| 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 | 37.8 | Very low | 45.3 | Very low | 225 Ų | 225 | 153.3 Ų | 153.3 | 100% | 1.108 | 78% | 0.78 | S | S | * | * | 0 | 99.5 | 0 | -69.1 | 172.1 | 94.9 | 0 | 0 | 106.7 | |||||
| 2 | D | 44.2 | Very low | 46 | Very low | 125 Ų | 125 | 155 Ų | 155 | 67% | 0.668 | 78% | 0.783 | S | S | * | * | trans | 57.5 | 94.4 | 139.3 | -38.9 | -52.1 | 0 | 0 | 0 | 117.1 | ||||
| 3 | N | 44.4 | Very low | 45.8 | Very low | 98 Ų | 98 | 154.5 Ų | 154.5 | 52% | 0.524 | 78% | 0.784 | S | S | . | * | 49.2 | 103.1 | 74.5 | -58.9 | -69.6 | 0 | 0 | 0 | 116.3 | R5 | N3-R5 HydrophobicContact CB-CG 4.38Å; N3-R5 VanDerWaalsContact CG-CZ 3.41Å; N3-R5 PolarHBondContact ND2-NH2 3.27Å; N3-R5 VanDerWaalsContact ND2-NH2 3.19Å; N3-R5 PolarHBondContact OD1-NH1 2.99Å; N3-R5 VanDerWaalsContact OD1-NH1 3.09Å | |||
| 4 | L | 55.3 | Low | 45.3 | Very low | 177 Ų | 177 | 147.8 Ų | 147.8 | 93% | 0.927 | 77% | 0.772 | S | S | * | * | trans | -141.4 | 79.4 | 144.4 | -117.3 | 83.8 | 0 | 0 | 0 | 105.6 | ||||
| 5 | R | 48.7 | Very low | 45.1 | Very low | 168 Ų | 168 | 150.1 Ų | 150.1 | 63% | 0.634 | 78% | 0.784 | S | S | * | * | 25.2 | 112 | 94.1 | 24.3 | -169.5 | 164.6 | -99.3 | 2.8 | 115.2 | N3 | N3-R5 HydrophobicContact CB-CG 4.38Å; N3-R5 VanDerWaalsContact CG-CZ 3.41Å; N3-R5 PolarHBondContact ND2-NH2 3.27Å; N3-R5 VanDerWaalsContact ND2-NH2 3.19Å; N3-R5 PolarHBondContact OD1-NH1 2.99Å; N3-R5 VanDerWaalsContact OD1-NH1 3.09Å | |||
| 6 | E | 46.9 | Very low | 44.2 | Very low | 168 Ų | 168 | 145.1 Ų | 145.1 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | trans | 60.9 | 124.9 | 143.8 | -58.3 | -172.7 | 151 | 0 | 0 | 117.2 | ||||
| 7 | T | 45.9 | Very low | 44.6 | Very low | 125 Ų | 125 | 144.2 Ų | 144.2 | 77% | 0.767 | 79% | 0.789 | S | S | * | * | -145 | 112.2 | 82.8 | -54.4 | 0 | 0 | 0 | 0 | 111.9 | L9 | T7-L9 HydrophobicContact CG2-CD2 4.36Å; T7-L9 HydrophobicContact CG2-CG 4.3Å | |||
| 8 | F | 41.4 | Very low | 44.4 | Very low | 169 Ų | 169 | 141.4 Ų | 141.4 | 74% | 0.741 | 78% | 0.781 | S | S | * | * | trans | -59.1 | 127.8 | 152.8 | -89.6 | -110.2 | 0 | 0 | 0 | 109.5 | ||||
| 9 | L | 42 | Very low | 44.8 | Very low | 162 Ų | 162 | 141.9 Ų | 141.9 | 85% | 0.848 | 78% | 0.783 | S | S | * | * | trans | -127.7 | 79.7 | 147.7 | -62.7 | 175.5 | 0 | 0 | 0 | 103.9 | T7 | T7-L9 HydrophobicContact CG2-CD2 4.36Å; T7-L9 HydrophobicContact CG2-CG 4.3Å | ||
| 10 | S | 46.7 | Very low | 44.7 | Very low | 98 Ų | 98 | 139.3 Ų | 139.3 | 69% | 0.685 | 77% | 0.774 | S | S | * | * | 35 | 76.6 | 69.5 | -157.7 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 11 | L | 45.3 | Very low | 44.9 | Very low | 171 Ų | 171 | 137.8 Ų | 137.8 | 90% | 0.895 | 77% | 0.771 | S | S | * | * | trans | -147.5 | 64.1 | 148.7 | -162.3 | 70.6 | 0 | 0 | 0 | 108.6 | ||||
| 12 | E | 53 | Low | 45.5 | Very low | 174 Ų | 174 | 129.2 Ų | 129.2 | 81% | 0.813 | 74% | 0.74 | S | S | * | * | trans | -94.2 | 128.8 | 147.2 | -169.7 | -174.7 | 124.9 | 0 | 0 | 105.9 | ||||
| 13 | D | 44.2 | Very low | 45.9 | Very low | 149 Ų | 149 | 131.5 Ų | 131.5 | 80% | 0.797 | 75% | 0.752 | S | S | * | * | trans | 135.9 | 122.7 | 139.6 | -130.2 | -45.8 | 0 | 0 | 0 | 112.2 | ||||
| 14 | G | 38.1 | Very low | 46.2 | Very low | 60 Ų | 60 | 133.8 Ų | 133.8 | 62% | 0.619 | 76% | 0.763 | S | S | * | * | trans | 139.4 | 76.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 15 | L | 42.2 | Very low | 45.9 | Very low | 182 Ų | 182 | 129.3 Ų | 129.3 | 95% | 0.953 | 75% | 0.747 | S | S | * | * | trans | 65.1 | 120.1 | 141.1 | -52.7 | 174.1 | 0 | 0 | 0 | 119 | ||||
| 16 | G | 31.6 | Very low | 45.8 | Very low | 71 Ų | 71 | 126.6 Ų | 126.6 | 73% | 0.732 | 75% | 0.753 | S | S | * | * | trans | 142.7 | 94.4 | 144.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | S18 | G16-S18 PolarHBondContact O-N 2.99Š| ||
| 17 | S | 51.1 | Low | 46.1 | Very low | 130 Ų | 130 | 129.6 Ų | 129.6 | 91% | 0.909 | 76% | 0.758 | S | S | * | * | trans | -46.3 | 107.4 | 149.4 | 174.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 18 | S | 41.1 | Very low | 46.7 | Very low | 93 Ų | 93 | 126.1 Ų | 126.1 | 65% | 0.65 | 73% | 0.734 | S | S | * | * | trans | -132.8 | 88.4 | 165.5 | -169.1 | 0 | 0 | 0 | 0 | 108.6 | G16 S20 | G16-S18 PolarHBondContact O-N 2.99Å; S18-S20 VanDerWaalsContact C-N 3.31Å; S18-S20 PolarHBondContact O-N 3.37Å; S18-S20 PolarHBondContact O-OG 3.23Å | ||
| 19 | D | 50.8 | Low | 47.6 | Very low | 152 Ų | 152 | 128.4 Ų | 128.4 | 81% | 0.813 | 74% | 0.738 | S | S | * | * | trans | -42.4 | 100 | 152 | -145 | -42.5 | 0 | 0 | 0 | 108 | P21 | D19-P21 WeakPolarHBondContact O-CD 3.33Š| ||
| 20 | S | 43.7 | Very low | 48.1 | Very low | 88 Ų | 88 | 127.1 Ų | 127.1 | 62% | 0.615 | 73% | 0.726 | S | S | * | * | trans | -121.9 | 86.6 | -179.2 | 43.5 | 0 | 0 | 0 | 0 | 108.7 | S18 G22 | S18-S20 VanDerWaalsContact C-N 3.31Å; S18-S20 PolarHBondContact O-N 3.37Å; S18-S20 PolarHBondContact O-OG 3.23Å; S20-G22 PolarHBondContact O-N 3.44Å | ||
| 21 | P | 49.6 | Very low | 48 | Very low | 109 Ų | 109 | 128.9 Ų | 128.9 | 71% | 0.708 | 73% | 0.728 | S | S | * | * | trans | -73.6 | 64.9 | 164.3 | 32.1 | -33.1 | 0 | 0 | 0 | 108.7 | D19 S25 | D19-P21 WeakPolarHBondContact O-CD 3.33Å; P21-S25 PolarHBondContact O-OG 3.08Å | ||
| 22 | G | 50 | Low | 48.3 | Very low | 45 Ų | 45 | 132.2 Ų | 132.2 | 46% | 0.464 | 73% | 0.728 | S | S | . | * | trans | -108.2 | -12.1 | -171.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | S20 L24 | S20-G22 PolarHBondContact O-N 3.44Å; G22-L24 PolarHBondContact O-N 3.42Å | ||
| 23 | L | 51.7 | Low | 48.2 | Very low | 173 Ų | 173 | 128.3 Ų | 128.3 | 91% | 0.906 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -86 | -2.7 | -168.4 | -61 | -173.6 | 0 | 0 | 0 | 115 | ||
| 24 | L | 50.9 | Low | 48.7 | Very low | 146 Ų | 146 | 123.9 Ų | 123.9 | 76% | 0.764 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -121.7 | -7.4 | 176.3 | -66.1 | 175.3 | 0 | 0 | 0 | 114.4 | G22 S26 | G22-L24 PolarHBondContact O-N 3.42Å; L24-S26 VanDerWaalsContact C-N 3.29Å; L24-S26 PolarHBondContact O-N 2.7Å |
| 25 | S | 48.6 | Very low | 49.1 | Very low | 83 Ų | 83 | 127 Ų | 127 | 58% | 0.58 | 73% | 0.725 | S | S | * | * | G | 310 helix | trans | -74.8 | -13.6 | -172.5 | -47.5 | 0 | 0 | 0 | 0 | 114.2 | P21 W27 | P21-S25 PolarHBondContact O-OG 3.08Å; S25-W27 PolarHBondContact O-N 3.04Å |
| 26 | S | 47 | Very low | 49.3 | Very low | 111 Ų | 111 | 128 Ų | 128 | 78% | 0.776 | 72% | 0.722 | S | S | * | * | G | 310 helix | trans | -84.9 | -3.5 | -174.8 | -171 | 0 | 0 | 0 | 0 | 115 | L24 D28 | L24-S26 VanDerWaalsContact C-N 3.29Å; L24-S26 PolarHBondContact O-N 2.7Å; S26-D28 VanDerWaalsContact C-N 3.32Å |
| 27 | W | 52.2 | Low | 50 | Low | 230 Ų | 230 | 132.4 Ų | 132.4 | 87% | 0.871 | 72% | 0.723 | S | S | * | * | G | 310 helix | trans | -98.9 | 33.6 | 177.4 | -65 | 90.2 | 0 | 0 | 0 | 112.3 | S25 W29 | S25-W27 PolarHBondContact O-N 3.04Å; W27-W29 PolarHBondContact O-N 3.33Å |
| 28 | D | 59.2 | Low | 50 | Low | 52 Ų | 52 | 132.9 Ų | 132.9 | 28% | 0.278 | 72% | 0.715 | S | S | . | * | trans | -85.2 | 93.5 | 172.8 | -155.1 | -77.2 | 0 | 0 | 0 | 110 | S26 K30 D31 | S26-D28 VanDerWaalsContact C-N 3.32Å; D28-K30 PolarHBondContact O-N 3.39Å; D28-K30 VanDerWaalsContact OD1-C 3.27Å; D28-K30 WeakPolarHBondContact OD1-CA 3.35Å; D28-K30 WeakPolarHBondContact OD1-CB 3.45Å; D28-K30 WeakPolarHBondContact OD1-CG 3.32Å; D28-K30 PolarHBondContact OD1-N 3.05Å; D28-K30 WeakPolarHBondContact OD2-CD 3.33Å; D28-K30 WeakPolarHBondContact OD2-CE 3.45Å; D28-K30 WeakPolarHBondContact OD2-CG 3.42Å; D28-K30 IonicContact OD2-NZ 3.54Å; D28-K30 PolarHBondContact OD2-NZ 3.33Å; D28-D31 PolarHBondContact OD1-N 3Å | ||
| 29 | W | 60.9 | Low | 49.9 | Very low | 217 Ų | 217 | 135.1 Ų | 135.1 | 82% | 0.822 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.3 | -6.9 | 170.3 | 64.8 | -86.7 | 0 | 0 | 0 | 112.4 | W27 | W27-W29 PolarHBondContact O-N 3.33Š|
| 30 | K | 51.4 | Low | 50 | Low | 135 Ų | 135 | 136.3 Ų | 136.3 | 59% | 0.587 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | -17.8 | -170.2 | -18.6 | 162.8 | -170.1 | 135.8 | 0 | 112.1 | D28 R32 | D28-K30 PolarHBondContact O-N 3.39Å; D28-K30 VanDerWaalsContact OD1-C 3.27Å; D28-K30 WeakPolarHBondContact OD1-CA 3.35Å; D28-K30 WeakPolarHBondContact OD1-CB 3.45Å; D28-K30 WeakPolarHBondContact OD1-CG 3.32Å; D28-K30 PolarHBondContact OD1-N 3.05Å; D28-K30 WeakPolarHBondContact OD2-CD 3.33Å; D28-K30 WeakPolarHBondContact OD2-CE 3.45Å; D28-K30 WeakPolarHBondContact OD2-CG 3.42Å; D28-K30 IonicContact OD2-NZ 3.54Å; D28-K30 PolarHBondContact OD2-NZ 3.33Å; K30-R32 PolarHBondContact O-N 3.29Å |
