-CB 3.33Å; A187-A191 PolarHBondContact O-N 3.06Å |
| 188 | L | 93.9 | Very high | 90.3 | Very high | 22 Ų | 22 | 87.7 Ų | 87.7 | 12% | 0.115 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -63.9 | -34.7 | 172.4 | 176.4 | 64.4 | 0 | 0 | 0 | 113.2 | Y183 D184 N186 V192 V211 T215 L216 K219 | Y183-L188 HydrophobicContact CD2-CB 4.33Å; Y183-L188 HydrophobicContact CD2-CD2 4.43Å; Y183-L188 HydrophobicContact CE2-CD2 3.92Å; D184-L188 WeakPolarHBondContact O-CB 3.36Å; D184-L188 PolarHBondContact O-N 3.1Å; N186-L188 VanDerWaalsContact C-N 3.31Å; N186-L188 PolarHBondContact O-N 3.35Å; L188-V192 HydrophobicContact CD1-CG2 4.11Å; L188-V192 VanDerWaalsContact O-CG2 3.28Å; L188-V192 WeakPolarHBondContact O-CG2 3.29Å; L188-V192 PolarHBondContact O-N 3.36Å; L188-V211 HydrophobicContact CB-CG2 4.45Å; L188-V211 HydrophobicContact CD1-CG1 3.82Å; L188-T215 HydrophobicContact CD1-CG2 4.18Å; L188-L216 HydrophobicContact CD1-CD2 3.74Å; L188-K219 HydrophobicContact CD1-CB 4.35Å; L188-K219 HydrophobicContact CD1-CG 4.18Å; L188-K219 HydrophobicContact CD2-CG 4.47Å |
| 189 | A | 93.5 | Very high | 91 | Very high | 43 Ų | 43 | 90.1 Ų | 90.1 | 36% | 0.355 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -67.6 | -48.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | K185 N186 A187 Q193 | K185-A189 PolarHBondContact O-N 2.97Å; N186-A189 WeakPolarHBondContact O-CA 3.49Å; N186-A189 WeakPolarHBondContact O-CB 3.15Å; N186-A189 PolarHBondContact O-N 2.95Å; A187-A189 VanDerWaalsContact C-N 3.34Å; A187-A189 PolarHBondContact O-N 2.92Å; A189-Q193 WeakPolarHBondContact O-CB 3.43Å; A189-Q193 PolarHBondContact O-N 2.78Å |
| 190 | L | 94.8 | Very high | 91.5 | Very high | 88 Ų | 88 | 84.8 Ų | 84.8 | 46% | 0.461 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -62.4 | -49.6 | 177 | -66.1 | 172.8 | 0 | 0 | 0 | 111.7 | N186 A187 V192 Q193 S194 Y209 | N186-L190 WeakPolarHBondContact O-CG 3.3Å; N186-L190 PolarHBondContact O-N 3.44Å; A187-L190 PolarHBondContact O-N 3.17Å; L190-V192 VanDerWaalsContact C-N 3.32Å; L190-V192 PolarHBondContact O-N 3.5Å; L190-Q193 CarbonylContact O-C 3.59Å; L190-Q193 WeakPolarHBondContact O-CA 3.41Å; L190-Q193 WeakPolarHBondContact O-CB 3.39Å; L190-Q193 PolarHBondContact O-N 3.02Å; L190-S194 PolarHBondContact O-N 3.25Å; L190-Y209 HydrophobicContact CB-CD1 4.23Å; L190-Y209 HydrophobicContact CB-CE1 3.63Å; L190-Y209 HydrophobicContact CD1-CE1 4.22Å |
| 191 | A | 95.4 | Very high | 92.1 | Very high | 0 Ų | 0 | 81.9 Ų | 81.9 | 0% | 0 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -53.3 | -47.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | A187 Q193 V195 Y209 V211 L216 | A187-A191 WeakPolarHBondContact O-CB 3.33Å; A187-A191 PolarHBondContact O-N 3.06Å; A191-Q193 VanDerWaalsContact C-N 3.31Å; A191-Q193 PolarHBondContact O-N 2.67Å; A191-V195 VanDerWaalsContact O-CG2 3.25Å; A191-V195 WeakPolarHBondContact O-CG2 3.19Å; A191-V195 PolarHBondContact O-N 3.14Å; A191-V195 VanDerWaalsContact O-N 3.14Å; A191-Y209 VanDerWaalsContact CA-CE2 3.45Å; A191-Y209 HydrophobicContact CB-CD2 3.35Å; A191-Y209 HydrophobicContact CB-CE2 4.01Å; A191-Y209 HydrophobicContact CB-CG 3.73Å; A191-V211 HydrophobicContact CB-CG2 4.35Å; A191-L216 HydrophobicContact CB-CD1 4.08Å; A191-L216 HydrophobicContact CB-CD2 3.53Å; A191-L216 HydrophobicContact CB-CG 4.48Å |
| 192 | V | 94.3 | Very high | 92.7 | Very high | 0 Ų | 0 | 73.4 Ų | 73.4 | 0% | 0 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -70.9 | -28.8 | 177.5 | 178.3 | 0 | 0 | 0 | 0 | 111.2 | L188 L190 R196 L216 K219 V220 R223 | L188-V192 HydrophobicContact CD1-CG2 4.11Å; L188-V192 VanDerWaalsContact O-CG2 3.28Å; L188-V192 WeakPolarHBondContact O-CG2 3.29Å; L188-V192 PolarHBondContact O-N 3.36Å; L190-V192 VanDerWaalsContact C-N 3.32Å; L190-V192 PolarHBondContact O-N 3.5Å; V192-R196 WeakPolarHBondContact O-CB 3.42Å; V192-R196 WeakPolarHBondContact O-CD 3.06Å; V192-R196 WeakPolarHBondContact O-CG 3.3Å; V192-R196 PolarHBondContact O-N 2.7Å; V192-L216 HydrophobicContact CG2-CD2 3.79Å; V192-K219 WeakPolarHBondContact CG1-O 3.19Å; V192-K219 HydrophobicContact CG2-CB 3.73Å; V192-V220 HydrophobicContact CB-CG2 4.44Å; V192-V220 HydrophobicContact CG1-CG2 4.04Å; V192-V220 HydrophobicContact CG2-CG2 4.24Å; V192-R223 VanDerWaalsContact CG1-CZ 3.45Å; V192-R223 VanDerWaalsContact CG1-NH1 3.3Å |
| 193 | Q | 93.7 | Very high | 93.1 | Very high | 88 Ų | 88 | 70.4 Ų | 70.4 | 41% | 0.411 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -69.6 | -49.1 | 174.7 | -177 | 168.9 | -1.9 | 0 | 0 | 112 | A189 L190 A191 V195 R196 R197 | A189-Q193 WeakPolarHBondContact O-CB 3.43Å; A189-Q193 PolarHBondContact O-N 2.78Å; L190-Q193 CarbonylContact O-C 3.59Å; L190-Q193 WeakPolarHBondContact O-CA 3.41Å; L190-Q193 WeakPolarHBondContact O-CB 3.39Å; L190-Q193 PolarHBondContact O-N 3.02Å; A191-Q193 VanDerWaalsContact C-N 3.31Å; A191-Q193 PolarHBondContact O-N 2.67Å; Q193-V195 PolarHBondContact O-N 3.02Å; Q193-R196 CarbonylContact O-C 3.55Å; Q193-R196 WeakPolarHBondContact O-CA 3.16Å; Q193-R196 WeakPolarHBondContact O-CB 3.41Å; Q193-R196 PolarHBondContact O-N 2.98Å; Q193-R197 HydrophobicContact CG-CG 4.48Å; Q193-R197 WeakPolarHBondContact O-CG 3.42Å; Q193-R197 PolarHBondContact O-N 2.88Å |
| 194 | S | 94.5 | Very high | 93.5 | Very high | 10 Ų | 10 | 73 Ų | 73 | 7% | 0.07 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -66 | -38.6 | -179.3 | -69.6 | 0 | 0 | 0 | 0 | 113 | L190 R196 R197 G198 E199 Y209 | L190-S194 PolarHBondContact O-N 3.25Å; S194-R196 PolarHBondContact O-N 3.26Å; S194-R197 PolarHBondContact O-N 3.46Å; S194-G198 PolarHBondContact O-N 3.03Å; S194-E199 WeakPolarHBondContact CA-OE2 3.22Å; S194-E199 WeakPolarHBondContact CB-OE2 3.39Å; S194-E199 PolarHBondContact O-N 2.82Å; S194-E199 PolarHBondContact OG-OE2 2.87Å; S194-Y209 PolarHBondContact OG-OH 3.04Å |
| 195 | V | 94.3 | Very high | 93.8 | Very high | 24 Ų | 24 | 67.4 Ų | 67.4 | 15% | 0.145 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -59.8 | -33.3 | 170.6 | 173.9 | 0 | 0 | 0 | 0 | 112.1 | A191 Q193 G198 M200 V202 A205 V220 | A191-V195 VanDerWaalsContact O-CG2 3.25Å; A191-V195 WeakPolarHBondContact O-CG2 3.19Å; A191-V195 PolarHBondContact O-N 3.14Å; A191-V195 VanDerWaalsContact O-N 3.14Å; Q193-V195 PolarHBondContact O-N 3.02Å; V195-G198 PolarHBondContact O-N 3.33Å; V195-M200 WeakPolarHBondContact CA-O 3.37Å; V195-M200 HydrophobicContact CG2-CG 4.3Å; V195-V202 HydrophobicContact CG1-CG2 3.83Å; V195-A205 HydrophobicContact CG2-CB 3.41Å; V195-A205 VanDerWaalsContact CG2-CB 3.41Å; V195-V220 HydrophobicContact CB-CG2 4.13Å; V195-V220 HydrophobicContact CG1-CG1 4.01Å; V195-V220 HydrophobicContact CG1-CG2 3.78Å |