| 31 | D | 46.1 | Very low | 50 | Low | 136 Ų | 136 | 135.9 Ų | 135.9 | 73% | 0.727 | 72% | 0.722 | S | S | * | * | trans | -80.9 | 9.9 | 176.1 | -86.8 | -37.4 | 0 | 0 | 0 | 114.7 | D28 A33 | D28-D31 PolarHBondContact OD1-N 3Å; D31-A33 PolarHBondContact O-N 3.5Å | ||
| 32 | R | 49.9 | Very low | 49.6 | Very low | 240 Ų | 240 | 136 Ų | 136 | 91% | 0.906 | 73% | 0.726 | S | S | * | * | trans | -78.4 | 46.8 | 163.1 | -72.8 | -166.5 | -172.7 | -98 | 0.6 | 112 | K30 | K30-R32 PolarHBondContact O-N 3.29Š| ||
| 33 | A | 52 | Low | 49.2 | Very low | 92 Ų | 92 | 140 Ų | 140 | 76% | 0.76 | 74% | 0.743 | S | S | * | * | trans | -107.1 | 55.2 | 168.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | D31 | D31-A33 PolarHBondContact O-N 3.5Š| ||
| 34 | G | 54.3 | Low | 49.2 | Very low | 56 Ų | 56 | 137 Ų | 137 | 58% | 0.577 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -99.8 | 139.9 | 165.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | F36 | G34-F36 PolarHBondContact O-N 3.5Š|
| 35 | P | 47.1 | Very low | 49.4 | Very low | 127 Ų | 127 | 138.3 Ų | 138.3 | 83% | 0.825 | 74% | 0.739 | S | S | * | * | trans | -57.2 | 134 | 175 | -18.4 | 30.2 | 0 | 0 | 0 | 110.2 | E37 | P35-E37 VanDerWaalsContact C-N 3.31Å; P35-E37 PolarHBondContact O-N 3.07Å | ||
| 36 | F | 45.1 | Very low | 49.4 | Very low | 201 Ų | 201 | 139.4 Ų | 139.4 | 88% | 0.882 | 75% | 0.747 | S | S | * | * | trans | -72.3 | 84.9 | 178.9 | -149.9 | -90.1 | 0 | 0 | 0 | 109.3 | G34 L38 | G34-F36 PolarHBondContact O-N 3.5Å; F36-L38 PolarHBondContact O-N 3.09Å | ||
| 37 | E | 47.1 | Very low | 49.6 | Very low | 164 Ų | 164 | 141.6 Ų | 141.6 | 77% | 0.766 | 75% | 0.749 | S | S | * | * | trans | -74 | 110.6 | 167.5 | -94.3 | -82.4 | 134.4 | 0 | 0 | 108.6 | P35 N39 | P35-E37 VanDerWaalsContact C-N 3.31Å; P35-E37 PolarHBondContact O-N 3.07Å; E37-N39 VanDerWaalsContact C-N 3.28Å; E37-N39 PolarHBondContact O-N 3.3Å | ||
| 38 | L | 50.3 | Low | 49.4 | Very low | 141 Ų | 141 | 135 Ų | 135 | 74% | 0.738 | 74% | 0.738 | S | S | * | * | trans | -70.6 | 80.4 | 177.5 | -174.1 | 78.1 | 0 | 0 | 0 | 109.7 | F36 Q40 | F36-L38 PolarHBondContact O-N 3.09Å; L38-Q40 PolarHBondContact O-N 3.2Å; L38-Q40 VanDerWaalsContact O-N 3.12Å | ||
| 39 | N | 39.7 | Very low | 49 | Very low | 140 Ų | 140 | 138.4 Ų | 138.4 | 75% | 0.749 | 76% | 0.763 | S | S | * | * | trans | -76.5 | 101.1 | 170.7 | -142.4 | -81.3 | 0 | 0 | 0 | 109.3 | E37 A41 | E37-N39 VanDerWaalsContact C-N 3.28Å; E37-N39 PolarHBondContact O-N 3.3Å; N39-A41 PolarHBondContact O-N 3.35Å | ||
| 40 | Q | 53.4 | Low | 48.4 | Very low | 177 Ų | 177 | 132.2 Ų | 132.2 | 83% | 0.827 | 76% | 0.758 | S | S | * | * | trans | -65.1 | 94.5 | 167.4 | -78.5 | -141.6 | 89.2 | 0 | 0 | 110.3 | L38 | L38-Q40 PolarHBondContact O-N 3.2Å; L38-Q40 VanDerWaalsContact O-N 3.12Å | ||
| 41 | A | 42.5 | Very low | 48.1 | Very low | 79 Ų | 79 | 131.7 Ų | 131.7 | 65% | 0.653 | 77% | 0.769 | S | S | * | * | trans | -150.3 | 86.7 | 157.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | N39 P43 | N39-A41 PolarHBondContact O-N 3.35Å; A41-P43 WeakPolarHBondContact O-CD 3.3Å | ||
| 42 | S | 41.4 | Very low | 48.5 | Very low | 112 Ų | 112 | 130.6 Ų | 130.6 | 78% | 0.783 | 77% | 0.772 | S | S | * | * | trans | -76.1 | 122.4 | 164.9 | -61.5 | 0 | 0 | 0 | 0 | 108.7 | S44 | S42-S44 PolarHBondContact O-N 3.36Š| ||
| 43 | P | 42.6 | Very low | 48.7 | Very low | 127 Ų | 127 | 126.7 Ų | 126.7 | 83% | 0.825 | 77% | 0.768 | S | S | * | * | trans | -78.6 | 105 | 161.4 | 29.2 | -27.7 | 0 | 0 | 0 | 108.4 | A41 Q45 | A41-P43 WeakPolarHBondContact O-CD 3.3Å; P43-Q45 VanDerWaalsContact C-N 3.29Å; P43-Q45 PolarHBondContact O-N 3.37Å; P43-Q45 VanDerWaalsContact O-N 3.08Å | ||
| 44 | S | 52.2 | Low | 48.5 | Very low | 112 Ų | 112 | 130.8 Ų | 130.8 | 78% | 0.783 | 77% | 0.771 | S | S | * | * | trans | -80.8 | 61.3 | 178.9 | 42.1 | 0 | 0 | 0 | 0 | 112.3 | S42 | S42-S44 PolarHBondContact O-N 3.36Š| ||
| 45 | Q | 54 | Low | 48 | Very low | 173 Ų | 173 | 131.8 Ų | 131.8 | 81% | 0.808 | 77% | 0.769 | S | S | * | * | trans | -143.6 | 74.6 | 170 | -64.3 | -166.8 | 32.8 | 0 | 0 | 112.2 | P43 | P43-Q45 VanDerWaalsContact C-N 3.29Å; P43-Q45 PolarHBondContact O-N 3.37Å; P43-Q45 VanDerWaalsContact O-N 3.08Å | ||
| 46 | S | 48 | Very low | 48 | Very low | 105 Ų | 105 | 136.2 Ų | 136.2 | 73% | 0.734 | 77% | 0.771 | S | S | * | * | trans | -94.8 | 87.7 | 159.8 | 166.7 | 0 | 0 | 0 | 0 | 108 | S48 | S46-S48 VanDerWaalsContact C-N 3.29Å; S46-S48 PolarHBondContact O-N 3.46Å; S46-S48 VanDerWaalsContact O-N 3.07Å; S46-S48 PolarHBondContact OG-OG 2.96Å | ||
| 47 | L | 52.5 | Low | 48.4 | Very low | 157 Ų | 157 | 131.9 Ų | 131.9 | 82% | 0.822 | 77% | 0.766 | S | S | * | * | trans | -79 | 83.5 | 167.9 | -66.4 | 177.2 | 0 | 0 | 0 | 108.8 | ||||
| 48 | S | 48.3 | Very low | 48.4 | Very low | 91 Ų | 91 | 129.8 Ų | 129.8 | 64% | 0.636 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 124.8 | 165.9 | -59.2 | 0 | 0 | 0 | 0 | 108.3 | S46 A50 | S46-S48 VanDerWaalsContact C-N 3.29Å; S46-S48 PolarHBondContact O-N 3.46Å; S46-S48 VanDerWaalsContact O-N 3.07Å; S46-S48 PolarHBondContact OG-OG 2.96Å; S48-A50 PolarHBondContact O-N 3.49Å |
| 49 | P | 50.4 | Low | 48.3 | Very low | 124 Ų | 124 | 128.2 Ų | 128.2 | 81% | 0.805 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 122.8 | 172.9 | 21.8 | -28.1 | 0 | 0 | 0 | 109.4 | ||
| 50 | A | 48 | Very low | 48.8 | Very low | 88 Ų | 88 | 126.8 Ų | 126.8 | 73% | 0.727 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 134.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | S48 S52 | S48-A50 PolarHBondContact O-N 3.49Å; A50-S52 PolarHBondContact O-N 3.02Å |
| 51 | P | 44.8 | Very low | 48.4 | Very low | 124 Ų | 124 | 123.9 Ų | 123.9 | 81% | 0.805 | 77% | 0.766 | S | S | * | * | trans | -70.1 | 115.8 | 170 | 28 | -31.1 | 0 | 0 | 0 | 108.9 | L53 | P51-L53 PolarHBondContact O-N 2.97Š| ||
| 52 | S | 54.8 | Low | 48.6 | Very low | 113 Ų | 113 | 125.9 Ų | 125.9 | 79% | 0.79 | 77% | 0.772 | S | S | * | * | trans | -67.3 | 115.1 | 168.9 | 59.9 | 0 | 0 | 0 | 0 | 109.2 | A50 | A50-S52 PolarHBondContact O-N 3.02Š| ||
| 53 | L | 55.2 | Low | 48.7 | Very low | 158 Ų | 158 | 126.7 Ų | 126.7 | 83% | 0.827 | 77% | 0.772 | S | S | * | * | trans | -92.9 | 95.4 | 165.3 | -93.8 | 172.1 | 0 | 0 | 0 | 108.2 | P51 | P51-L53 PolarHBondContact O-N 2.97Š| ||
| 54 | E | 46 | Very low | 48.6 | Very low | 178 Ų | 178 | 127.1 Ų | 127.1 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | trans | -177 | 130.4 | 161.4 | -116.4 | 93.7 | -140.6 | 0 | 0 | 103.4 | ||||
| 55 | S | 44.2 | Very low | 48.3 | Very low | 76 Ų | 76 | 127.4 Ų | 127.4 | 53% | 0.531 | 77% | 0.77 | S | S | . | * | cis | -163.9 | 170.7 | 22.9 | -73.5 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 56 | Y | 46.7 | Very low | 47.5 | Very low | 220 Ų | 220 | 122.2 Ų | 122.2 | 86% | 0.863 | 76% | 0.762 | S | S | * | * | cis | -161.4 | 146.4 | 39.8 | -78.3 | -82.4 | 0 | 0 | 0 | 109.4 | ||||
| 57 | S | 55.2 | Low | 47.2 | Very low | 111 Ų | 111 | 125.1 Ų | 125.1 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | trans | -56.8 | 136.3 | 157.8 | 175 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 58 | S | 47.1 | Very low | 46.8 | Very low | 119 Ų | 119 | 123 Ų | 123 | 83% | 0.832 | 77% | 0.765 | S | S | * | * | trans | -159.4 | 99.8 | 146.4 | -82.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 59 | S | 47.4 | Very low | 46.5 | Very low | 108 Ų | 108 | 125 Ų | 125 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | trans | 2.1 | 161.5 | 131.9 | -143.7 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 60 | P | 51.3 | Low | 45.6 | Very low | 111 Ų | 111 | 127.5 Ų | 127.5 | 72% | 0.721 | 78% | 0.778 | S | S | * | * | cis | -136.2 | 164.3 | 11 | 29.7 | -6.2 | 0 | 0 | 0 | 116.8 | ||||
| 61 | C | 43.8 | Very low | 45.5 | Very low | 116 Ų | 116 | 132.7 Ų | 132.7 | 78% | 0.784 | 79% | 0.787 | S | S | * | * | trans | -55.6 | 142.1 | 165.6 | -53.8 | 0 | 0 | 0 | 0 | 111.7 | V63 | C61-V63 PolarHBondContact O-N 3.05Š| ||
| 62 | P | 47.7 | Very low | 45 | Very low | 120 Ų | 120 | 130.7 Ų | 130.7 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | trans | -68.7 | 118.9 | 166.4 | 27.7 | -30.3 | 0 | 0 | 0 | 109.6 | V64 | P62-V64 PolarHBondContact O-N 2.99Š| ||