| 196 | R | 90.6 | Very high | 94 | Very high | 80 Ų | 80 | 58.8 Ų | 58.8 | 30% | 0.302 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -81.9 | -25.7 | 178.4 | -75.2 | 168.3 | 145.2 | -136.1 | -16.7 | 114.5 | V192 Q193 S194 R223 N224 | V192-R196 WeakPolarHBondContact O-CB 3.42Å; V192-R196 WeakPolarHBondContact O-CD 3.06Å; V192-R196 WeakPolarHBondContact O-CG 3.3Å; V192-R196 PolarHBondContact O-N 2.7Å; Q193-R196 CarbonylContact O-C 3.55Å; Q193-R196 WeakPolarHBondContact O-CA 3.16Å; Q193-R196 WeakPolarHBondContact O-CB 3.41Å; Q193-R196 PolarHBondContact O-N 2.98Å; S194-R196 PolarHBondContact O-N 3.26Å; R196-R223 PolarHBondContact NH2-O 3.03Å; R196-N224 VanDerWaalsContact CZ-OD1 3.26Å; R196-N224 PolarHBondContact NE-OD1 3.36Å; R196-N224 VanDerWaalsContact NH2-N 3.19Å; R196-N224 PolarHBondContact NH2-OD1 3.32Å |
| 197 | R | 90.6 | Very high | 94.1 | Very high | 162 Ų | 162 | 57.1 Ų | 57.1 | 61% | 0.611 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -74 | -13.8 | 169.2 | -69.3 | 177.5 | 178 | -97.8 | 12.9 | 112 | Q193 S194 E199 | Q193-R197 HydrophobicContact CG-CG 4.48Å; Q193-R197 WeakPolarHBondContact O-CG 3.42Å; Q193-R197 PolarHBondContact O-N 2.88Å; S194-R197 PolarHBondContact O-N 3.46Å; R197-E199 VanDerWaalsContact C-N 3.3Å; R197-E199 HydrophobicContact CB-CG 3.76Å; R197-E199 WeakPolarHBondContact CD-OE1 3.25Å; R197-E199 WeakPolarHBondContact CD-OE2 3.37Å; R197-E199 IonicContact NE-OE1 2.73Å |
| 198 | G | 92.7 | Very high | 94.2 | Very high | 62 Ų | 62 | 62.9 Ų | 62.9 | 64% | 0.639 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84 | 0.5 | -173.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | S194 V195 M200 | S194-G198 PolarHBondContact O-N 3.03Å; V195-G198 PolarHBondContact O-N 3.33Å; G198-M200 PolarHBondContact O-N 3.31Å; G198-M200 VanDerWaalsContact O-N 3.16Å |
| 199 | E | 93.5 | Very high | 94.2 | Very high | 113 Ų | 113 | 64.2 Ų | 64.2 | 53% | 0.528 | 33% | 0.334 | S | S | . | . | S | Bend | trans | -62.2 | -23.4 | -176.7 | -66.6 | 167.6 | 167.6 | 0 | 0 | 113.4 | S194 R197 | S194-E199 WeakPolarHBondContact CA-OE2 3.22Å; S194-E199 WeakPolarHBondContact CB-OE2 3.39Å; S194-E199 PolarHBondContact O-N 2.82Å; S194-E199 PolarHBondContact OG-OE2 2.87Å; R197-E199 VanDerWaalsContact C-N 3.3Å; R197-E199 HydrophobicContact CB-CG 3.76Å; R197-E199 WeakPolarHBondContact CD-OE1 3.25Å; R197-E199 WeakPolarHBondContact CD-OE2 3.37Å; R197-E199 IonicContact NE-OE1 2.73Å |
| 200 | M | 93 | Very high | 94.3 | Very high | 39 Ų | 39 | 64.5 Ų | 64.5 | 19% | 0.192 | 34% | 0.34 | C | S | . | . | S | Bend | trans | -161.6 | 151 | -178 | 52.6 | -179.6 | 77.5 | 0 | 0 | 112.6 | V195 G198 K204 A205 F208 Y209 | V195-M200 WeakPolarHBondContact CA-O 3.37Å; V195-M200 HydrophobicContact CG2-CG 4.3Å; G198-M200 PolarHBondContact O-N 3.31Å; G198-M200 VanDerWaalsContact O-N 3.16Å; M200-K204 HydrophobicContact CB-CB 4.31Å; M200-K204 HydrophobicContact CB-CG 4.22Å; M200-A205 HydrophobicContact CG-CB 3.94Å; M200-A205 VanDerWaalsContact SD-CA 3.53Å; M200-A205 HydrophobicContact SD-CB 3.48Å; M200-A205 WeakPolarHBondContact SD-CB 3.35Å; M200-F208 HydrophobicContact CE-CD1 4.33Å; M200-Y209 HydrophobicContact CE-CE2 3.91Å; M200-Y209 HydrophobicContact SD-CD2 4.25Å; M200-Y209 HydrophobicContact SD-CE2 3.61Å |
| 201 | S | 95 | Very high | 94.2 | Very high | 68 Ų | 68 | 60.4 Ų | 60.4 | 48% | 0.476 | 32% | 0.319 | S | S | . | . | trans | -71.7 | 158.2 | 172.3 | 72.3 | 0 | 0 | 0 | 0 | 112.1 | H203 K204 A205 | S201-H203 PolarHBondContact O-N 2.64Å; S201-K204 PolarHBondContact O-N 3.48Å; S201-K204 VanDerWaalsContact O-N 3.11Å; S201-K204 PolarHBondContact OG-N 3.4Å; S201-A205 WeakPolarHBondContact O-CB 3.49Å; S201-A205 PolarHBondContact O-N 3.04Å | ||
| 202 | V | 93.7 | Very high | 94.1 | Very high | 33 Ų | 33 | 62 Ų | 62 | 20% | 0.2 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -51.5 | -41.7 | 176.7 | 180 | 0 | 0 | 0 | 0 | 112 | V195 G206 L216 E217 | V195-V202 HydrophobicContact CG1-CG2 3.83Å; V202-G206 PolarHBondContact O-N 2.87Å; V202-L216 HydrophobicContact CG1-CB 3.81Å; V202-E217 HydrophobicContact CG1-CG 3.76Å |
| 203 | H | 95.8 | Very high | 94.1 | Very high | 120 Ų | 120 | 65.2 Ų | 65.2 | 56% | 0.556 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -64.3 | -50.7 | 177 | -62.3 | 99.4 | 0 | 0 | 0 | 112 | S201 A205 G206 S207 H213 | S201-H203 PolarHBondContact O-N 2.64Å; H203-A205 VanDerWaalsContact C-N 3.34Å; H203-A205 PolarHBondContact O-N 3.37Å; H203-G206 PolarHBondContact O-N 2.99Å; H203-S207 PolarHBondContact O-N 3.5Å; H203-H213 AromaticContact CD2-CD2 3.61Å; H203-H213 PolarHBondContact O-CE1 2.89Å |
| 204 | K | 96.6 | Very high | 94 | Very high | 135 Ų | 135 | 65 Ų | 65 | 59% | 0.587 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -61.5 | -43.1 | 179.2 | -177.1 | 66.1 | 173.2 | -174.6 | 0 | 111.2 | M200 S201 G206 S207 F208 | M200-K204 HydrophobicContact CB-CB 4.31Å; M200-K204 HydrophobicContact CB-CG 4.22Å; S201-K204 PolarHBondContact O-N 3.48Å; S201-K204 VanDerWaalsContact O-N 3.11Å; S201-K204 PolarHBondContact OG-N 3.4Å; K204-G206 PolarHBondContact O-N 3.33Å; K204-S207 PolarHBondContact O-N 3.12Å; K204-F208 VanDerWaalsContact O-CB 3.31Å; K204-F208 WeakPolarHBondContact O-CB 3.35Å; K204-F208 PolarHBondContact O-N 3.32Å |
| 205 | A | 96 | Very high | 93.9 | Very high | 0 Ų | 0 | 65.4 Ų | 65.4 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -62 | -40.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | V195 M200 S201 H203 S207 F208 Y209 L216 | V195-A205 HydrophobicContact CG2-CB 3.41Å; V195-A205 VanDerWaalsContact CG2-CB 3.41Å; M200-A205 HydrophobicContact CG-CB 3.94Å; M200-A205 VanDerWaalsContact SD-CA 3.53Å; M200-A205 HydrophobicContact SD-CB 3.48Å; M200-A205 WeakPolarHBondContact SD-CB 3.35Å; S201-A205 WeakPolarHBondContact O-CB 3.49Å; S201-A205 PolarHBondContact O-N 3.04Å; H203-A205 VanDerWaalsContact C-N 3.34Å; H203-A205 PolarHBondContact O-N 3.37Å; A205-S207 PolarHBondContact O-N 2.96Å; A205-F208 PolarHBondContact O-N 3.09Å; A205-Y209 HydrophobicContact CB-CD2 4.42Å; A205-Y209 WeakPolarHBondContact O-CD2 3.39Å; A205-Y209 PolarHBondContact O-N 2.97Å; A205-L216 HydrophobicContact CB-CD1 3.75Å |