| 63 | V | 42.9 | Very low | 44.2 | Very low | 129 Ų | 129 | 129 Ų | 129 | 78% | 0.782 | 79% | 0.789 | S | S | * | * | trans | -41 | 111 | 157.6 | 56.1 | 0 | 0 | 0 | 0 | 110.3 | C61 | C61-V63 PolarHBondContact O-N 3.05Š| ||
| 64 | V | 40.9 | Very low | 43.6 | Very low | 136 Ų | 136 | 126.6 Ų | 126.6 | 82% | 0.824 | 79% | 0.792 | S | S | * | * | trans | -98.1 | 103.9 | 161.7 | 65.8 | 0 | 0 | 0 | 0 | 106.8 | P62 G66 | P62-V64 PolarHBondContact O-N 2.99Å; V64-G66 PolarHBondContact O-N 2.98Å | ||
| 65 | T | 44.9 | Very low | 43.5 | Very low | 118 Ų | 118 | 123.4 Ų | 123.4 | 72% | 0.724 | 79% | 0.79 | S | S | * | * | trans | -55.9 | 121.2 | 172.5 | -54.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 66 | G | 38.3 | Very low | 43.6 | Very low | 64 Ų | 64 | 125 Ų | 125 | 66% | 0.66 | 80% | 0.801 | S | S | * | * | trans | -67 | 138.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | V64 | V64-G66 PolarHBondContact O-N 2.98Š| ||
| 67 | L | 40 | Very low | 43.3 | Very low | 166 Ų | 166 | 118.2 Ų | 118.2 | 87% | 0.869 | 80% | 0.797 | S | S | * | * | trans | -135.3 | 136.5 | 148.9 | -74.8 | 177.1 | 0 | 0 | 0 | 107.9 | ||||
| 68 | P | 45.7 | Very low | 42.5 | Very low | 113 Ų | 113 | 116.2 Ų | 116.2 | 73% | 0.734 | 79% | 0.794 | S | S | * | * | trans | -89.8 | 137.9 | -171.5 | 34.6 | -31.8 | 0 | 0 | 0 | 111.1 | ||||
| 69 | C | 41.3 | Very low | 42.9 | Very low | 133 Ų | 133 | 115.4 Ų | 115.4 | 90% | 0.899 | 79% | 0.788 | S | S | * | * | trans | -134.6 | 101.9 | 154.7 | -75 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 70 | E | 32.4 | Very low | 42.6 | Very low | 176 Ų | 176 | 117.7 Ų | 117.7 | 82% | 0.822 | 79% | 0.792 | S | S | * | * | trans | -55.2 | 151.4 | 156.9 | -55.6 | -158 | 109.1 | 0 | 0 | 109.4 | ||||
| 71 | H | 45.8 | Very low | 42.3 | Very low | 198 Ų | 198 | 115.4 Ų | 115.4 | 92% | 0.917 | 79% | 0.789 | S | S | * | * | trans | 176.1 | 120.2 | 137 | -93.9 | 89.8 | 0 | 0 | 0 | 110.1 | ||||
| 72 | G | 33.8 | Very low | 42.5 | Very low | 82 Ų | 82 | 115.8 Ų | 115.8 | 85% | 0.845 | 79% | 0.792 | S | S | * | * | trans | 92.5 | 101.8 | 142.9 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 73 | G | 37.4 | Very low | 42.2 | Very low | 77 Ų | 77 | 116.2 Ų | 116.2 | 79% | 0.794 | 80% | 0.797 | S | S | * | * | trans | -90 | -165.4 | 169.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 74 | A | 41.8 | Very low | 42.6 | Very low | 108 Ų | 108 | 117.4 Ų | 117.4 | 89% | 0.893 | 81% | 0.805 | S | S | * | * | trans | 81.3 | 138.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 75 | S | 44.2 | Very low | 42.6 | Very low | 111 Ų | 111 | 114.6 Ų | 114.6 | 78% | 0.776 | 80% | 0.803 | S | S | * | * | cis | -158 | 163.7 | 7.8 | -167.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 76 | S | 47.3 | Very low | 42.4 | Very low | 109 Ų | 109 | 112.8 Ų | 112.8 | 76% | 0.762 | 81% | 0.808 | S | S | * | * | trans | -56.7 | 151.9 | 169.2 | 49.6 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 77 | G | 40.3 | Very low | 42.6 | Very low | 77 Ų | 77 | 114.2 Ų | 114.2 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | 114.7 | 138.4 | 125.2 | 0 | 0 | 0 | 0 | 0 | 118.9 | |||||
| 78 | G | 39.2 | Very low | 43.1 | Very low | 69 Ų | 69 | 112.5 Ų | 112.5 | 71% | 0.711 | 82% | 0.815 | S | S | * | * | trans | 84.6 | 109.7 | 153 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 79 | S | 54.5 | Low | 43 | Very low | 102 Ų | 102 | 110.6 Ų | 110.6 | 71% | 0.713 | 82% | 0.816 | S | S | * | * | 55.1 | 111.9 | 81 | 75.6 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 80 | D | 40.1 | Very low | 43.5 | Very low | 156 Ų | 156 | 112 Ų | 112 | 83% | 0.834 | 81% | 0.814 | S | S | * | * | 152.9 | 131 | 120.3 | -72 | -30.9 | 0 | 0 | 0 | 112.8 | |||||
| 81 | G | 45.2 | Very low | 44.2 | Very low | 63 Ų | 63 | 109.5 Ų | 109.5 | 65% | 0.649 | 81% | 0.811 | S | S | * | * | 67.6 | 105.8 | 128 | 0 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 82 | C | 47.8 | Very low | 44.6 | Very low | 125 Ų | 125 | 108.7 Ų | 108.7 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | trans | 22.9 | 122.7 | 134.2 | 40.1 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 83 | S | 43.1 | Very low | 45.5 | Very low | 128 Ų | 128 | 109.5 Ų | 109.5 | 90% | 0.895 | 80% | 0.795 | S | S | * | * | trans | -150.1 | 131.2 | 137.2 | -82.9 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 84 | V | 50.8 | Low | 46.3 | Very low | 155 Ų | 155 | 111.2 Ų | 111.2 | 94% | 0.939 | 79% | 0.786 | S | S | * | * | trans | -66.2 | 140.3 | 173.4 | 163.3 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 85 | G | 40 | Very low | 47.1 | Very low | 76 Ų | 76 | 114.9 Ų | 114.9 | 78% | 0.784 | 78% | 0.778 | S | S | * | * | trans | 177 | 84.7 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 86 | G | 41.2 | Very low | 47.8 | Very low | 80 Ų | 80 | 115.7 Ų | 115.7 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | trans | -75.4 | 148.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 87 | A | 43.8 | Very low | 48.3 | Very low | 94 Ų | 94 | 118.3 Ų | 118.3 | 78% | 0.777 | 78% | 0.776 | S | S | * | * | trans | -170.5 | 112.2 | 141.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 88 | S | 49 | Very low | 48.9 | Very low | 130 Ų | 130 | 120.7 Ų | 120.7 | 91% | 0.909 | 77% | 0.77 | S | S | * | * | trans | 66.5 | 79.9 | 145.5 | -51.1 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 89 | G | 43.5 | Very low | 49.6 | Very low | 73 Ų | 73 | 120.5 Ų | 120.5 | 75% | 0.753 | 76% | 0.762 | S | S | * | * | trans | -111.9 | 118 | 165 | 0 | 0 | 0 | 0 | 0 | 111.1 | V91 | G89-V91 PolarHBondContact O-N 3.15Š| ||
| 90 | L | 51.8 | Low | 49.4 | Very low | 162 Ų | 162 | 125.2 Ų | 125.2 | 85% | 0.848 | 77% | 0.77 | S | S | * | * | trans | -29.7 | 118.3 | 169 | -159.7 | -176.9 | 0 | 0 | 0 | 112.4 | E92 | L90-E92 PolarHBondContact O-N 3.25Š| ||
| 91 | V | 46.7 | Very low | 50 | Low | 125 Ų | 125 | 125.9 Ų | 125.9 | 76% | 0.758 | 77% | 0.768 | S | S | * | * | trans | -69.3 | 95.7 | 169.9 | -75 | 0 | 0 | 0 | 0 | 109.1 | G89 V93 | G89-V91 PolarHBondContact O-N 3.15Å; V91-V93 PolarHBondContact O-N 3.34Å | ||
| 92 | E | 55.4 | Low | 49.9 | Very low | 181 Ų | 181 | 127.5 Ų | 127.5 | 85% | 0.846 | 77% | 0.767 | S | S | * | * | trans | -62.1 | 101.4 | 165.5 | -170.5 | 177.6 | 159.7 | 0 | 0 | 107.3 | L90 D94 | L90-E92 PolarHBondContact O-N 3.25Å; E92-D94 PolarHBondContact O-N 3.26Å | ||
| 93 | V | 51.7 | Low | 49.9 | Very low | 98 Ų | 98 | 126 Ų | 126 | 59% | 0.594 | 76% | 0.764 | S | S | * | * | trans | -65.5 | 108.7 | 176.6 | -178.6 | 0 | 0 | 0 | 0 | 107 | V91 Y95 | V91-V93 PolarHBondContact O-N 3.34Å; V93-Y95 HydrophobicContact CB-CE2 4.45Å; V93-Y95 WeakPolarHBondContact O-CD2 3.45Å; V93-Y95 PolarHBondContact O-N 3.23Å | ||
| 94 | D | 55.3 | Low | 50.4 | Low | 113 Ų | 113 | 129 Ų | 129 | 60% | 0.604 | 76% | 0.757 | S | S | * | * | trans | -65.7 | 95.1 | 175.5 | -175.6 | -4.4 | 0 | 0 | 0 | 109.8 | E92 N96 M97 | E92-D94 PolarHBondContact O-N 3.26Å; D94-N96 PolarHBondContact O-N 3.18Å; D94-N96 WeakPolarHBondContact OD1-CB 3.39Å; D94-N96 PolarHBondContact OD1-N 3.19Å; D94-M97 PolarHBondContact O-N 2.96Å | ||
| 95 | Y | 58.5 | Low | 50.5 | Low | 185 Ų | 185 | 128.9 Ų | 128.9 | 73% | 0.725 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -62.1 | -5.1 | 177.1 | -79.4 | -89.2 | 0 | 0 | 0 | 113.6 | V93 M97 | V93-Y95 HydrophobicContact CB-CE2 4.45Å; V93-Y95 WeakPolarHBondContact O-CD2 3.45Å; V93-Y95 PolarHBondContact O-N 3.23Å; Y95-M97 VanDerWaalsContact C-N 3.31Å |
| 96 | N | 57.9 | Low | 51 | Low | 128 Ų | 128 | 134.3 Ų | 134.3 | 68% | 0.684 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -79.3 | -12 | 178.7 | -132.6 | 14.2 | 0 | 0 | 0 | 112.6 | D94 L98 | D94-N96 PolarHBondContact O-N 3.18Å; D94-N96 WeakPolarHBondContact OD1-CB 3.39Å; D94-N96 PolarHBondContact OD1-N 3.19Å; N96-L98 VanDerWaalsContact C-N 3.33Å |
| 97 | M | 58.4 | Low | 50.9 | Low | 165 Ų | 165 | 134.2 Ų | 134.2 | 81% | 0.813 | 75% | 0.754 | S | S | * | * | G | 310 helix | trans | -76.5 | -16.4 | 173.3 | -148.3 | -163.3 | 88.2 | 0 | 0 | 113.6 | D94 Y95 A99 | D94-M97 PolarHBondContact O-N 2.96Å; Y95-M97 VanDerWaalsContact C-N 3.31Å; M97-A99 VanDerWaalsContact C-N 3.3Å |
| 98 | L | 54.2 | Low | 50.9 | Low | 126 Ų | 126 | 133.5 Ų | 133.5 | 66% | 0.66 | 76% | 0.756 | S | S | * | * | G | 310 helix | trans | -90.3 | 9.3 | 176.3 | -63.9 | 179.4 | 0 | 0 | 0 | 113.2 | N96 F100 | N96-L98 VanDerWaalsContact C-N 3.33Å; L98-F100 PolarHBondContact O-N 3.09Å |
| 99 | A | 53.3 | Low | 50.8 | Low | 66 Ų | 66 | 131.6 Ų | 131.6 | 55% | 0.545 | 76% | 0.756 | S | S | . | * | S | Bend | trans | -73.4 | 94 | 169.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | M97 Q101 | M97-A99 VanDerWaalsContact C-N 3.3Å; A99-Q101 PolarHBondContact O-N 3.18Å |
| 100 | F | 50.8 | Low | 50.6 | Low | 200 Ų | 200 | 131.7 Ų | 131.7 | 88% | 0.877 | 76% | 0.757 | S | S | * | * | trans | -37.6 | 104.1 | 171.4 | -76.4 | -93.4 | 0 | 0 | 0 | 111.5 | L98 | L98-F100 PolarHBondContact O-N 3.09Š| ||
| 101 | Q | 51.6 | Low | 50.9 | Low | 171 Ų | 171 | 129.6 Ų | 129.6 | 80% | 0.799 | 75% | 0.753 | S | S | * | * | trans | -67.8 | 125.9 | 167.4 | -66.1 | -160 | -1.7 | 0 | 0 | 107.9 | A99 A103 | A99-Q101 PolarHBondContact O-N 3.18Å; Q101-A103 PolarHBondContact O-N 3.42Å | ||
| 102 | P | 43.3 | Very low | 51.2 | Low | 97 Ų | 97 | 133.5 Ų | 133.5 | 63% | 0.63 | 76% | 0.76 | S | S | * | * | trans | -75.3 | 85 | 174.6 | 29.4 | -29.3 | 0 | 0 | 0 | 108.4 | Y104 | P102-Y104 HydrophobicContact CB-CD1 4.27Å; P102-Y104 HydrophobicContact CB-CE1 3.9Å; P102-Y104 PolarHBondContact O-N 2.89Å | ||
| 103 | A | 48.2 | Very low | 50.8 | Low | 94 Ų | 94 | 129.1 Ų | 129.1 | 78% | 0.777 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | 22.4 | -174.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q101 | Q101-A103 PolarHBondContact O-N 3.42Š|
| 104 | Y | 53.5 | Low | 50.9 | Low | 190 Ų | 190 | 134.2 Ų | 134.2 | 75% | 0.745 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.8 | 7.7 | -177.5 | 65.5 | -96.1 | 0 | 0 | 0 | 115.2 | P102 | P102-Y104 HydrophobicContact CB-CD1 4.27Å; P102-Y104 HydrophobicContact CB-CE1 3.9Å; P102-Y104 PolarHBondContact O-N 2.89Å |
| 105 | L | 51.8 | Low | 50.7 | Low | 153 Ų | 153 | 136.5 Ų | 136.5 | 80% | 0.801 | 78% | 0.777 | S | S | * | * | trans | -121.7 | 36.9 | 173.2 | -64.7 | -177.6 | 0 | 0 | 0 | 113.4 | ||||
| 106 | Q | 50.3 | Low | 50.5 | Low | 190 Ų | 190 | 130.6 Ų | 130.6 | 89% | 0.888 | 77% | 0.772 | S | S | * | * | trans | -102.2 | 66.6 | 168.5 | -159.9 | 127.1 | 64.2 | 0 | 0 | 109.9 | ||||
| 107 | G | 39.1 | Very low | 50.3 | Low | 78 Ų | 78 | 131 Ų | 131 | 80% | 0.804 | 78% | 0.78 | S | S | * | * | trans | -82.5 | 116.2 | 162.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 108 | G | 45.4 | Very low | 50.5 | Low | 79 Ų | 79 | 130.4 Ų | 130.4 | 81% | 0.814 | 77% | 0.772 | S | S | * | * | trans | -74.8 | 149 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 109 | G | 46.4 | Very low | 51.1 | Low | 89 Ų | 89 | 129.8 Ų | 129.8 | 92% | 0.918 | 77% | 0.774 | S | S | * | * | trans | 95.4 | 108.4 | 148.7 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 110 | G | 39.5 | Very low | 52.2 | Low | 75 Ų | 75 | 136.4 Ų | 136.4 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | trans | 147 | 115.8 | 155.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 111 | P | 58.7 | Low | 53.6 | Low | 118 Ų | 118 | 130.4 Ų | 130.4 | 77% | 0.766 | 76% | 0.76 | S | S | * | * | trans | -85.5 | 155 | 170.6 | 34.9 | -29.4 | 0 | 0 | 0 | 111 | ||||
| 112 | K | 51.5 | Low | 55.4 | Low | 207 Ų | 207 | 125.7 Ų | 125.7 | 90% | 0.9 | 75% | 0.746 | S | S | * | * | trans | 84.9 | 89.3 | 173.5 | -46 | -67.3 | -178.5 | 170.3 | 0 | 116.2 | ||||
| 113 | A | 46.5 | Very low | 57.7 | Low | 90 Ų | 90 | 124.9 Ų | 124.9 | 74% | 0.744 | 74% | 0.739 | S | S | * | * | trans | -151.9 | 125.5 | 138.4 | 0 | 0 | 0 | 0 | 0 | 107.2 | K115 | A113-K115 VanDerWaalsContact C-N 3.34Å; A113-K115 PolarHBondContact O-N 2.94Å | ||
| 114 | Q | 55.5 | Low | 59.9 | Low | 205 Ų | 205 | 126.8 Ų | 126.8 | 96% | 0.958 | 73% | 0.732 | S | S | * | * | trans | -57 | 98.1 | 175.3 | -70.4 | -172.2 | -37.7 | 0 | 0 | 108.7 | G116 | Q114-G116 PolarHBondContact O-N 3.31Å; Q114-G116 VanDerWaalsContact O-N 3.15Å | ||
| 115 | K | 50.3 | Low | 61.9 | Low | 161 Ų | 161 | 125.1 Ų | 125.1 | 70% | 0.7 | 73% | 0.725 | S | S | * | * | trans | -78.8 | 100.6 | 178.7 | -113.9 | 167.6 | 177.3 | 165.8 | 0 | 105.7 | A113 T117 | A113-K115 VanDerWaalsContact C-N 3.34Å; A113-K115 PolarHBondContact O-N 2.94Å; K115-T117 PolarHBondContact O-N 3.49Å | ||
| 116 | G | 54.8 | Low | 64 | Low | 60 Ų | 60 | 123.3 Ų | 123.3 | 62% | 0.619 | 71% | 0.707 | S | S | * | * | trans | -41.5 | 133.5 | 164 | 0 | 0 | 0 | 0 | 0 | 109 | Q114 K118 | Q114-G116 PolarHBondContact O-N 3.31Å; Q114-G116 VanDerWaalsContact O-N 3.15Å; G116-K118 PolarHBondContact O-N 3.35Å | ||
| 117 | T | 53.1 | Low | 66.2 | Low | 138 Ų | 138 | 122.4 Ų | 122.4 | 85% | 0.847 | 70% | 0.695 | S | S | * | * | trans | -58.8 | 78.7 | -174 | -50.5 | 0 | 0 | 0 | 0 | 110.1 | K115 V119 | K115-T117 PolarHBondContact O-N 3.49Å; T117-V119 PolarHBondContact O-N 3.12Å | ||
| 118 | K | 62.3 | Low | 69 | Low | 151 Ų | 151 | 126.1 Ų | 126.1 | 66% | 0.657 | 69% | 0.689 | S | S | * | * | trans | -71.1 | 103.6 | 173.7 | 37.3 | -175.7 | 156.3 | -161.8 | 0 | 106.4 | G116 R120 | G116-K118 PolarHBondContact O-N 3.35Å; K118-R120 PolarHBondContact O-N 2.7Å | ||
| 119 | V | 66.4 | Low | 71.5 | Confident | 114 Ų | 114 | 125.2 Ų | 125.2 | 69% | 0.691 | 67% | 0.674 | S | S | * | * | trans | -57.7 | 90.5 | 173.5 | 180 | 0 | 0 | 0 | 0 | 107.6 | T117 M121 | T117-V119 PolarHBondContact O-N 3.12Å; V119-M121 HydrophobicContact CB-CE 4.49Å; V119-M121 HydrophobicContact CG1-CE 3.88Å; V119-M121 PolarHBondContact O-N 3.23Å | ||
| 120 | R | 77.4 | Confident | 74 | Confident | 204 Ų | 204 | 124.8 Ų | 124.8 | 77% | 0.77 | 66% | 0.658 | S | S | * | * | trans | -76.5 | 115.4 | 177.8 | -170.1 | 179.1 | 172.5 | -147.4 | 1.4 | 106.6 | K118 S122 | K118-R120 PolarHBondContact O-N 2.7Å; R120-S122 PolarHBondContact O-N 3.45Å | ||
| 121 | M | 80.1 | Confident | 76.8 | Confident | 74 Ų | 74 | 127.1 Ų | 127.1 | 37% | 0.365 | 65% | 0.648 | S | S | . | * | trans | -55.5 | 133.1 | 179.5 | -62.7 | -55.4 | 150.3 | 0 | 0 | 111 | V119 R125 R126 | V119-M121 HydrophobicContact CB-CE 4.49Å; V119-M121 HydrophobicContact CG1-CE 3.88Å; V119-M121 PolarHBondContact O-N 3.23Å; M121-R125 PolarHBondContact SD-NH1 3.29Å; M121-R126 HydrophobicContact CB-CG 4.09Å; M121-R126 PolarHBondContact O-NE 2.92Å | ||
| 122 | S | 90.1 | Very high | 78.7 | Confident | 72 Ų | 72 | 130.9 Ų | 130.9 | 50% | 0.503 | 65% | 0.647 | S | S | . | * | trans | -54.7 | 149 | 178.7 | 71.5 | 0 | 0 | 0 | 0 | 110.4 | R120 Q124 R125 R126 | R120-S122 PolarHBondContact O-N 3.45Å; S122-Q124 PolarHBondContact O-N 3.27Å; S122-R125 PolarHBondContact O-N 3.4Å; S122-R125 VanDerWaalsContact O-N 3.09Å; S122-R125 WeakPolarHBondContact OG-CB 3.36Å; S122-R125 PolarHBondContact OG-N 3.46Å; S122-R125 VanDerWaalsContact OG-N 3.16Å; S122-R126 PolarHBondContact O-N 3.11Å | ||
| 123 | V | 91.9 | Very high | 80.9 | Confident | 81 Ų | 81 | 124.6 Ų | 124.6 | 49% | 0.491 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -53.6 | -40.5 | 177.2 | 177.1 | 0 | 0 | 0 | 0 | 110.3 | R126 R127 | V123-R126 VanDerWaalsContact CG2-NH2 3.31Å; V123-R126 PolarHBondContact O-N 3.35Å; V123-R127 WeakPolarHBondContact O-CG 3.4Å; V123-R127 PolarHBondContact O-N 3.03Å |
| 124 | Q | 92.8 | Very high | 83.4 | Confident | 134 Ų | 134 | 126.3 Ų | 126.3 | 63% | 0.626 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -63.2 | -43.7 | 177.9 | -170.5 | 62.1 | 9.9 | 0 | 0 | 112.7 | S122 R126 R127 K128 | S122-Q124 PolarHBondContact O-N 3.27Å; Q124-R126 VanDerWaalsContact C-N 3.31Å; Q124-R126 PolarHBondContact O-N 2.96Å; Q124-R127 PolarHBondContact O-N 3.32Å; Q124-K128 PolarHBondContact O-N 2.93Å |
| 125 | R | 96.1 | Very high | 85.4 | Confident | 155 Ų | 155 | 120.7 Ų | 120.7 | 59% | 0.585 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63.1 | -40.2 | 176.2 | -173.8 | 176.4 | 176.5 | -172.7 | 0.7 | 111.2 | M121 S122 A129 | M121-R125 PolarHBondContact SD-NH1 3.29Å; S122-R125 PolarHBondContact O-N 3.4Å; S122-R125 VanDerWaalsContact O-N 3.09Å; S122-R125 WeakPolarHBondContact OG-CB 3.36Å; S122-R125 PolarHBondContact OG-N 3.46Å; S122-R125 VanDerWaalsContact OG-N 3.16Å; R125-A129 WeakPolarHBondContact O-CB 3.46Å; R125-A129 PolarHBondContact O-N 2.91Å |
| 126 | R | 96.8 | Very high | 87.8 | Confident | 115 Ų | 115 | 119.6 Ų | 119.6 | 43% | 0.434 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -62.1 | -46.1 | 175.1 | -71.4 | -173.1 | -76.5 | 147.4 | -0.8 | 111.6 | M121 S122 V123 Q124 A129 S130 | M121-R126 HydrophobicContact CB-CG 4.09Å; M121-R126 PolarHBondContact O-NE 2.92Å; S122-R126 PolarHBondContact O-N 3.11Å; V123-R126 VanDerWaalsContact CG2-NH2 3.31Å; V123-R126 PolarHBondContact O-N 3.35Å; Q124-R126 VanDerWaalsContact C-N 3.31Å; Q124-R126 PolarHBondContact O-N 2.96Å; R126-A129 PolarHBondContact O-N 3.12Å; R126-S130 PolarHBondContact O-N 2.88Å; R126-S130 PolarHBondContact O-OG 3.34Å |