| 206 | G | 95 | Very high | 93.9 | Very high | 3 Ų | 3 | 64.2 Ų | 64.2 | 3% | 0.031 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -65.2 | -39.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | V202 H203 K204 G210 V211 L216 | V202-G206 PolarHBondContact O-N 2.87Å; H203-G206 PolarHBondContact O-N 2.99Å; K204-G206 PolarHBondContact O-N 3.33Å; G206-G210 CarbonylContact O-C 3.4Å; G206-G210 WeakPolarHBondContact O-CA 3.22Å; G206-G210 PolarHBondContact O-N 3.01Å; G206-V211 CarbonylContact C-O 3.55Å; G206-V211 WeakPolarHBondContact CA-O 3.31Å; G206-V211 PolarHBondContact O-N 3.15Å; G206-V211 VanDerWaalsContact O-O 3.08Å; G206-L216 VanDerWaalsContact CA-CD1 3.42Å; G206-L216 VanDerWaalsContact N-CD1 3.27Å |
| 207 | S | 95.1 | Very high | 94 | Very high | 91 Ų | 91 | 64.6 Ų | 64.6 | 64% | 0.636 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -70.2 | -41.8 | 173 | -59 | 0 | 0 | 0 | 0 | 112.2 | H203 K204 A205 | H203-S207 PolarHBondContact O-N 3.5Å; K204-S207 PolarHBondContact O-N 3.12Å; A205-S207 PolarHBondContact O-N 2.96Å |
| 208 | F | 95.3 | Very high | 94 | Very high | 140 Ų | 140 | 63 Ų | 63 | 61% | 0.614 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -68.5 | -42.8 | -176 | -171.7 | -96 | 0 | 0 | 0 | 113.5 | M200 K204 A205 | M200-F208 HydrophobicContact CE-CD1 4.33Å; K204-F208 VanDerWaalsContact O-CB 3.31Å; K204-F208 WeakPolarHBondContact O-CB 3.35Å; K204-F208 PolarHBondContact O-N 3.32Å; A205-F208 PolarHBondContact O-N 3.09Å |
| 209 | Y | 95.6 | Very high | 93.9 | Very high | 50 Ų | 50 | 63.8 Ų | 63.8 | 20% | 0.196 | 33% | 0.333 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.2 | 7.6 | -179.4 | -65.8 | -75.4 | 0 | 0 | 0 | 113.8 | L190 A191 S194 M200 A205 V211 | L190-Y209 HydrophobicContact CB-CD1 4.23Å; L190-Y209 HydrophobicContact CB-CE1 3.63Å; L190-Y209 HydrophobicContact CD1-CE1 4.22Å; A191-Y209 VanDerWaalsContact CA-CE2 3.45Å; A191-Y209 HydrophobicContact CB-CD2 3.35Å; A191-Y209 HydrophobicContact CB-CE2 4.01Å; A191-Y209 HydrophobicContact CB-CG 3.73Å; S194-Y209 PolarHBondContact OG-OH 3.04Å; M200-Y209 HydrophobicContact CE-CE2 3.91Å; M200-Y209 HydrophobicContact SD-CD2 4.25Å; M200-Y209 HydrophobicContact SD-CE2 3.61Å; A205-Y209 HydrophobicContact CB-CD2 4.42Å; A205-Y209 WeakPolarHBondContact O-CD2 3.39Å; A205-Y209 PolarHBondContact O-N 2.97Å; Y209-V211 PolarHBondContact O-N 3.39Å |
| 210 | G | 94.6 | Very high | 93.7 | Very high | 48 Ų | 48 | 59.2 Ų | 59.2 | 50% | 0.495 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 66.3 | 13.3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | G206 | G206-G210 CarbonylContact O-C 3.4Å; G206-G210 WeakPolarHBondContact O-CA 3.22Å; G206-G210 PolarHBondContact O-N 3.01Å |
| 211 | V | 92.9 | Very high | 93.3 | Very high | 3 Ų | 3 | 64.4 Ų | 64.4 | 2% | 0.018 | 34% | 0.335 | C | S | . | . | trans | -90.1 | 129.6 | -175.6 | -172.1 | 0 | 0 | 0 | 0 | 110.7 | Y183 L188 A191 G206 Y209 H213 T215 L216 | Y183-V211 HydrophobicContact CG-CG1 4.46Å; L188-V211 HydrophobicContact CB-CG2 4.45Å; L188-V211 HydrophobicContact CD1-CG1 3.82Å; A191-V211 HydrophobicContact CB-CG2 4.35Å; G206-V211 CarbonylContact C-O 3.55Å; G206-V211 WeakPolarHBondContact CA-O 3.31Å; G206-V211 PolarHBondContact O-N 3.15Å; G206-V211 VanDerWaalsContact O-O 3.08Å; Y209-V211 PolarHBondContact O-N 3.39Å; V211-H213 PolarHBondContact O-N 3.36Å; V211-T215 HydrophobicContact CG1-CG2 4.04Å; V211-L216 HydrophobicContact CB-CD1 4.2Å; V211-L216 HydrophobicContact CB-CD2 4Å; V211-L216 HydrophobicContact CB-CG 3.93Å; V211-L216 HydrophobicContact CG1-CD2 3.66Å; V211-L216 HydrophobicContact CG1-CG 3.7Å; V211-L216 HydrophobicContact CG2-CD2 4.38Å | ||
| 212 | P | 93.9 | Very high | 91.8 | Very high | 34 Ų | 34 | 64 Ų | 64 | 22% | 0.221 | 33% | 0.325 | C | S | . | . | trans | -54.8 | 133.2 | 175.8 | -25 | 33.9 | 0 | 0 | 0 | 112.4 | Y183 S214 T215 L216 | Y183-P212 HydrophobicContact CD1-CG 4.18Å; Y183-P212 HydrophobicContact CE1-CG 4.49Å; P212-S214 PolarHBondContact O-N 2.9Å; P212-T215 WeakPolarHBondContact O-CA 3.09Å; P212-T215 VanDerWaalsContact O-CB 3.23Å; P212-T215 WeakPolarHBondContact O-CB 3.13Å; P212-T215 PolarHBondContact O-N 3.47Å; P212-L216 PolarHBondContact O-N 3.23Å | ||
| 213 | H | 93.7 | Very high | 90.1 | Very high | 67 Ų | 67 | 65.5 Ų | 65.5 | 31% | 0.31 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -53.5 | -48.2 | -173.6 | -64.5 | -5.8 | 0 | 0 | 0 | 112.9 | H203 V211 T215 L216 E217 | H203-H213 AromaticContact CD2-CD2 3.61Å; H203-H213 PolarHBondContact O-CE1 2.89Å; V211-H213 PolarHBondContact O-N 3.36Å; H213-T215 PolarHBondContact O-N 3.48Å; H213-T215 VanDerWaalsContact O-N 3.12Å; H213-L216 CarbonylContact O-C 3.44Å; H213-L216 WeakPolarHBondContact O-CA 3.14Å; H213-L216 WeakPolarHBondContact O-CB 3.26Å; H213-L216 PolarHBondContact O-N 2.97Å; H213-E217 VanDerWaalsContact C-OE1 3.31Å; H213-E217 WeakPolarHBondContact O-CG 3.47Å; H213-E217 PolarHBondContact O-N 3.01Å |
| 214 | S | 91.2 | Very high | 88.2 | Confident | 82 Ų | 82 | 64 Ų | 64 | 57% | 0.573 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -59.5 | -25.5 | 176.3 | 57.7 | 0 | 0 | 0 | 0 | 114.2 | P212 E217 Y218 | P212-S214 PolarHBondContact O-N 2.9Å; S214-E217 WeakPolarHBondContact CA-OE1 3.43Å; S214-E217 PolarHBondContact N-OE1 3.16Å; S214-Y218 WeakPolarHBondContact O-CB 3.32Å; S214-Y218 PolarHBondContact O-N 2.96Å |
| 215 | T | 93.7 | Very high | 86.2 | Confident | 19 Ų | 19 | 63.7 Ų | 63.7 | 12% | 0.117 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -74.7 | -37.3 | 172.5 | -57.2 | 0 | 0 | 0 | 0 | 111.1 | Y183 L188 V211 P212 H213 K219 | Y183-T215 HydrophobicContact CE1-CG2 4.33Å; Y183-T215 HydrophobicContact CE2-CG2 4.39Å; L188-T215 HydrophobicContact CD1-CG2 4.18Å; V211-T215 HydrophobicContact CG1-CG2 4.04Å; P212-T215 WeakPolarHBondContact O-CA 3.09Å; P212-T215 VanDerWaalsContact O-CB 3.23Å; P212-T215 WeakPolarHBondContact O-CB 3.13Å; P212-T215 PolarHBondContact O-N 3.47Å; H213-T215 PolarHBondContact O-N 3.48Å; H213-T215 VanDerWaalsContact O-N 3.12Å; T215-K219 VanDerWaalsContact O-CB 3.31Å; T215-K219 WeakPolarHBondContact O-CB 3.09Å; T215-K219 WeakPolarHBondContact O-CG 3.3Å; T215-K219 PolarHBondContact O-N 3.42Å |
| 216 | L | 93.8 | Very high | 84.2 | Confident | 0 Ų | 0 | 68.8 Ų | 68.8 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -73 | -45.1 | 173.3 | -67.9 | -175.5 | 0 | 0 | 0 | 112.6 | L188 A191 V192 V202 A205 G206 V211 P212 H213 Y218 K219 V220 | L188-L216 HydrophobicContact CD1-CD2 3.74Å; A191-L216 HydrophobicContact CB-CD1 4.08Å; A191-L216 HydrophobicContact CB-CD2 3.53Å; A191-L216 HydrophobicContact CB-CG 4.48Å; V192-L216 HydrophobicContact CG2-CD2 3.79Å; V202-L216 HydrophobicContact CG1-CB 3.81Å; A205-L216 HydrophobicContact CB-CD1 3.75Å; G206-L216 VanDerWaalsContact CA-CD1 3.42Å; G206-L216 VanDerWaalsContact N-CD1 3.27Å; V211-L216 HydrophobicContact CB-CD1 4.2Å; V211-L216 HydrophobicContact CB-CD2 4Å; V211-L216 HydrophobicContact CB-CG 3.93Å; V211-L216 HydrophobicContact CG1-CD2 3.66Å; V211-L216 HydrophobicContact CG1-CG 3.7Å; V211-L216 HydrophobicContact CG2-CD2 4.38Å; P212-L216 PolarHBondContact O-N 3.23Å; H213-L216 CarbonylContact O-C 3.44Å; H213-L216 WeakPolarHBondContact O-CA 3.14Å; H213-L216 WeakPolarHBondContact O-CB 3.26Å; H213-L216 PolarHBondContact O-N 2.97Å; L216-Y218 VanDerWaalsContact C-N 3.28Å; L216-Y218 PolarHBondContact O-N 2.94Å; L216-K219 CarbonylContact O-C 3.5Å; L216-K219 PolarHBondContact O-N 3.41Å; L216-K219 VanDerWaalsContact O-N 3.11Å; L216-V220 VanDerWaalsContact O-CB 3.31Å; L216-V220 WeakPolarHBondContact O-CB 3.19Å; L216-V220 WeakPolarHBondContact O-CG2 3.35Å; L216-V220 PolarHBondContact O-N 3.24Å |
| 217 | E | 92.1 | Very high | 82.2 | Confident | 88 Ų | 88 | 73.8 Ų | 73.8 | 41% | 0.411 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -50.1 | -51 | 175.1 | -69.6 | 164.4 | -126.4 | 0 | 0 | 110.9 | V202 H213 S214 K221 | V202-E217 HydrophobicContact CG1-CG 3.76Å; H213-E217 VanDerWaalsContact C-OE1 3.31Å; H213-E217 WeakPolarHBondContact O-CG 3.47Å; H213-E217 PolarHBondContact O-N 3.01Å; S214-E217 WeakPolarHBondContact CA-OE1 3.43Å; S214-E217 PolarHBondContact N-OE1 3.16Å; E217-K221 WeakPolarHBondContact O-CB 3.38Å; E217-K221 PolarHBondContact O-N 2.96Å |
| 218 | Y | 91.5 | Very high | 80.3 | Confident | 127 Ų | 127 | 73 Ų | 73 | 50% | 0.498 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -60 | -54.5 | 174.1 | -179.1 | -113.9 | 0 | 0 | 0 | 111.8 | S214 L216 V220 K221 E222 | S214-Y218 WeakPolarHBondContact O-CB 3.32Å; S214-Y218 PolarHBondContact O-N 2.96Å; L216-Y218 VanDerWaalsContact C-N 3.28Å; L216-Y218 PolarHBondContact O-N 2.94Å; Y218-V220 VanDerWaalsContact C-N 3.29Å; Y218-V220 PolarHBondContact O-N 2.76Å; Y218-K221 PolarHBondContact O-N 3.15Å; Y218-E222 HydrophobicContact CD1-CG 4.47Å; Y218-E222 HydrophobicContact CD2-CG 3.49Å; Y218-E222 VanDerWaalsContact CD2-CG 3.49Å; Y218-E222 HydrophobicContact CE1-CG 4.3Å; Y218-E222 HydrophobicContact CE2-CG 3.26Å; Y218-E222 HydrophobicContact CG-CG 4.1Å; Y218-E222 WeakPolarHBondContact O-CB 3.46Å; Y218-E222 VanDerWaalsContact O-CG 3.3Å; Y218-E222 WeakPolarHBondContact O-CG 3.32Å; Y218-E222 PolarHBondContact O-N 2.81Å |
| 219 | K | 90.8 | Very high | 78.6 | Confident | 79 Ų | 79 | 73.4 Ų | 73.4 | 34% | 0.343 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -71.3 | -18.4 | -174.4 | -65.6 | -65.5 | -178.4 | -172.2 | 0 | 114.6 | L188 V192 T215 L216 R223 | L188-K219 HydrophobicContact CD1-CB 4.35Å; L188-K219 HydrophobicContact CD1-CG 4.18Å; L188-K219 HydrophobicContact CD2-CG 4.47Å; V192-K219 WeakPolarHBondContact CG1-O 3.19Å; V192-K219 HydrophobicContact CG2-CB 3.73Å; T215-K219 VanDerWaalsContact O-CB 3.31Å; T215-K219 WeakPolarHBondContact O-CB 3.09Å; T215-K219 WeakPolarHBondContact O-CG 3.3Å; T215-K219 PolarHBondContact O-N 3.42Å; L216-K219 CarbonylContact O-C 3.5Å; L216-K219 PolarHBondContact O-N 3.41Å; L216-K219 VanDerWaalsContact O-N 3.11Å; K219-R223 WeakPolarHBondContact O-CB 3.36Å |
| 220 | V | 88.3 | Confident | 77 | Confident | 18 Ų | 18 | 77.9 Ų | 77.9 | 11% | 0.109 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -80.3 | -53 | 169.6 | 173.2 | 0 | 0 | 0 | 0 | 109.6 | V192 V195 L216 Y218 R223 N224 | V192-V220 HydrophobicContact CB-CG2 4.44Å; V192-V220 HydrophobicContact CG1-CG2 4.04Å; V192-V220 HydrophobicContact CG2-CG2 4.24Å; V195-V220 HydrophobicContact CB-CG2 4.13Å; V195-V220 HydrophobicContact CG1-CG1 4.01Å; V195-V220 HydrophobicContact CG1-CG2 3.78Å; L216-V220 VanDerWaalsContact O-CB 3.31Å; L216-V220 WeakPolarHBondContact O-CB 3.19Å; L216-V220 WeakPolarHBondContact O-CG2 3.35Å; L216-V220 PolarHBondContact O-N 3.24Å; Y218-V220 VanDerWaalsContact C-N 3.29Å; Y218-V220 PolarHBondContact O-N 2.76Å; V220-R223 PolarHBondContact O-N 3.48Å; V220-N224 PolarHBondContact O-N 2.67Å; V220-N224 PolarHBondContact O-OD1 2.98Å |
| 221 | K | 85.1 | Confident | 75.4 | Confident | 147 Ų | 147 | 80.6 Ų | 80.6 | 64% | 0.639 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -58.9 | -58.2 | -178.5 | -172.8 | -178.5 | -63.1 | -177 | 0 | 112.1 | E217 Y218 R223 N224 L225 | E217-K221 WeakPolarHBondContact O-CB 3.38Å; E217-K221 PolarHBondContact O-N 2.96Å; Y218-K221 PolarHBondContact O-N 3.15Å; K221-R223 VanDerWaalsContact C-N 3.32Å; K221-R223 PolarHBondContact O-N 2.74Å; K221-N224 PolarHBondContact O-N 2.88Å; K221-L225 PolarHBondContact O-N 3.27Å |
| 222 | E | 62.2 | Low | 73.9 | Confident | 60 Ų | 60 | 83.2 Ų | 83.2 | 28% | 0.28 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -59.5 | -42.3 | -179.1 | -66 | -50.4 | 133.9 | 0 | 0 | 112.3 | Y218 N224 L225 L226 | Y218-E222 HydrophobicContact CD1-CG 4.47Å; Y218-E222 HydrophobicContact CD2-CG 3.49Å; Y218-E222 VanDerWaalsContact CD2-CG 3.49Å; Y218-E222 HydrophobicContact CE1-CG 4.3Å; Y218-E222 HydrophobicContact CE2-CG 3.26Å; Y218-E222 HydrophobicContact CG-CG 4.1Å; Y218-E222 WeakPolarHBondContact O-CB 3.46Å; Y218-E222 VanDerWaalsContact O-CG 3.3Å; Y218-E222 WeakPolarHBondContact O-CG 3.32Å; Y218-E222 PolarHBondContact O-N 2.81Å; E222-N224 PolarHBondContact O-N 3.31Å; E222-L225 PolarHBondContact O-N 2.86Å; E222-L226 HydrophobicContact CB-CD1 4.3Å; E222-L226 VanDerWaalsContact O-CB 3.31Å; E222-L226 WeakPolarHBondContact O-CB 3.48Å; E222-L226 VanDerWaalsContact O-CG 3.29Å; E222-L226 WeakPolarHBondContact O-CG 3.33Å; E222-L226 PolarHBondContact O-N 3.16Å |
| 223 | R | 58.6 | Low | 72.7 | Confident | 64 Ų | 64 | 85.7 Ų | 85.7 | 24% | 0.242 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -70.2 | -24 | -175.8 | -163.1 | -171.3 | -69.2 | 179.5 | 1.5 | 111.2 | V192 R196 K219 V220 K221 R227 | V192-R223 VanDerWaalsContact CG1-CZ 3.45Å; V192-R223 VanDerWaalsContact CG1-NH1 3.3Å; R196-R223 PolarHBondContact NH2-O 3.03Å; K219-R223 WeakPolarHBondContact O-CB 3.36Å; V220-R223 PolarHBondContact O-N 3.48Å; K221-R223 VanDerWaalsContact C-N 3.32Å; K221-R223 PolarHBondContact O-N 2.74Å; R223-R227 HydrophobicContact CG-CG 4.05Å; R223-R227 WeakPolarHBondContact O-CB 3.27Å; R223-R227 WeakPolarHBondContact O-CG 3.42Å; R223-R227 PolarHBondContact O-N 2.73Å; R223-R227 VanDerWaalsContact O-N 3.17Å |