| 127 | R | 96.6 | Very high | 89.8 | Confident | 170 Ų | 170 | 120.4 Ų | 120.4 | 64% | 0.642 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -58.4 | -50.1 | 177.1 | -73.9 | -179.4 | 178.8 | -165.4 | -0.1 | 112.4 | V123 Q124 A129 S130 E131 | V123-R127 WeakPolarHBondContact O-CG 3.4Å; V123-R127 PolarHBondContact O-N 3.03Å; Q124-R127 PolarHBondContact O-N 3.32Å; R127-A129 VanDerWaalsContact C-N 3.3Å; R127-A129 PolarHBondContact O-N 3.14Å; R127-S130 PolarHBondContact O-N 3.2Å; R127-E131 PolarHBondContact O-N 2.83Å |
| 128 | K | 97.6 | Very high | 92 | Very high | 156 Ų | 156 | 119.9 Ų | 119.9 | 68% | 0.678 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -58.9 | -40.6 | 177.2 | -175.4 | 175.9 | -179.3 | 175.7 | 0 | 112.1 | Q124 R132 | Q124-K128 PolarHBondContact O-N 2.93Å; K128-R132 PolarHBondContact O-N 3.45Å; K128-R132 VanDerWaalsContact O-N 3.12Å |
| 129 | A | 97.2 | Very high | 93.7 | Very high | 60 Ų | 60 | 117.2 Ų | 117.2 | 50% | 0.496 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.7 | -42.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | R125 R126 R127 R132 E133 | R125-A129 WeakPolarHBondContact O-CB 3.46Å; R125-A129 PolarHBondContact O-N 2.91Å; R126-A129 PolarHBondContact O-N 3.12Å; R127-A129 VanDerWaalsContact C-N 3.3Å; R127-A129 PolarHBondContact O-N 3.14Å; A129-R132 PolarHBondContact O-N 3.26Å; A129-E133 PolarHBondContact O-N 3.21Å |
| 130 | S | 98.1 | Very high | 95.3 | Very high | 81 Ų | 81 | 116.2 Ų | 116.2 | 57% | 0.566 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.7 | -39.8 | 176.7 | -63.3 | 0 | 0 | 0 | 0 | 112.7 | R126 R127 E133 K134 | R126-S130 PolarHBondContact O-N 2.88Å; R126-S130 PolarHBondContact O-OG 3.34Å; R127-S130 PolarHBondContact O-N 3.2Å; S130-E133 PolarHBondContact O-N 3.01Å; S130-K134 WeakPolarHBondContact O-CB 3.48Å; S130-K134 PolarHBondContact O-N 2.89Å |
| 131 | E | 98.6 | Very high | 96.2 | Very high | 124 Ų | 124 | 108.1 Ų | 108.1 | 58% | 0.579 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.4 | -44.8 | 175.3 | -171.8 | -168.4 | 177 | 0 | 0 | 111.5 | R127 E133 K134 L135 | R127-E131 PolarHBondContact O-N 2.83Å; E131-E133 VanDerWaalsContact C-N 3.32Å; E131-E133 PolarHBondContact O-N 2.93Å; E131-K134 WeakPolarHBondContact O-CB 3.39Å; E131-K134 PolarHBondContact O-N 2.68Å; E131-L135 PolarHBondContact O-N 3.12Å |
| 132 | R | 98.6 | Very high | 97.1 | Very high | 196 Ų | 196 | 109.5 Ų | 109.5 | 74% | 0.74 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -59.1 | -43.6 | 175.2 | -178.7 | 176.5 | 176.9 | -110.1 | 3.2 | 111.8 | K128 A129 K134 L135 R136 | K128-R132 PolarHBondContact O-N 3.45Å; K128-R132 VanDerWaalsContact O-N 3.12Å; A129-R132 PolarHBondContact O-N 3.26Å; R132-K134 VanDerWaalsContact C-N 3.32Å; R132-K134 PolarHBondContact O-N 3Å; R132-L135 PolarHBondContact O-N 3.33Å; R132-R136 PolarHBondContact O-N 3.09Å |
| 133 | E | 98.6 | Very high | 97.5 | Very high | 76 Ų | 76 | 108.9 Ų | 108.9 | 36% | 0.355 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.5 | -36.1 | 177.8 | -172.6 | 58.1 | -158.4 | 0 | 0 | 112 | A129 S130 E131 L135 R136 M137 | A129-E133 PolarHBondContact O-N 3.21Å; S130-E133 PolarHBondContact O-N 3.01Å; E131-E133 VanDerWaalsContact C-N 3.32Å; E131-E133 PolarHBondContact O-N 2.93Å; E133-L135 VanDerWaalsContact C-N 3.35Å; E133-L135 PolarHBondContact O-N 2.82Å; E133-R136 WeakPolarHBondContact O-CB 3.33Å; E133-R136 PolarHBondContact O-N 3.07Å; E133-R136 IonicContact OE1-CZ 3.87Å; E133-R136 IonicContact OE1-NH1 2.71Å; E133-R136 PolarHBondContact OE1-NH1 3.01Å; E133-R136 WeakPolarHBondContact OE2-CD 3.45Å; E133-R136 IonicContact OE2-NH1 2.75Å; E133-M137 WeakPolarHBondContact O-CG 3.27Å; E133-M137 PolarHBondContact O-N 3.07Å; E133-M137 WeakPolarHBondContact OE1-CE 3.42Å |
| 134 | K | 98.6 | Very high | 97.8 | Very high | 125 Ų | 125 | 106.3 Ų | 106.3 | 54% | 0.543 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60 | -44.9 | 173.3 | -174.7 | -178.6 | -175.8 | -179.1 | 0 | 111.4 | S130 E131 R132 M137 R138 | S130-K134 WeakPolarHBondContact O-CB 3.48Å; S130-K134 PolarHBondContact O-N 2.89Å; E131-K134 WeakPolarHBondContact O-CB 3.39Å; E131-K134 PolarHBondContact O-N 2.68Å; R132-K134 VanDerWaalsContact C-N 3.32Å; R132-K134 PolarHBondContact O-N 3Å; K134-M137 PolarHBondContact O-N 3.49Å; K134-R138 WeakPolarHBondContact O-CG 3.46Å; K134-R138 PolarHBondContact O-N 3.44Å |
| 135 | L | 98.7 | Very high | 98 | Very high | 87 Ų | 87 | 104.5 Ų | 104.5 | 46% | 0.455 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.6 | -43.8 | 175.4 | -70.7 | 174.7 | 0 | 0 | 0 | 111.5 | E131 R132 E133 M137 R138 T139 | E131-L135 PolarHBondContact O-N 3.12Å; R132-L135 PolarHBondContact O-N 3.33Å; E133-L135 VanDerWaalsContact C-N 3.35Å; E133-L135 PolarHBondContact O-N 2.82Å; L135-M137 VanDerWaalsContact C-N 3.33Å; L135-M137 PolarHBondContact O-N 3.42Å; L135-R138 WeakPolarHBondContact O-CB 3.5Å; L135-R138 PolarHBondContact O-N 3.37Å; L135-T139 PolarHBondContact O-N 2.98Å; L135-T139 VanDerWaalsContact O-N 3.1Å; L135-T139 PolarHBondContact O-OG1 3.32Å |
| 136 | R | 98.6 | Very high | 98 | Very high | 139 Ų | 139 | 100.5 Ų | 100.5 | 53% | 0.525 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -56.5 | -46.8 | 174.3 | -177.4 | -176.7 | 169.6 | -113.8 | -0.7 | 111.7 | R132 E133 R138 T139 L140 | R132-R136 PolarHBondContact O-N 3.09Å; E133-R136 WeakPolarHBondContact O-CB 3.33Å; E133-R136 PolarHBondContact O-N 3.07Å; E133-R136 IonicContact OE1-CZ 3.87Å; E133-R136 IonicContact OE1-NH1 2.71Å; E133-R136 PolarHBondContact OE1-NH1 3.01Å; E133-R136 WeakPolarHBondContact OE2-CD 3.45Å; E133-R136 IonicContact OE2-NH1 2.75Å; R136-R138 VanDerWaalsContact C-N 3.34Å; R136-R138 PolarHBondContact O-N 2.76Å; R136-T139 PolarHBondContact O-N 3.38Å; R136-L140 WeakPolarHBondContact O-CG 3.46Å; R136-L140 PolarHBondContact O-N 3.36Å; R136-L140 VanDerWaalsContact O-N 3.12Å |
| 137 | M | 98.8 | Very high | 98.1 | Very high | 76 Ų | 76 | 97.4 Ų | 97.4 | 37% | 0.374 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.7 | -33.6 | 178.4 | -72.1 | -59.3 | 96.1 | 0 | 0 | 113.4 | E133 K134 L135 L140 A141 | E133-M137 WeakPolarHBondContact O-CG 3.27Å; E133-M137 PolarHBondContact O-N 3.07Å; E133-M137 WeakPolarHBondContact OE1-CE 3.42Å; K134-M137 PolarHBondContact O-N 3.49Å; L135-M137 VanDerWaalsContact C-N 3.33Å; L135-M137 PolarHBondContact O-N 3.42Å; M137-L140 HydrophobicContact CE-CD1 3.26Å; M137-L140 HydrophobicContact CE-CG 4.09Å; M137-L140 PolarHBondContact O-N 2.94Å; M137-L140 HydrophobicContact SD-CD1 4.23Å; M137-A141 PolarHBondContact O-N 3.16Å |
| 138 | R | 98.6 | Very high | 98 | Very high | 128 Ų | 128 | 91 Ų | 91 | 48% | 0.483 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -61.6 | -51 | 172.7 | -74.2 | 170.3 | 175.5 | -179.1 | -6.5 | 111.1 | K134 L135 R136 L140 A141 D142 | K134-R138 WeakPolarHBondContact O-CG 3.46Å; K134-R138 PolarHBondContact O-N 3.44Å; L135-R138 WeakPolarHBondContact O-CB 3.5Å; L135-R138 PolarHBondContact O-N 3.37Å; R136-R138 VanDerWaalsContact C-N 3.34Å; R136-R138 PolarHBondContact O-N 2.76Å; R138-L140 VanDerWaalsContact C-N 3.27Å; R138-L140 PolarHBondContact O-N 3.41Å; R138-A141 WeakPolarHBondContact O-CA 3.46Å; R138-A141 WeakPolarHBondContact O-CB 3.49Å; R138-A141 PolarHBondContact O-N 2.92Å; R138-D142 PolarHBondContact O-N 3.48Å |
| 139 | T | 98.6 | Very high | 97.9 | Very high | 95 Ų | 95 | 90 Ų | 90 | 58% | 0.583 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -57.2 | -40.2 | 177.2 | -53.5 | 0 | 0 | 0 | 0 | 112.3 | L135 R136 D142 A143 | L135-T139 PolarHBondContact O-N 2.98Å; L135-T139 VanDerWaalsContact O-N 3.1Å; L135-T139 PolarHBondContact O-OG1 3.32Å; R136-T139 PolarHBondContact O-N 3.38Å; T139-D142 PolarHBondContact O-N 2.86Å; T139-A143 WeakPolarHBondContact O-CB 3.46Å; T139-A143 PolarHBondContact O-N 3.15Å |
| 140 | L | 98.4 | Very high | 97.8 | Very high | 92 Ų | 92 | 95 Ų | 95 | 48% | 0.482 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -65.6 | -38.4 | 175.5 | -65.9 | -169.5 | 0 | 0 | 0 | 112.7 | R136 M137 R138 L144 | R136-L140 WeakPolarHBondContact O-CG 3.46Å; R136-L140 PolarHBondContact O-N 3.36Å; R136-L140 VanDerWaalsContact O-N 3.12Å; M137-L140 HydrophobicContact CE-CD1 3.26Å; M137-L140 HydrophobicContact CE-CG 4.09Å; M137-L140 PolarHBondContact O-N 2.94Å; M137-L140 HydrophobicContact SD-CD1 4.23Å; R138-L140 VanDerWaalsContact C-N 3.27Å; R138-L140 PolarHBondContact O-N 3.41Å; L140-L144 WeakPolarHBondContact O-CB 3.36Å; L140-L144 PolarHBondContact O-N 2.76Å; L140-L144 VanDerWaalsContact O-N 3.09Å |