| 224 | N | 55.4 | Low | 71.4 | Confident | 88 Ų | 88 | 85.1 Ų | 85.1 | 47% | 0.471 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -70.4 | -50.6 | 173.5 | -68.8 | 0.3 | 0 | 0 | 0 | 110.2 | R196 V220 K221 E222 | R196-N224 VanDerWaalsContact CZ-OD1 3.26Å; R196-N224 PolarHBondContact NE-OD1 3.36Å; R196-N224 VanDerWaalsContact NH2-N 3.19Å; R196-N224 PolarHBondContact NH2-OD1 3.32Å; V220-N224 PolarHBondContact O-N 2.67Å; V220-N224 PolarHBondContact O-OD1 2.98Å; K221-N224 PolarHBondContact O-N 2.88Å; E222-N224 PolarHBondContact O-N 3.31Å |
| 225 | L | 55.1 | Low | 70.5 | Confident | 130 Ų | 130 | 84.7 Ų | 84.7 | 68% | 0.681 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -60.5 | -48.1 | 177.3 | -175.4 | 61.9 | 0 | 0 | 0 | 112.4 | K221 E222 | K221-L225 PolarHBondContact O-N 3.27Å; E222-L225 PolarHBondContact O-N 2.86Å |
| 226 | L | 53.9 | Low | 69.3 | Low | 107 Ų | 107 | 86.3 Ų | 86.3 | 56% | 0.56 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -81.4 | -17.7 | -172.9 | -62.3 | 171.8 | 0 | 0 | 0 | 114.2 | E222 K230 | E222-L226 HydrophobicContact CB-CD1 4.3Å; E222-L226 VanDerWaalsContact O-CB 3.31Å; E222-L226 WeakPolarHBondContact O-CB 3.48Å; E222-L226 VanDerWaalsContact O-CG 3.29Å; E222-L226 WeakPolarHBondContact O-CG 3.33Å; E222-L226 PolarHBondContact O-N 3.16Å; L226-K230 PolarHBondContact O-N 3.12Å; L226-K230 VanDerWaalsContact O-N 3.12Å |
| 227 | R | 52.5 | Low | 68.3 | Low | 108 Ų | 108 | 91.9 Ų | 91.9 | 41% | 0.408 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -84.5 | -23.7 | 176.5 | -86.8 | -159.6 | 180 | -172.1 | -2.5 | 114.8 | R223 K229 K230 Q231 | R223-R227 HydrophobicContact CG-CG 4.05Å; R223-R227 WeakPolarHBondContact O-CB 3.27Å; R223-R227 WeakPolarHBondContact O-CG 3.42Å; R223-R227 PolarHBondContact O-N 2.73Å; R223-R227 VanDerWaalsContact O-N 3.17Å; R227-K229 PolarHBondContact O-N 3.19Å; R227-K230 PolarHBondContact O-N 2.92Å; R227-Q231 HydrophobicContact CB-CG 4.21Å; R227-Q231 HydrophobicContact CG-CG 4.49Å; R227-Q231 WeakPolarHBondContact O-CA 3.47Å; R227-Q231 WeakPolarHBondContact O-CB 3.41Å; R227-Q231 VanDerWaalsContact O-CG 3.29Å; R227-Q231 WeakPolarHBondContact O-CG 3.16Å; R227-Q231 PolarHBondContact O-N 3.39Å |
| 228 | A | 55.7 | Low | 67.3 | Low | 75 Ų | 75 | 90.7 Ų | 90.7 | 62% | 0.62 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -54.5 | -47.4 | 171 | 0 | 0 | 0 | 0 | 0 | 109.8 | A232 | A228-A232 WeakPolarHBondContact O-CB 3.41Å; A228-A232 PolarHBondContact O-N 3.17Å; A228-A232 VanDerWaalsContact O-N 3.14Å |
| 229 | K | 59.4 | Low | 66.2 | Low | 147 Ų | 147 | 91 Ų | 91 | 64% | 0.639 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -63.9 | -56 | 172 | -174.4 | 167.3 | 180 | 173.4 | 0 | 113 | R227 Q231 A232 E233 | R227-K229 PolarHBondContact O-N 3.19Å; K229-Q231 VanDerWaalsContact C-N 3.31Å; K229-Q231 PolarHBondContact O-N 3.02Å; K229-A232 WeakPolarHBondContact O-CB 3.3Å; K229-A232 PolarHBondContact O-N 3.2Å; K229-A232 VanDerWaalsContact O-N 3.14Å; K229-E233 WeakPolarHBondContact CE-OE1 3.31Å; K229-E233 VanDerWaalsContact CG-OE1 3.29Å; K229-E233 WeakPolarHBondContact CG-OE1 3.18Å; K229-E233 WeakPolarHBondContact O-CG 3.21Å; K229-E233 PolarHBondContact O-N 3.41Å |
| 230 | K | 62.5 | Low | 64.9 | Low | 144 Ų | 144 | 91.4 Ų | 91.4 | 63% | 0.626 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -69.1 | -21.8 | -175.8 | -172.2 | 155.8 | -176.1 | 159.3 | 0 | 115.1 | L226 R227 E233 A234 | L226-K230 PolarHBondContact O-N 3.12Å; L226-K230 VanDerWaalsContact O-N 3.12Å; R227-K230 PolarHBondContact O-N 2.92Å; K230-E233 WeakPolarHBondContact CA-OE2 3.35Å; K230-A234 WeakPolarHBondContact O-CB 3.29Å; K230-A234 PolarHBondContact O-N 3.22Å |
| 231 | Q | 61.2 | Low | 63.8 | Low | 106 Ų | 106 | 96.3 Ų | 96.3 | 50% | 0.495 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -82 | -31.6 | 172 | -66.4 | -178.6 | -98.3 | 0 | 0 | 111.5 | R227 K229 T235 | R227-Q231 HydrophobicContact CB-CG 4.21Å; R227-Q231 HydrophobicContact CG-CG 4.49Å; R227-Q231 WeakPolarHBondContact O-CA 3.47Å; R227-Q231 WeakPolarHBondContact O-CB 3.41Å; R227-Q231 VanDerWaalsContact O-CG 3.29Å; R227-Q231 WeakPolarHBondContact O-CG 3.16Å; R227-Q231 PolarHBondContact O-N 3.39Å; K229-Q231 VanDerWaalsContact C-N 3.31Å; K229-Q231 PolarHBondContact O-N 3.02Å; Q231-T235 WeakPolarHBondContact O-CB 3.46Å; Q231-T235 VanDerWaalsContact O-CG2 3.3Å; Q231-T235 WeakPolarHBondContact O-CG2 3.29Å; Q231-T235 PolarHBondContact O-N 3.26Å; Q231-T235 PolarHBondContact O-OG1 3.17Å |
| 232 | A | 61.9 | Low | 62.8 | Low | 58 Ų | 58 | 92.9 Ų | 92.9 | 48% | 0.479 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.9 | -48.7 | 165.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | A228 K229 A234 T235 A236 | A228-A232 WeakPolarHBondContact O-CB 3.41Å; A228-A232 PolarHBondContact O-N 3.17Å; A228-A232 VanDerWaalsContact O-N 3.14Å; K229-A232 WeakPolarHBondContact O-CB 3.3Å; K229-A232 PolarHBondContact O-N 3.2Å; K229-A232 VanDerWaalsContact O-N 3.14Å; A232-A234 PolarHBondContact O-N 2.99Å; A232-T235 PolarHBondContact O-N 2.78Å; A232-T235 PolarHBondContact O-OG1 3.49Å; A232-A236 VanDerWaalsContact O-CB 3.25Å; A232-A236 WeakPolarHBondContact O-CB 3.41Å; A232-A236 PolarHBondContact O-N 3.07Å |
| 233 | E | 67.3 | Low | 62.5 | Low | 86 Ų | 86 | 94.9 Ų | 94.9 | 40% | 0.402 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -57.8 | -48.2 | 175.2 | -67.6 | 164.1 | 177.3 | 0 | 0 | 112.3 | K229 K230 A236 N237 | K229-E233 WeakPolarHBondContact CE-OE1 3.31Å; K229-E233 VanDerWaalsContact CG-OE1 3.29Å; K229-E233 WeakPolarHBondContact CG-OE1 3.18Å; K229-E233 WeakPolarHBondContact O-CG 3.21Å; K229-E233 PolarHBondContact O-N 3.41Å; K230-E233 WeakPolarHBondContact CA-OE2 3.35Å; E233-A236 PolarHBondContact O-N 3.01Å; E233-N237 VanDerWaalsContact O-CG 3.29Å; E233-N237 PolarHBondContact O-N 3.32Å; E233-N237 PolarHBondContact O-OD1 2.87Å |
| 234 | A | 67.2 | Low | 62.5 | Low | 55 Ų | 55 | 94.7 Ų | 94.7 | 46% | 0.455 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -68.8 | -36.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | K230 A232 A238 | K230-A234 WeakPolarHBondContact O-CB 3.29Å; K230-A234 PolarHBondContact O-N 3.22Å; A232-A234 PolarHBondContact O-N 2.99Å; A234-A238 WeakPolarHBondContact O-CB 3.25Å; A234-A238 PolarHBondContact O-N 2.94Å |
| 235 | T | 71.5 | Confident | 62.6 | Low | 72 Ų | 72 | 95.8 Ų | 95.8 | 44% | 0.442 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -75.8 | -30.9 | 175.9 | 55.3 | 0 | 0 | 0 | 0 | 112.3 | Q231 A232 K239 | Q231-T235 WeakPolarHBondContact O-CB 3.46Å; Q231-T235 VanDerWaalsContact O-CG2 3.3Å; Q231-T235 WeakPolarHBondContact O-CG2 3.29Å; Q231-T235 PolarHBondContact O-N 3.26Å; Q231-T235 PolarHBondContact O-OG1 3.17Å; A232-T235 PolarHBondContact O-N 2.78Å; A232-T235 PolarHBondContact O-OG1 3.49Å; T235-K239 VanDerWaalsContact O-CB 3.3Å; T235-K239 WeakPolarHBondContact O-CB 3.43Å; T235-K239 WeakPolarHBondContact O-CD 2.98Å; T235-K239 WeakPolarHBondContact O-CG 3.49Å; T235-K239 PolarHBondContact O-N 3.15Å |
| 236 | A | 69.6 | Low | 62.6 | Low | 53 Ų | 53 | 93.9 Ų | 93.9 | 44% | 0.438 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.8 | -48 | 169.7 | 0 | 0 | 0 | 0 | 0 | 111 | A232 E233 A238 K239 S240 | A232-A236 VanDerWaalsContact O-CB 3.25Å; A232-A236 WeakPolarHBondContact O-CB 3.41Å; A232-A236 PolarHBondContact O-N 3.07Å; E233-A236 PolarHBondContact O-N 3.01Å; A236-A238 PolarHBondContact O-N 3.22Å; A236-K239 PolarHBondContact O-N 2.94Å; A236-S240 WeakPolarHBondContact O-CB 3.43Å; A236-S240 PolarHBondContact O-N 2.83Å |
| 237 | N | 72.4 | Confident | 62.6 | Low | 118 Ų | 118 | 95.3 Ų | 95.3 | 63% | 0.631 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.8 | -40.6 | 177.8 | -69.5 | -2.4 | 0 | 0 | 0 | 112.4 | E233 S240 L241 | E233-N237 VanDerWaalsContact O-CG 3.29Å; E233-N237 PolarHBondContact O-N 3.32Å; E233-N237 PolarHBondContact O-OD1 2.87Å; N237-S240 PolarHBondContact O-N 2.72Å; N237-L241 PolarHBondContact O-N 3.37Å |
| 238 | A | 70.3 | Confident | 62.7 | Low | 62 Ų | 62 | 97.4 Ų | 97.4 | 51% | 0.512 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.7 | -39 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A234 A236 L241 V242 | A234-A238 WeakPolarHBondContact O-CB 3.25Å; A234-A238 PolarHBondContact O-N 2.94Å; A236-A238 PolarHBondContact O-N 3.22Å; A238-L241 PolarHBondContact O-N 3.24Å; A238-V242 PolarHBondContact O-N 3.23Å; A238-V242 VanDerWaalsContact O-N 3.08Å |
| 239 | K | 68.7 | Low | 62.5 | Low | 133 Ų | 133 | 98.7 Ų | 98.7 | 58% | 0.578 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -67.1 | -39.4 | 174.5 | -73.7 | 168.9 | -178.1 | -177.5 | 0 | 112.1 | T235 A236 L241 V242 N243 | T235-K239 VanDerWaalsContact O-CB 3.3Å; T235-K239 WeakPolarHBondContact O-CB 3.43Å; T235-K239 WeakPolarHBondContact O-CD 2.98Å; T235-K239 WeakPolarHBondContact O-CG 3.49Å; T235-K239 PolarHBondContact O-N 3.15Å; A236-K239 PolarHBondContact O-N 2.94Å; K239-L241 VanDerWaalsContact C-N 3.32Å; K239-L241 PolarHBondContact O-N 3.41Å; K239-V242 PolarHBondContact O-N 3.24Å; K239-N243 WeakPolarHBondContact O-CB 3.49Å; K239-N243 PolarHBondContact O-N 2.56Å; K239-N243 PolarHBondContact O-OD1 3.4Å |
| 240 | S | 63.6 | Low | 62.1 | Low | 88 Ų | 88 | 96.4 Ų | 96.4 | 62% | 0.615 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -59.4 | -44.4 | 173.7 | -169.8 | 0 | 0 | 0 | 0 | 111.2 | A236 N237 G244 | A236-S240 WeakPolarHBondContact O-CB 3.43Å; A236-S240 PolarHBondContact O-N 2.83Å; N237-S240 PolarHBondContact O-N 2.72Å; S240-G244 PolarHBondContact O-N 3.4Å; S240-G244 VanDerWaalsContact O-N 3.14Å |
| 241 | L | 64.7 | Low | 61.8 | Low | 122 Ų | 122 | 96.3 Ų | 96.3 | 64% | 0.639 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.5 | -43.7 | 179.4 | -165.5 | 70.9 | 0 | 0 | 0 | 112.9 | N237 A238 K239 G244 I245 | N237-L241 PolarHBondContact O-N 3.37Å; A238-L241 PolarHBondContact O-N 3.24Å; K239-L241 VanDerWaalsContact C-N 3.32Å; K239-L241 PolarHBondContact O-N 3.41Å; L241-G244 PolarHBondContact O-N 2.86Å; L241-I245 HydrophobicContact CG-CD1 4.38Å; L241-I245 WeakPolarHBondContact O-CD1 3.23Å; L241-I245 WeakPolarHBondContact O-CG1 3.41Å |
| 242 | V | 64.1 | Low | 61.3 | Low | 75 Ų | 75 | 98.3 Ų | 98.3 | 46% | 0.455 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -69.7 | -39.8 | -179.8 | 79.6 | 0 | 0 | 0 | 0 | 112 | A238 K239 G244 I245 T246 | A238-V242 PolarHBondContact O-N 3.23Å; A238-V242 VanDerWaalsContact O-N 3.08Å; K239-V242 PolarHBondContact O-N 3.24Å; V242-G244 PolarHBondContact O-N 2.89Å; V242-I245 PolarHBondContact O-N 3.38Å; V242-T246 PolarHBondContact O-N 3.01Å |
| 243 | N | 57.4 | Low | 60.5 | Low | 102 Ų | 102 | 104.8 Ų | 104.8 | 55% | 0.545 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -66.7 | -20.8 | 176 | -69.4 | 16.3 | 0 | 0 | 0 | 112.8 | K239 I245 N247 | K239-N243 WeakPolarHBondContact O-CB 3.49Å; K239-N243 PolarHBondContact O-N 2.56Å; K239-N243 PolarHBondContact O-OD1 3.4Å; N243-I245 VanDerWaalsContact C-N 3.34Å; N243-N247 PolarHBondContact O-ND2 3.43Å |
| 244 | G | 57.3 | Low | 59.5 | Low | 59 Ų | 59 | 105.6 Ų | 105.6 | 61% | 0.608 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | -12.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | S240 L241 V242 | S240-G244 PolarHBondContact O-N 3.4Å; S240-G244 VanDerWaalsContact O-N 3.14Å; L241-G244 PolarHBondContact O-N 2.86Å; V242-G244 PolarHBondContact O-N 2.89Å |
| 245 | I | 57.9 | Low | 58.3 | Low | 111 Ų | 111 | 111.9 Ų | 111.9 | 57% | 0.569 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.9 | -29 | -176 | -66.3 | 165.4 | 0 | 0 | 0 | 111.6 | L241 V242 N243 N247 | L241-I245 HydrophobicContact CG-CD1 4.38Å; L241-I245 WeakPolarHBondContact O-CD1 3.23Å; L241-I245 WeakPolarHBondContact O-CG1 3.41Å; V242-I245 PolarHBondContact O-N 3.38Å; N243-I245 VanDerWaalsContact C-N 3.34Å; I245-N247 VanDerWaalsContact C-N 3.35Å; I245-N247 PolarHBondContact O-N 2.7Å |
| 246 | T | 56.3 | Low | 57.2 | Low | 91 Ų | 91 | 114.5 Ų | 114.5 | 56% | 0.558 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.5 | 4.9 | -171.8 | 56.7 | 0 | 0 | 0 | 0 | 115.6 | V242 | V242-T246 PolarHBondContact O-N 3.01Š|
| 247 | N | 53.8 | Low | 55.8 | Low | 137 Ų | 137 | 116.4 Ų | 116.4 | 73% | 0.733 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.5 | 0.2 | -170.9 | -70.6 | -48.8 | 0 | 0 | 0 | 114.6 | N243 I245 | N243-N247 PolarHBondContact O-ND2 3.43Å; I245-N247 VanDerWaalsContact C-N 3.35Å; I245-N247 PolarHBondContact O-N 2.7Å |
| 248 | D | 54 | Low | 54.9 | Low | 152 Ų | 152 | 118.9 Ų | 118.9 | 81% | 0.813 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -143.8 | 35.7 | -167.1 | -149.5 | 9.2 | 0 | 0 | 0 | 111.9 | ||