| 141 | A | 98 | Very high | 97.7 | Very high | 35 Ų | 35 | 91.7 Ų | 91.7 | 29% | 0.289 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.4 | -44.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111 | M137 R138 L144 H145 | M137-A141 PolarHBondContact O-N 3.16Å; R138-A141 WeakPolarHBondContact O-CA 3.46Å; R138-A141 WeakPolarHBondContact O-CB 3.49Å; R138-A141 PolarHBondContact O-N 2.92Å; A141-L144 WeakPolarHBondContact O-CB 3.33Å; A141-L144 PolarHBondContact O-N 3.29Å; A141-H145 PolarHBondContact O-CD2 3.43Å; A141-H145 PolarHBondContact O-N 3.38Å |
| 142 | D | 98.3 | Very high | 97.5 | Very high | 102 Ų | 102 | 87.1 Ų | 87.1 | 55% | 0.545 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.1 | -46.9 | 178.7 | -64 | -19.3 | 0 | 0 | 0 | 111.2 | R138 T139 L144 H145 T146 | R138-D142 PolarHBondContact O-N 3.48Å; T139-D142 PolarHBondContact O-N 2.86Å; D142-L144 VanDerWaalsContact C-N 3.28Å; D142-L144 PolarHBondContact O-N 3.28Å; D142-H145 WeakPolarHBondContact O-CB 3.38Å; D142-H145 PolarHBondContact O-N 3.23Å; D142-T146 PolarHBondContact O-N 3.37Å; D142-T146 PolarHBondContact O-OG1 3.01Å |
| 143 | A | 98.4 | Very high | 97.1 | Very high | 60 Ų | 60 | 83.2 Ų | 83.2 | 50% | 0.496 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -58.7 | -40.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | T139 T146 L147 | T139-A143 WeakPolarHBondContact O-CB 3.46Å; T139-A143 PolarHBondContact O-N 3.15Å; A143-T146 PolarHBondContact O-N 3.1Å; A143-L147 PolarHBondContact O-N 3.4Å |
| 144 | L | 97.6 | Very high | 96.7 | Very high | 26 Ų | 26 | 85.5 Ų | 85.5 | 14% | 0.136 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -68.1 | -33.9 | 176.1 | -168.6 | 82.1 | 0 | 0 | 0 | 112 | L140 A141 D142 L147 R148 K164 T167 L168 | L140-L144 WeakPolarHBondContact O-CB 3.36Å; L140-L144 PolarHBondContact O-N 2.76Å; L140-L144 VanDerWaalsContact O-N 3.09Å; A141-L144 WeakPolarHBondContact O-CB 3.33Å; A141-L144 PolarHBondContact O-N 3.29Å; D142-L144 VanDerWaalsContact C-N 3.28Å; D142-L144 PolarHBondContact O-N 3.28Å; L144-L147 PolarHBondContact O-N 3.15Å; L144-R148 VanDerWaalsContact CD2-NH2 3.31Å; L144-R148 WeakPolarHBondContact O-CG 3.24Å; L144-R148 PolarHBondContact O-N 3Å; L144-R148 PolarHBondContact O-NH1 3.5Å; L144-K164 HydrophobicContact CD2-CB 4Å; L144-K164 HydrophobicContact CD2-CD 4.14Å; L144-K164 HydrophobicContact CD2-CG 3.58Å; L144-T167 HydrophobicContact CD1-CG2 4.13Å; L144-T167 HydrophobicContact CG-CG2 4.46Å; L144-L168 HydrophobicContact CD1-CD2 4.48Å |
| 145 | H | 96.6 | Very high | 96.3 | Very high | 97 Ų | 97 | 80.9 Ų | 80.9 | 45% | 0.449 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -67.5 | -45.8 | 173.3 | -77.5 | -62.8 | 0 | 0 | 0 | 111.3 | A141 D142 L147 R148 N149 | A141-H145 PolarHBondContact O-CD2 3.43Å; A141-H145 PolarHBondContact O-N 3.38Å; D142-H145 WeakPolarHBondContact O-CB 3.38Å; D142-H145 PolarHBondContact O-N 3.23Å; H145-L147 PolarHBondContact O-N 2.92Å; H145-R148 PolarHBondContact ND1-NH1 3.12Å; H145-R148 WeakPolarHBondContact O-CB 3.36Å; H145-R148 PolarHBondContact O-N 3.01Å; H145-N149 PolarHBondContact O-N 2.98Å |
| 146 | T | 97.4 | Very high | 95.7 | Very high | 71 Ų | 71 | 78.6 Ų | 78.6 | 44% | 0.436 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -55.7 | -41.7 | 172.7 | -59.8 | 0 | 0 | 0 | 0 | 111.5 | D142 A143 R148 N149 Y150 | D142-T146 PolarHBondContact O-N 3.37Å; D142-T146 PolarHBondContact O-OG1 3.01Å; A143-T146 PolarHBondContact O-N 3.1Å; T146-R148 VanDerWaalsContact C-N 3.3Å; T146-R148 PolarHBondContact O-N 3.47Å; T146-N149 WeakPolarHBondContact O-CB 3.49Å; T146-N149 PolarHBondContact O-N 3.18Å; T146-N149 VanDerWaalsContact O-N 3.12Å; T146-Y150 HydrophobicContact CG2-CE2 3.85Å; T146-Y150 VanDerWaalsContact O-CD2 3.3Å; T146-Y150 WeakPolarHBondContact O-CD2 3.22Å |
| 147 | L | 97.5 | Very high | 94.8 | Very high | 49 Ų | 49 | 78.8 Ų | 78.8 | 26% | 0.257 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -59.4 | -38.6 | 176.2 | -178.5 | 58.2 | 0 | 0 | 0 | 112.8 | A143 L144 H145 N149 Y150 T167 L168 T171 | A143-L147 PolarHBondContact O-N 3.4Å; L144-L147 PolarHBondContact O-N 3.15Å; H145-L147 PolarHBondContact O-N 2.92Å; L147-N149 VanDerWaalsContact C-N 3.25Å; L147-N149 PolarHBondContact O-N 3.33Å; L147-Y150 PolarHBondContact O-N 3.12Å; L147-T167 HydrophobicContact CB-CG2 4.42Å; L147-T167 HydrophobicContact CD2-CG2 3.89Å; L147-T167 HydrophobicContact CG-CG2 3.98Å; L147-L168 HydrophobicContact CD2-CD2 4.45Å; L147-T171 HydrophobicContact CD1-CG2 3.85Å; L147-T171 HydrophobicContact CD2-CG2 4.38Å |
| 148 | R | 95.9 | Very high | 93.4 | Very high | 36 Ų | 36 | 86.8 Ų | 86.8 | 14% | 0.136 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -64.2 | -30.6 | 177.3 | -67.9 | 175.4 | -175.4 | 95.1 | -12 | 112.8 | L144 H145 T146 Y150 L151 L162 T167 | L144-R148 VanDerWaalsContact CD2-NH2 3.31Å; L144-R148 WeakPolarHBondContact O-CG 3.24Å; L144-R148 PolarHBondContact O-N 3Å; L144-R148 PolarHBondContact O-NH1 3.5Å; H145-R148 PolarHBondContact ND1-NH1 3.12Å; H145-R148 WeakPolarHBondContact O-CB 3.36Å; H145-R148 PolarHBondContact O-N 3.01Å; T146-R148 VanDerWaalsContact C-N 3.3Å; T146-R148 PolarHBondContact O-N 3.47Å; R148-Y150 PolarHBondContact O-N 3.48Å; R148-L151 PolarHBondContact O-N 3.03Å; R148-L151 VanDerWaalsContact O-N 3.09Å; R148-L162 VanDerWaalsContact CZ-O 3.29Å; R148-L162 PolarHBondContact NE-O 2.83Å; R148-L162 PolarHBondContact NH2-O 3.3Å; R148-T167 HydrophobicContact CG-CG2 3.66Å; R148-T167 PolarHBondContact NE-OG1 3.3Å |
| 149 | N | 94.9 | Very high | 92.2 | Very high | 134 Ų | 134 | 84.1 Ų | 84.1 | 72% | 0.717 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -67.3 | -22.2 | 178.9 | -61.7 | -18.4 | 0 | 0 | 0 | 112.5 | H145 T146 L147 | H145-N149 PolarHBondContact O-N 2.98Å; T146-N149 WeakPolarHBondContact O-CB 3.49Å; T146-N149 PolarHBondContact O-N 3.18Å; T146-N149 VanDerWaalsContact O-N 3.12Å; L147-N149 VanDerWaalsContact C-N 3.25Å; L147-N149 PolarHBondContact O-N 3.33Å |
| 150 | Y | 95.9 | Very high | 91.5 | Very high | 166 Ų | 166 | 86.1 Ų | 86.1 | 65% | 0.651 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.1 | -8.2 | 174.8 | -64.1 | -64.6 | 0 | 0 | 0 | 113.5 | T146 L147 R148 Y174 | T146-Y150 HydrophobicContact CG2-CE2 3.85Å; T146-Y150 VanDerWaalsContact O-CD2 3.3Å; T146-Y150 WeakPolarHBondContact O-CD2 3.22Å; L147-Y150 PolarHBondContact O-N 3.12Å; R148-Y150 PolarHBondContact O-N 3.48Å; Y150-Y174 WeakPolarHBondContact O-CE1 2.97Å |
| 151 | L | 95.6 | Very high | 90.9 | Very high | 12 Ų | 12 | 86.3 Ų | 86.3 | 6% | 0.063 | 47% | 0.468 | C | S | . | . | S | Bend | trans | -83.6 | 134.5 | 178.9 | -68.3 | 177.6 | 0 | 0 | 0 | 110.6 | R148 L162 T167 Y174 | R148-L151 PolarHBondContact O-N 3.03Å; R148-L151 VanDerWaalsContact O-N 3.09Å; L151-L162 HydrophobicContact CD1-CD1 3.59Å; L151-T167 HydrophobicContact CD1-CG2 3.99Å; L151-Y174 HydrophobicContact CD2-CD1 4.43Å |
| 152 | P | 93.9 | Very high | 90.7 | Very high | 28 Ų | 28 | 85 Ų | 85 | 18% | 0.182 | 46% | 0.456 | C | S | . | . | trans | -51.4 | 138.9 | 173.3 | -31.5 | 35.8 | 0 | 0 | 0 | 112.9 | V154 Y155 Y174 | P152-V154 HydrophobicContact CB-CG2 3.75Å; P152-V154 PolarHBondContact O-N 2.86Å; P152-Y155 HydrophobicContact CB-CD2 3.88Å; P152-Y155 HydrophobicContact CB-CE2 3.97Å; P152-Y155 HydrophobicContact CG-CD2 4.07Å; P152-Y155 HydrophobicContact CG-CE2 3.78Å; P152-Y155 PolarHBondContact O-N 3.18Å; P152-Y174 HydrophobicContact CG-CD1 4.47Å; P152-Y174 HydrophobicContact CG-CD2 3.7Å; P152-Y174 HydrophobicContact CG-CE1 4.19Å; P152-Y174 HydrophobicContact CG-CE2 3.4Å; P152-Y174 VanDerWaalsContact CG-CE2 3.4Å; P152-Y174 HydrophobicContact CG-CG 4.24Å | ||
| 153 | P | 90.1 | Very high | 90.6 | Very high | 113 Ų | 113 | 83.6 Ų | 83.6 | 73% | 0.734 | 45% | 0.451 | S | S | * | . | G | 310 helix | trans | -56.9 | -25.7 | -179.9 | -27.1 | 34.5 | 0 | 0 | 0 | 114.1 | Y155 S156 | P153-Y155 PolarHBondContact O-N 2.93Å; P153-S156 PolarHBondContact O-N 3.42Å |
| 154 | V | 90.4 | Very high | 90.5 | Very high | 124 Ų | 124 | 87.6 Ų | 87.6 | 75% | 0.752 | 46% | 0.457 | S | S | * | . | G | 310 helix | trans | -59.1 | -25.7 | 177.2 | -63.5 | 0 | 0 | 0 | 0 | 113.5 | P152 | P152-V154 HydrophobicContact CB-CG2 3.75Å; P152-V154 PolarHBondContact O-N 2.86Å |