| 249 | S | 51.9 | Low | 53.7 | Low | 102 Ų | 102 | 121 Ų | 121 | 71% | 0.713 | 70% | 0.7 | S | S | * | * | trans | -131.3 | 34.1 | -173.1 | 60.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 250 | S | 49.5 | Very low | 53.1 | Low | 98 Ų | 98 | 123.8 Ų | 123.8 | 69% | 0.685 | 71% | 0.712 | S | S | * | * | trans | -118.9 | 168 | 155.8 | 64.3 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 251 | I | 56.2 | Low | 52.2 | Low | 143 Ų | 143 | 124.7 Ų | 124.7 | 73% | 0.733 | 72% | 0.718 | S | S | * | * | S | Bend | trans | 81.7 | 88.4 | -178.3 | -47.4 | 169.2 | 0 | 0 | 0 | 114.6 | ||
| 252 | N | 51.2 | Low | 51.8 | Low | 147 Ų | 147 | 129.7 Ų | 129.7 | 79% | 0.786 | 73% | 0.729 | S | S | * | * | trans | 74.6 | 136.6 | 140.4 | -54.2 | -6.7 | 0 | 0 | 0 | 121.2 | S254 | N252-S254 PolarHBondContact O-N 3.33Š| ||
| 253 | E | 44.5 | Very low | 51.5 | Low | 195 Ų | 195 | 131.9 Ų | 131.9 | 91% | 0.911 | 75% | 0.748 | S | S | * | * | trans | -66.4 | 120 | 157 | -61 | -174.2 | 123.1 | 0 | 0 | 110.3 | ||||
| 254 | S | 47.7 | Very low | 51.2 | Low | 102 Ų | 102 | 134.4 Ų | 134.4 | 71% | 0.713 | 76% | 0.76 | S | S | * | * | trans | 179.5 | 120.4 | 137.9 | 31.5 | 0 | 0 | 0 | 0 | 113.5 | N252 V256 | N252-S254 PolarHBondContact O-N 3.33Å; S254-V256 PolarHBondContact O-N 3.38Å | ||
| 255 | H | 40.9 | Very low | 51.1 | Low | 188 Ų | 188 | 141.5 Ų | 141.5 | 87% | 0.87 | 78% | 0.775 | S | S | * | * | trans | 36.8 | 77.8 | 135.5 | -168.1 | -75.2 | 0 | 0 | 0 | 118.3 | ||||
| 256 | V | 48.1 | Very low | 51.2 | Low | 127 Ų | 127 | 141.5 Ų | 141.5 | 77% | 0.77 | 78% | 0.781 | S | S | * | * | trans | -132.9 | 119.1 | 155 | -176 | 0 | 0 | 0 | 0 | 109.7 | S254 | S254-V256 PolarHBondContact O-N 3.38Š| ||
| 257 | A | 40.7 | Very low | 50.9 | Low | 93 Ų | 93 | 143.5 Ų | 143.5 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | -90.7 | 128.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 258 | L | 53.4 | Low | 50.5 | Low | 169 Ų | 169 | 141.2 Ų | 141.2 | 89% | 0.885 | 79% | 0.788 | S | S | * | * | trans | -119.9 | 122.2 | 164.2 | -73.2 | 178.5 | 0 | 0 | 0 | 109.7 | ||||
| 259 | S | 45.6 | Very low | 50.3 | Low | 107 Ų | 107 | 140.9 Ų | 140.9 | 75% | 0.748 | 79% | 0.786 | S | S | * | * | trans | -101.8 | 133 | -166.5 | 46.6 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 260 | F | 57.1 | Low | 49.9 | Very low | 192 Ų | 192 | 141.7 Ų | 141.7 | 84% | 0.842 | 78% | 0.782 | S | S | * | * | trans | -138.3 | 69.6 | 165 | -158.8 | -99.4 | 0 | 0 | 0 | 112 | R262 | F260-R262 PolarHBondContact O-N 3.18Š| ||
| 261 | S | 44.5 | Very low | 49.6 | Very low | 106 Ų | 106 | 144.2 Ų | 144.2 | 74% | 0.741 | 79% | 0.787 | S | S | * | * | trans | -71.9 | 122.7 | -179.7 | -51.1 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 262 | R | 56.8 | Low | 49 | Very low | 227 Ų | 227 | 141.9 Ų | 141.9 | 86% | 0.857 | 79% | 0.789 | S | S | * | * | trans | -154.9 | 79.1 | 158.5 | -113.8 | 161.3 | -157.2 | -151.9 | 3.1 | 114.8 | F260 | F260-R262 PolarHBondContact O-N 3.18Š| ||
| 263 | S | 56.7 | Low | 48.8 | Very low | 122 Ų | 122 | 143.6 Ų | 143.6 | 85% | 0.853 | 79% | 0.792 | S | S | * | * | trans | 37.1 | 125.7 | 145.7 | -144.7 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 264 | L | 50.3 | Low | 49.1 | Very low | 155 Ų | 155 | 142 Ų | 142 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | trans | -78.9 | 159.7 | 173.7 | -55.7 | 166.5 | 0 | 0 | 0 | 113.1 | ||||
| 265 | K | 56.5 | Low | 49.2 | Very low | 208 Ų | 208 | 142.1 Ų | 142.1 | 90% | 0.904 | 79% | 0.789 | S | S | * | * | -150.6 | 124 | 128.5 | -70.1 | -156.2 | 179.2 | -175.2 | 0 | 110.9 | |||||
| 266 | P | 59 | Low | 49.6 | Very low | 110 Ų | 110 | 138.5 Ų | 138.5 | 71% | 0.714 | 78% | 0.78 | S | S | * | * | trans | -101.1 | -152.2 | 173.1 | 39.6 | -32.9 | 0 | 0 | 0 | 111.7 | ||||
| 267 | V | 51.2 | Low | 49.6 | Very low | 133 Ų | 133 | 139 Ų | 139 | 81% | 0.806 | 78% | 0.778 | S | S | * | * | trans | 86.7 | 126.6 | 177.2 | -179 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 268 | S | 45.6 | Very low | 50.5 | Low | 89 Ų | 89 | 142.4 Ų | 142.4 | 62% | 0.622 | 78% | 0.784 | S | S | * | * | cis | -169 | 158.1 | -8.8 | -110.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 269 | L | 48.3 | Very low | 50.3 | Low | 146 Ų | 146 | 139.3 Ų | 139.3 | 76% | 0.764 | 77% | 0.774 | S | S | * | * | trans | 64.6 | 155.6 | 149.2 | -61.2 | 167.6 | 0 | 0 | 0 | 118.2 | ||||
| 270 | D | 43.6 | Very low | 50.5 | Low | 119 Ų | 119 | 142.4 Ų | 142.4 | 64% | 0.636 | 78% | 0.781 | S | S | * | * | cis | -152.2 | 174.3 | 0.2 | -134.3 | -27.1 | 0 | 0 | 0 | 114.8 | ||||
| 271 | L | 44.7 | Very low | 50.2 | Low | 151 Ų | 151 | 142.1 Ų | 142.1 | 79% | 0.791 | 79% | 0.786 | S | S | * | * | trans | 31.1 | 119.8 | 156.4 | -98.9 | 48.2 | 0 | 0 | 0 | 119.9 | ||||
| 272 | A | 43.7 | Very low | 50.5 | Low | 94 Ų | 94 | 140 Ų | 140 | 78% | 0.777 | 78% | 0.782 | S | S | * | * | cis | 99.4 | 170 | 37.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 273 | H | 45.6 | Very low | 50.2 | Low | 183 Ų | 183 | 138.3 Ų | 138.3 | 85% | 0.847 | 78% | 0.781 | S | S | * | * | trans | 91.7 | 152.5 | 172 | -132.9 | -110.6 | 0 | 0 | 0 | 119.5 | ||||
| 274 | I | 51.6 | Low | 50.3 | Low | 160 Ų | 160 | 138.6 Ų | 138.6 | 82% | 0.821 | 78% | 0.777 | S | S | * | * | trans | 69.8 | 129.6 | 178.2 | -46.5 | 166.4 | 0 | 0 | 0 | 115 | ||||
| 275 | S | 48.6 | Very low | 50.7 | Low | 105 Ų | 105 | 135.5 Ų | 135.5 | 73% | 0.734 | 77% | 0.768 | S | S | * | * | cis | -160.6 | 154.4 | -28.8 | -172.7 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 276 | T | 49.7 | Very low | 50.9 | Low | 113 Ų | 113 | 129.9 Ų | 129.9 | 69% | 0.693 | 75% | 0.751 | S | S | * | * | trans | -82.3 | -178.1 | 164.9 | 53.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 277 | D | 48.9 | Very low | 51 | Low | 136 Ų | 136 | 131 Ų | 131 | 73% | 0.727 | 75% | 0.751 | S | S | * | * | trans | 93.3 | 94.6 | 161.6 | -45.1 | -15.8 | 0 | 0 | 0 | 115.9 | ||||
| 278 | D | 58.3 | Low | 51.3 | Low | 165 Ų | 165 | 127.9 Ų | 127.9 | 88% | 0.882 | 74% | 0.739 | S | S | * | * | -172.4 | 154.3 | 118.8 | -103.8 | -28.1 | 0 | 0 | 0 | 112.5 | |||||
| 279 | P | 50.5 | Low | 52.1 | Low | 105 Ų | 105 | 129.1 Ų | 129.1 | 68% | 0.682 | 74% | 0.737 | S | S | * | * | trans | -103.6 | 137 | -165.1 | 36.8 | -32.6 | 0 | 0 | 0 | 115.3 | ||||
| 280 | L | 49.4 | Very low | 52.7 | Low | 172 Ų | 172 | 128.7 Ų | 128.7 | 90% | 0.901 | 73% | 0.731 | S | S | * | * | trans | -164.2 | 37.1 | 146.9 | -93.8 | -150.1 | 0 | 0 | 0 | 114 | G282 | L280-G282 PolarHBondContact O-N 3.44Š| ||
| 281 | I | 51.6 | Low | 53.6 | Low | 185 Ų | 185 | 130.8 Ų | 130.8 | 95% | 0.949 | 74% | 0.735 | S | S | * | * | trans | -83.9 | 100.4 | 165.7 | -66.3 | 172.9 | 0 | 0 | 0 | 107.7 | ||||