| 155 | Y | 90.3 | Very high | 90.5 | Very high | 29 Ų | 29 | 91.8 Ų | 91.8 | 11% | 0.114 | 48% | 0.479 | C | S | . | . | G | 310 helix | trans | -81.9 | -24 | 175.4 | -61.4 | -61.5 | 0 | 0 | 0 | 112.5 | P152 P153 Q157 L162 Y170 Y174 E177 | P152-Y155 HydrophobicContact CB-CD2 3.88Å; P152-Y155 HydrophobicContact CB-CE2 3.97Å; P152-Y155 HydrophobicContact CG-CD2 4.07Å; P152-Y155 HydrophobicContact CG-CE2 3.78Å; P152-Y155 PolarHBondContact O-N 3.18Å; P153-Y155 PolarHBondContact O-N 2.93Å; Y155-Q157 PolarHBondContact O-N 3.34Å; Y155-L162 WeakPolarHBondContact O-CD2 3.37Å; Y155-Y170 AromaticContact CD1-CD1 3.68Å; Y155-Y170 HydrophobicContact CD1-CD1 3.68Å; Y155-Y170 HydrophobicContact CD1-CD2 4.45Å; Y155-Y170 HydrophobicContact CD1-CE1 4.02Å; Y155-Y170 AromaticContact CD1-CG 3.93Å; Y155-Y170 HydrophobicContact CD1-CG 3.93Å; Y155-Y170 HydrophobicContact CE1-CD1 4.17Å; Y155-Y170 HydrophobicContact CG-CD1 4.23Å; Y155-Y170 HydrophobicContact CG-CD2 4.28Å; Y155-Y170 AromaticContact CG-CG 3.99Å; Y155-Y170 HydrophobicContact CG-CG 3.99Å; Y155-Y174 HydrophobicContact CE2-CD2 4.41Å; Y155-E177 VanDerWaalsContact OH-CD 3.27Å; Y155-E177 PolarHBondContact OH-OE1 3.27Å; Y155-E177 PolarHBondContact OH-OE2 2.89Å |
| 156 | S | 86.1 | Confident | 90.5 | Very high | 38 Ų | 38 | 90.5 Ų | 90.5 | 27% | 0.266 | 47% | 0.473 | S | S | . | . | S | Bend | trans | -88.1 | 85.6 | 179.6 | -61.5 | 0 | 0 | 0 | 0 | 110 | P153 R158 | P153-S156 PolarHBondContact O-N 3.42Å; S156-R158 PolarHBondContact O-N 3.41Å |
| 157 | Q | 78.5 | Confident | 90.5 | Very high | 143 Ų | 143 | 87.1 Ų | 87.1 | 67% | 0.668 | 45% | 0.452 | S | S | * | . | G | 310 helix | trans | -62.8 | 124.4 | -179.5 | -65.7 | 179 | -12.8 | 0 | 0 | 111 | Y155 G159 Q160 | Y155-Q157 PolarHBondContact O-N 3.34Å; Q157-G159 VanDerWaalsContact C-N 3.32Å; Q157-G159 PolarHBondContact O-N 2.96Å; Q157-Q160 PolarHBondContact O-N 2.99Å |
| 158 | R | 70.4 | Confident | 90.5 | Very high | 244 Ų | 244 | 89 Ų | 89 | 92% | 0.921 | 46% | 0.462 | S | S | * | . | G | 310 helix | trans | 59.2 | 31.8 | 167.9 | -61.8 | -175.5 | 172.7 | -177.7 | -2.1 | 115.8 | S156 Q160 | S156-R158 PolarHBondContact O-N 3.41Å; R158-Q160 PolarHBondContact O-N 3.47Å; R158-Q160 VanDerWaalsContact O-N 3.15Å |
| 159 | G | 72.7 | Confident | 90.6 | Very high | 73 Ų | 73 | 93.8 Ų | 93.8 | 75% | 0.753 | 48% | 0.484 | S | S | * | . | G | 310 helix | trans | 69.3 | 10.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | Q157 | Q157-G159 VanDerWaalsContact C-N 3.32Å; Q157-G159 PolarHBondContact O-N 2.96Å |
| 160 | Q | 84.4 | Confident | 90.7 | Very high | 136 Ų | 136 | 90 Ų | 90 | 64% | 0.636 | 46% | 0.46 | S | S | * | . | P | Polyproline II helix | trans | -83.7 | 138.4 | 172.9 | -67.6 | -63.6 | -27.4 | 0 | 0 | 110.2 | Q157 R158 | Q157-Q160 PolarHBondContact O-N 2.99Å; R158-Q160 PolarHBondContact O-N 3.47Å; R158-Q160 VanDerWaalsContact O-N 3.15Å |
| 161 | P | 85.3 | Confident | 90.8 | Very high | 96 Ų | 96 | 83.1 Ų | 83.1 | 62% | 0.623 | 44% | 0.435 | S | S | * | . | P | Polyproline II helix | trans | -68.6 | 135.1 | 177.7 | 27.7 | -33 | 0 | 0 | 0 | 110.8 | ||
| 162 | L | 93.5 | Very high | 90.9 | Very high | 9 Ų | 9 | 88.3 Ų | 88.3 | 5% | 0.047 | 46% | 0.462 | C | S | . | . | P | Polyproline II helix | trans | -60.1 | 140.4 | 179 | -66.8 | 173.3 | 0 | 0 | 0 | 112.4 | R148 L151 Y155 Q166 T167 Y170 | R148-L162 VanDerWaalsContact CZ-O 3.29Å; R148-L162 PolarHBondContact NE-O 2.83Å; R148-L162 PolarHBondContact NH2-O 3.3Å; L151-L162 HydrophobicContact CD1-CD1 3.59Å; Y155-L162 WeakPolarHBondContact O-CD2 3.37Å; L162-Q166 HydrophobicContact CB-CB 4.4Å; L162-Q166 HydrophobicContact CD2-CB 4.21Å; L162-T167 WeakPolarHBondContact CB-OG1 3.48Å; L162-Y170 HydrophobicContact CD1-CD2 3.95Å; L162-Y170 HydrophobicContact CD2-CD2 3.94Å; L162-Y170 HydrophobicContact CD2-CE2 3.69Å |
| 163 | T | 96.1 | Very high | 91.1 | Very high | 72 Ų | 72 | 92.8 Ų | 92.8 | 44% | 0.442 | 48% | 0.478 | S | S | . | . | P | Polyproline II helix | trans | -64.6 | 163.7 | 168.9 | 64.6 | 0 | 0 | 0 | 0 | 111.2 | I165 Q166 T167 | T163-I165 VanDerWaalsContact C-N 3.32Å; T163-I165 PolarHBondContact O-N 3.35Å; T163-I165 WeakPolarHBondContact OG1-CG2 3.36Å; T163-Q166 PolarHBondContact O-N 3.07Å; T163-Q166 WeakPolarHBondContact OG1-CB 3.45Å; T163-Q166 VanDerWaalsContact OG1-CD 3.25Å; T163-Q166 WeakPolarHBondContact OG1-CG 3.49Å; T163-Q166 PolarHBondContact OG1-N 3.36Å; T163-Q166 PolarHBondContact OG1-OE1 3.02Å; T163-T167 WeakPolarHBondContact O-CB 3.41Å; T163-T167 PolarHBondContact O-N 2.96Å; T163-T167 PolarHBondContact O-OG1 3.18Å |
| 164 | K | 97.6 | Very high | 91.5 | Very high | 143 Ų | 143 | 90.7 Ų | 90.7 | 62% | 0.622 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -57 | -46.6 | 179 | -53.5 | -166.5 | 175.7 | 176.2 | 0 | 111.5 | L144 T167 L168 | L144-K164 HydrophobicContact CD2-CB 4Å; L144-K164 HydrophobicContact CD2-CD 4.14Å; L144-K164 HydrophobicContact CD2-CG 3.58Å; K164-T167 PolarHBondContact O-N 3.15Å; K164-L168 WeakPolarHBondContact O-CG 3.45Å; K164-L168 PolarHBondContact O-N 2.94Å; K164-L168 VanDerWaalsContact O-N 3.16Å |
| 165 | I | 97.4 | Very high | 91.8 | Very high | 114 Ų | 114 | 89.5 Ų | 89.5 | 59% | 0.585 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -67 | -41 | -179.2 | -169.8 | 63 | 0 | 0 | 0 | 112 | T163 L168 K169 | T163-I165 VanDerWaalsContact C-N 3.32Å; T163-I165 PolarHBondContact O-N 3.35Å; T163-I165 WeakPolarHBondContact OG1-CG2 3.36Å; I165-L168 PolarHBondContact O-N 3.34Å; I165-K169 HydrophobicContact CG1-CD 4.27Å; I165-K169 WeakPolarHBondContact O-CB 3.45Å; I165-K169 WeakPolarHBondContact O-CG 3.39Å; I165-K169 PolarHBondContact O-N 3.27Å |
| 166 | Q | 96.3 | Very high | 92.2 | Very high | 70 Ų | 70 | 89.5 Ų | 89.5 | 33% | 0.327 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -63.7 | -44.6 | 176.3 | -75 | 167.5 | -42.8 | 0 | 0 | 111.5 | L162 T163 L168 K169 Y170 | L162-Q166 HydrophobicContact CB-CB 4.4Å; L162-Q166 HydrophobicContact CD2-CB 4.21Å; T163-Q166 PolarHBondContact O-N 3.07Å; T163-Q166 WeakPolarHBondContact OG1-CB 3.45Å; T163-Q166 VanDerWaalsContact OG1-CD 3.25Å; T163-Q166 WeakPolarHBondContact OG1-CG 3.49Å; T163-Q166 PolarHBondContact OG1-N 3.36Å; T163-Q166 PolarHBondContact OG1-OE1 3.02Å; Q166-L168 VanDerWaalsContact C-N 3.31Å; Q166-L168 PolarHBondContact O-N 3.01Å; Q166-K169 PolarHBondContact O-N 2.75Å; Q166-Y170 HydrophobicContact CB-CD2 4.2Å; Q166-Y170 HydrophobicContact CB-CE2 3.95Å; Q166-Y170 HydrophobicContact CG-CE2 4.39Å; Q166-Y170 WeakPolarHBondContact O-CB 3.48Å; Q166-Y170 VanDerWaalsContact O-CD2 3.24Å; Q166-Y170 WeakPolarHBondContact O-CD2 3.35Å; Q166-Y170 PolarHBondContact O-N 3.03Å |
| 167 | T | 97.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 92.1 Ų | 92.1 | 0% | 0 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -55.3 | -48.1 | 178 | -53.5 | 0 | 0 | 0 | 0 | 110.6 | L144 L147 R148 L151 L162 T163 K164 T171 | L144-T167 HydrophobicContact CD1-CG2 4.13Å; L144-T167 HydrophobicContact CG-CG2 4.46Å; L147-T167 HydrophobicContact CB-CG2 4.42Å; L147-T167 HydrophobicContact CD2-CG2 3.89Å; L147-T167 HydrophobicContact CG-CG2 3.98Å; R148-T167 HydrophobicContact CG-CG2 3.66Å; R148-T167 PolarHBondContact NE-OG1 3.3Å; L151-T167 HydrophobicContact CD1-CG2 3.99Å; L162-T167 WeakPolarHBondContact CB-OG1 3.48Å; T163-T167 WeakPolarHBondContact O-CB 3.41Å; T163-T167 PolarHBondContact O-N 2.96Å; T163-T167 PolarHBondContact O-OG1 3.18Å; K164-T167 PolarHBondContact O-N 3.15Å; T167-T171 WeakPolarHBondContact O-CB 3.32Å; T167-T171 PolarHBondContact O-N 3.3Å; T167-T171 PolarHBondContact O-OG1 2.71Å |
| 168 | L | 98.3 | Very high | 93.6 | Very high | 89 Ų | 89 | 88.5 Ų | 88.5 | 47% | 0.466 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -65.3 | -45.2 | 179 | -64.2 | 176.4 | 0 | 0 | 0 | 112.1 | L144 L147 K164 I165 Q166 Y170 T171 I172 | L144-L168 HydrophobicContact CD1-CD2 4.48Å; L147-L168 HydrophobicContact CD2-CD2 4.45Å; K164-L168 WeakPolarHBondContact O-CG 3.45Å; K164-L168 PolarHBondContact O-N 2.94Å; K164-L168 VanDerWaalsContact O-N 3.16Å; I165-L168 PolarHBondContact O-N 3.34Å; Q166-L168 VanDerWaalsContact C-N 3.31Å; Q166-L168 PolarHBondContact O-N 3.01Å; L168-Y170 PolarHBondContact O-N 2.92Å; L168-T171 PolarHBondContact O-N 3.28Å; L168-I172 WeakPolarHBondContact O-CG1 3.41Å; L168-I172 PolarHBondContact O-N 2.87Å; L168-I172 VanDerWaalsContact O-N 3.12Å |