| 282 | G | 49 | Very low | 54.3 | Low | 62 Ų | 62 | 132.6 Ų | 132.6 | 64% | 0.639 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -168.5 | -31.2 | -177.9 | 0 | 0 | 0 | 0 | 0 | 119.1 | L280 | L280-G282 PolarHBondContact O-N 3.44Š|
| 283 | F | 52.3 | Low | 55.2 | Low | 192 Ų | 192 | 133.7 Ų | 133.7 | 84% | 0.842 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -121.1 | -24.5 | -165.9 | -95.4 | -92.5 | 0 | 0 | 0 | 118 | ||
| 284 | V | 58.4 | Low | 56 | Low | 128 Ų | 128 | 132.3 Ų | 132.3 | 78% | 0.776 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -85.2 | -14.5 | -171.6 | -86.6 | 0 | 0 | 0 | 0 | 115.7 | ||
| 285 | S | 59.3 | Low | 56.5 | Low | 90 Ų | 90 | 130.6 Ų | 130.6 | 63% | 0.629 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -71.7 | -40.5 | -175.6 | -159.3 | 0 | 0 | 0 | 0 | 113.2 | L287 A288 | S285-L287 VanDerWaalsContact C-N 3.34Å; S285-L287 PolarHBondContact O-N 2.97Å; S285-A288 PolarHBondContact O-N 3.14Å |
| 286 | T | 59.7 | Low | 57.1 | Low | 89 Ų | 89 | 134.3 Ų | 134.3 | 55% | 0.546 | 72% | 0.723 | S | S | . | * | H | α-helix | trans | -68.9 | -27.8 | -168.8 | -40.6 | 0 | 0 | 0 | 0 | 114.1 | H290 | T286-H290 PolarHBondContact O-ND1 2.83Å |
| 287 | L | 60 | Low | 57.6 | Low | 134 Ų | 134 | 134.3 Ų | 134.3 | 70% | 0.702 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -76.3 | -31.2 | -179.3 | -70.1 | 171.3 | 0 | 0 | 0 | 112.8 | S285 I289 | S285-L287 VanDerWaalsContact C-N 3.34Å; S285-L287 PolarHBondContact O-N 2.97Å; L287-I289 VanDerWaalsContact C-N 3.32Å; L287-I289 PolarHBondContact O-N 3.35Å |
| 288 | A | 59.1 | Low | 58 | Low | 67 Ų | 67 | 134.1 Ų | 134.1 | 55% | 0.554 | 73% | 0.728 | S | S | * | * | H | α-helix | trans | -67.9 | -32.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S285 | S285-A288 PolarHBondContact O-N 3.14Å |
| 289 | I | 61.2 | Low | 58.3 | Low | 115 Ų | 115 | 132.7 Ų | 132.7 | 59% | 0.59 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -74.5 | -44.4 | -176.4 | -59 | 175.9 | 0 | 0 | 0 | 111 | L287 F291 Y292 | L287-I289 VanDerWaalsContact C-N 3.32Å; L287-I289 PolarHBondContact O-N 3.35Å; I289-F291 VanDerWaalsContact C-N 3.31Å; I289-F291 PolarHBondContact O-N 2.61Å; I289-Y292 PolarHBondContact O-N 3.3Å |
| 290 | H | 61.4 | Low | 58.6 | Low | 137 Ų | 137 | 133 Ų | 133 | 63% | 0.634 | 73% | 0.729 | S | S | * | * | H | α-helix | trans | -65.1 | -31.1 | -178.9 | -81.8 | 92.7 | 0 | 0 | 0 | 113.7 | T286 Y292 | T286-H290 PolarHBondContact O-ND1 2.83Å; H290-Y292 VanDerWaalsContact C-N 3.32Å; H290-Y292 PolarHBondContact O-N 2.88Å |
| 291 | F | 62.2 | Low | 59.5 | Low | 163 Ų | 163 | 130.3 Ų | 130.3 | 72% | 0.715 | 72% | 0.721 | S | S | * | * | H | α-helix | trans | -74.6 | -20.9 | -178.2 | -132.8 | -86.9 | 0 | 0 | 0 | 113.7 | I289 | I289-F291 VanDerWaalsContact C-N 3.31Å; I289-F291 PolarHBondContact O-N 2.61Å |
| 292 | Y | 60.6 | Low | 60.1 | Low | 189 Ų | 189 | 127.6 Ų | 127.6 | 74% | 0.741 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -86.4 | -16.9 | -175.7 | -128 | -86.9 | 0 | 0 | 0 | 114 | I289 H290 | I289-Y292 PolarHBondContact O-N 3.3Å; H290-Y292 VanDerWaalsContact C-N 3.32Å; H290-Y292 PolarHBondContact O-N 2.88Å |
| 293 | V | 62.4 | Low | 61 | Low | 117 Ų | 117 | 130.3 Ų | 130.3 | 71% | 0.709 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -86.2 | -25.5 | -174.2 | 179.2 | 0 | 0 | 0 | 0 | 112.7 | L295 | V293-L295 PolarHBondContact O-N 3.41Å |
| 294 | L | 62.3 | Low | 61.4 | Low | 154 Ų | 154 | 128.1 Ų | 128.1 | 81% | 0.806 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.7 | -1.6 | -171 | -75.3 | 168.5 | 0 | 0 | 0 | 115.7 | ||
| 295 | L | 62 | Low | 62 | Low | 125 Ų | 125 | 125.7 Ų | 125.7 | 65% | 0.654 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.6 | 12.2 | -167.7 | -96.4 | 164.3 | 0 | 0 | 0 | 115.9 | V293 P297 | V293-L295 PolarHBondContact O-N 3.41Å; L295-P297 VanDerWaalsContact C-CD 3.45Å |
| 296 | F | 60.8 | Low | 62.2 | Low | 183 Ų | 183 | 127.1 Ų | 127.1 | 80% | 0.803 | 74% | 0.737 | S | S | * | * | trans | -124 | 67.7 | 179.2 | -89.3 | -84.4 | 0 | 0 | 0 | 114.9 | V298 | F296-V298 PolarHBondContact O-N 3.43Š| ||
| 297 | P | 60.8 | Low | 62.2 | Low | 113 Ų | 113 | 138 Ų | 138 | 73% | 0.734 | 77% | 0.769 | S | S | * | * | trans | -75.8 | 100.4 | 164.8 | 31.4 | -32.2 | 0 | 0 | 0 | 111.7 | L295 | L295-P297 VanDerWaalsContact C-CD 3.45Š| ||
| 298 | V | 56 | Low | 62.3 | Low | 131 Ų | 131 | 138.3 Ų | 138.3 | 79% | 0.794 | 77% | 0.772 | S | S | * | * | trans | 2.5 | 117.7 | 154.5 | -173.5 | 0 | 0 | 0 | 0 | 117.6 | F296 | F296-V298 PolarHBondContact O-N 3.43Š| ||
| 299 | V | 64.7 | Low | 62.5 | Low | 135 Ų | 135 | 142 Ų | 142 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | -140 | 120.6 | 155.9 | 179.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 300 | C | 58.2 | Low | 62.5 | Low | 113 Ų | 113 | 143.5 Ų | 143.5 | 76% | 0.764 | 79% | 0.794 | S | S | * | * | trans | -120.4 | 132.5 | 176 | -63 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 301 | P | 67.3 | Low | 62.6 | Low | 115 Ų | 115 | 143.9 Ų | 143.9 | 75% | 0.747 | 80% | 0.804 | S | S | * | * | trans | -109.2 | 169.3 | 163.3 | 41 | -31.3 | 0 | 0 | 0 | 110.7 | ||||
| 302 | P | 65.1 | Low | 62.6 | Low | 127 Ų | 127 | 142.7 Ų | 142.7 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | -114.9 | 167.5 | -106 | 8.7 | 15.2 | 0 | 0 | 0 | 114.9 | |||||
| 303 | S | 66.5 | Low | 62.8 | Low | 120 Ų | 120 | 139.6 Ų | 139.6 | 84% | 0.839 | 81% | 0.814 | S | S | * | * | trans | -70.7 | 143.2 | 175.2 | -172.1 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 304 | V | 61.7 | Low | 62.8 | Low | 145 Ų | 145 | 141.2 Ų | 141.2 | 88% | 0.879 | 82% | 0.821 | S | S | * | * | trans | -66.5 | 149.2 | 164.6 | -129.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 305 | G | 69.6 | Low | 62.8 | Low | 77 Ų | 77 | 140.2 Ų | 140.2 | 79% | 0.794 | 82% | 0.823 | S | S | * | * | trans | -156.9 | 128.2 | 172 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 306 | S | 64.3 | Low | 62.9 | Low | 120 Ų | 120 | 141.5 Ų | 141.5 | 84% | 0.839 | 84% | 0.837 | S | S | * | * | trans | -114.6 | 139.3 | -170.9 | -177 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 307 | R | 59.6 | Low | 63.1 | Low | 319 Ų | 319 | 137.7 Ų | 137.7 | 100% | 1.204 | 84% | 0.84 | S | S | * | * | trans | -164.4 | 0 | 156.2 | -109 | 171.8 | -164.3 | -98.4 | 0.6 | 110.1 |
Retrieved 307 of 307 residues in 253.8 ms
(Link to these results)