| 169 | K | 97.3 | Very high | 94.9 | Very high | 136 Ų | 136 | 80 Ų | 80 | 59% | 0.591 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -60.2 | -46.7 | 177.8 | -73.8 | -178.4 | 70.7 | 172.9 | 0 | 112.1 | I165 Q166 I172 K173 | I165-K169 HydrophobicContact CG1-CD 4.27Å; I165-K169 WeakPolarHBondContact O-CB 3.45Å; I165-K169 WeakPolarHBondContact O-CG 3.39Å; I165-K169 PolarHBondContact O-N 3.27Å; Q166-K169 PolarHBondContact O-N 2.75Å; K169-I172 PolarHBondContact O-N 2.93Å; K169-K173 PolarHBondContact O-N 3.2Å; K169-K173 VanDerWaalsContact O-N 3.15Å |
| 170 | Y | 97.2 | Very high | 96 | Very high | 55 Ų | 55 | 81.1 Ų | 81.1 | 22% | 0.216 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -70.4 | -33.5 | -179.8 | -64.1 | -39.4 | 0 | 0 | 0 | 112.6 | Y155 L162 Q166 L168 K173 Y174 | Y155-Y170 AromaticContact CD1-CD1 3.68Å; Y155-Y170 HydrophobicContact CD1-CD1 3.68Å; Y155-Y170 HydrophobicContact CD1-CD2 4.45Å; Y155-Y170 HydrophobicContact CD1-CE1 4.02Å; Y155-Y170 AromaticContact CD1-CG 3.93Å; Y155-Y170 HydrophobicContact CD1-CG 3.93Å; Y155-Y170 HydrophobicContact CE1-CD1 4.17Å; Y155-Y170 HydrophobicContact CG-CD1 4.23Å; Y155-Y170 HydrophobicContact CG-CD2 4.28Å; Y155-Y170 AromaticContact CG-CG 3.99Å; Y155-Y170 HydrophobicContact CG-CG 3.99Å; L162-Y170 HydrophobicContact CD1-CD2 3.95Å; L162-Y170 HydrophobicContact CD2-CD2 3.94Å; L162-Y170 HydrophobicContact CD2-CE2 3.69Å; Q166-Y170 HydrophobicContact CB-CD2 4.2Å; Q166-Y170 HydrophobicContact CB-CE2 3.95Å; Q166-Y170 HydrophobicContact CG-CE2 4.39Å; Q166-Y170 WeakPolarHBondContact O-CB 3.48Å; Q166-Y170 VanDerWaalsContact O-CD2 3.24Å; Q166-Y170 WeakPolarHBondContact O-CD2 3.35Å; Q166-Y170 PolarHBondContact O-N 3.03Å; L168-Y170 PolarHBondContact O-N 2.92Å; Y170-K173 PolarHBondContact O-N 2.95Å; Y170-Y174 VanDerWaalsContact O-CB 3.27Å; Y170-Y174 WeakPolarHBondContact O-CB 3.44Å; Y170-Y174 PolarHBondContact O-N 3.01Å |
| 171 | T | 98.1 | Very high | 96.5 | Very high | 22 Ų | 22 | 80.3 Ų | 80.3 | 14% | 0.135 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -59.8 | -47.5 | 173.1 | -58.3 | 0 | 0 | 0 | 0 | 111.3 | L147 T167 L168 K173 Y174 I175 | L147-T171 HydrophobicContact CD1-CG2 3.85Å; L147-T171 HydrophobicContact CD2-CG2 4.38Å; T167-T171 WeakPolarHBondContact O-CB 3.32Å; T167-T171 PolarHBondContact O-N 3.3Å; T167-T171 PolarHBondContact O-OG1 2.71Å; L168-T171 PolarHBondContact O-N 3.28Å; T171-K173 VanDerWaalsContact C-N 3.35Å; T171-K173 PolarHBondContact O-N 3.3Å; T171-Y174 PolarHBondContact O-N 3Å; T171-I175 HydrophobicContact CG2-CD1 3.86Å; T171-I175 HydrophobicContact CG2-CG1 4.47Å; T171-I175 WeakPolarHBondContact O-CG1 3.1Å; T171-I175 PolarHBondContact O-N 3.44Å |
| 172 | I | 98.1 | Very high | 97 | Very high | 120 Ų | 120 | 81.9 Ų | 81.9 | 62% | 0.615 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -60.7 | -46.3 | 178.3 | -65.7 | 164.7 | 0 | 0 | 0 | 110.4 | L168 K169 Y174 G176 | L168-I172 WeakPolarHBondContact O-CG1 3.41Å; L168-I172 PolarHBondContact O-N 2.87Å; L168-I172 VanDerWaalsContact O-N 3.12Å; K169-I172 PolarHBondContact O-N 2.93Å; I172-Y174 PolarHBondContact O-N 3.27Å; I172-G176 PolarHBondContact O-N 3.09Å; I172-G176 VanDerWaalsContact O-N 3.12Å |
| 173 | K | 97.6 | Very high | 97.1 | Very high | 123 Ų | 123 | 86 Ų | 86 | 54% | 0.535 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -59.5 | -46.8 | 176.4 | -72.1 | -163.3 | 70 | 176.2 | 0 | 112.2 | K169 Y170 T171 G176 E177 | K169-K173 PolarHBondContact O-N 3.2Å; K169-K173 VanDerWaalsContact O-N 3.15Å; Y170-K173 PolarHBondContact O-N 2.95Å; T171-K173 VanDerWaalsContact C-N 3.35Å; T171-K173 PolarHBondContact O-N 3.3Å; K173-G176 WeakPolarHBondContact O-CA 3.16Å; K173-G176 PolarHBondContact O-N 3.16Å; K173-G176 VanDerWaalsContact O-N 3.14Å; K173-E177 WeakPolarHBondContact O-CG 3.08Å; K173-E177 PolarHBondContact O-N 2.92Å |
| 174 | Y | 97.9 | Very high | 96.8 | Very high | 69 Ų | 69 | 91.9 Ų | 91.9 | 27% | 0.271 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -66.4 | -41.3 | -176 | -176 | -129.7 | 0 | 0 | 0 | 112.2 | Y150 L151 P152 Y155 Y170 T171 I172 G176 E177 L178 | Y150-Y174 WeakPolarHBondContact O-CE1 2.97Å; L151-Y174 HydrophobicContact CD2-CD1 4.43Å; P152-Y174 HydrophobicContact CG-CD1 4.47Å; P152-Y174 HydrophobicContact CG-CD2 3.7Å; P152-Y174 HydrophobicContact CG-CE1 4.19Å; P152-Y174 HydrophobicContact CG-CE2 3.4Å; P152-Y174 VanDerWaalsContact CG-CE2 3.4Å; P152-Y174 HydrophobicContact CG-CG 4.24Å; Y155-Y174 HydrophobicContact CE2-CD2 4.41Å; Y170-Y174 VanDerWaalsContact O-CB 3.27Å; Y170-Y174 WeakPolarHBondContact O-CB 3.44Å; Y170-Y174 PolarHBondContact O-N 3.01Å; T171-Y174 PolarHBondContact O-N 3Å; I172-Y174 PolarHBondContact O-N 3.27Å; Y174-G176 VanDerWaalsContact C-N 3.27Å; Y174-G176 PolarHBondContact O-N 3.19Å; Y174-E177 PolarHBondContact O-N 3.29Å; Y174-L178 HydrophobicContact CD1-CD1 4.09Å; Y174-L178 HydrophobicContact CD2-CD1 4.47Å; Y174-L178 HydrophobicContact CD2-CG 4.22Å; Y174-L178 HydrophobicContact CE1-CD1 3.69Å; Y174-L178 HydrophobicContact CE1-CG 4.39Å; Y174-L178 HydrophobicContact CE2-CD1 4.07Å; Y174-L178 HydrophobicContact CE2-CD2 3.94Å; Y174-L178 HydrophobicContact CE2-CG 3.86Å; Y174-L178 HydrophobicContact CG-CD1 4.47Å; Y174-L178 VanDerWaalsContact O-CG 3.32Å; Y174-L178 WeakPolarHBondContact O-CG 3.12Å; Y174-L178 PolarHBondContact O-N 3.33Å |
| 175 | I | 98.1 | Very high | 95.9 | Very high | 98 Ų | 98 | 88.4 Ų | 88.4 | 50% | 0.503 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -59 | -42.1 | 172.1 | -67.5 | 169 | 0 | 0 | 0 | 110.5 | T171 L178 T179 | T171-I175 HydrophobicContact CG2-CD1 3.86Å; T171-I175 HydrophobicContact CG2-CG1 4.47Å; T171-I175 WeakPolarHBondContact O-CG1 3.1Å; T171-I175 PolarHBondContact O-N 3.44Å; I175-L178 PolarHBondContact O-N 2.85Å; I175-T179 WeakPolarHBondContact O-CB 3.49Å; I175-T179 PolarHBondContact O-N 2.97Å; I175-T179 PolarHBondContact O-OG1 3.42Å |
| 176 | G | 97.7 | Very high | 94.6 | Very high | 29 Ų | 29 | 93.1 Ų | 93.1 | 30% | 0.299 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -59.3 | -51.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | I172 K173 Y174 L178 T179 D180 | I172-G176 PolarHBondContact O-N 3.09Å; I172-G176 VanDerWaalsContact O-N 3.12Å; K173-G176 WeakPolarHBondContact O-CA 3.16Å; K173-G176 PolarHBondContact O-N 3.16Å; K173-G176 VanDerWaalsContact O-N 3.14Å; Y174-G176 VanDerWaalsContact C-N 3.27Å; Y174-G176 PolarHBondContact O-N 3.19Å; G176-L178 VanDerWaalsContact C-N 3.34Å; G176-L178 PolarHBondContact O-N 3.35Å; G176-T179 WeakPolarHBondContact O-CB 3.03Å; G176-T179 PolarHBondContact O-N 2.97Å; G176-T179 VanDerWaalsContact O-N 3.11Å; G176-D180 PolarHBondContact O-N 3.23Å |
| 177 | E | 97.1 | Very high | 92.8 | Very high | 93 Ų | 93 | 96.9 Ų | 96.9 | 44% | 0.435 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -59.4 | -41.9 | 178.6 | -69.1 | 171.2 | -160.9 | 0 | 0 | 112.3 | Y155 K173 Y174 D180 L181 | Y155-E177 VanDerWaalsContact OH-CD 3.27Å; Y155-E177 PolarHBondContact OH-OE1 3.27Å; Y155-E177 PolarHBondContact OH-OE2 2.89Å; K173-E177 WeakPolarHBondContact O-CG 3.08Å; K173-E177 PolarHBondContact O-N 2.92Å; Y174-E177 PolarHBondContact O-N 3.29Å; E177-D180 PolarHBondContact O-N 3.27Å; E177-L181 WeakPolarHBondContact O-CB 3.42Å; E177-L181 PolarHBondContact O-N 3.01Å |
| 178 | L | 97.3 | Very high | 90.9 | Very high | 67 Ų | 67 | 101.7 Ų | 101.7 | 35% | 0.351 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.7 | -39.3 | 175.2 | -69.8 | 178.2 | 0 | 0 | 0 | 112.2 | Y174 I175 G176 L181 L182 | Y174-L178 HydrophobicContact CD1-CD1 4.09Å; Y174-L178 HydrophobicContact CD2-CD1 4.47Å; Y174-L178 HydrophobicContact CD2-CG 4.22Å; Y174-L178 HydrophobicContact CE1-CD1 3.69Å; Y174-L178 HydrophobicContact CE1-CG 4.39Å; Y174-L178 HydrophobicContact CE2-CD1 4.07Å; Y174-L178 HydrophobicContact CE2-CD2 3.94Å; Y174-L178 HydrophobicContact CE2-CG 3.86Å; Y174-L178 HydrophobicContact CG-CD1 4.47Å; Y174-L178 VanDerWaalsContact O-CG 3.32Å; Y174-L178 WeakPolarHBondContact O-CG 3.12Å; Y174-L178 PolarHBondContact O-N 3.33Å; I175-L178 PolarHBondContact O-N 2.85Å; G176-L178 VanDerWaalsContact C-N 3.34Å; G176-L178 PolarHBondContact O-N 3.35Å; L178-L181 PolarHBondContact O-N 2.93Å; L178-L182 WeakPolarHBondContact O-CG 3.4Å; L178-L182 PolarHBondContact O-N 3.3Å |
| 179 | T | 97.2 | Very high | 88.7 | Confident | 66 Ų | 66 | 108.6 Ų | 108.6 | 41% | 0.405 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.5 | -44.9 | 177.8 | -57 | 0 | 0 | 0 | 0 | 110.6 | I175 G176 L181 L182 N183 | I175-T179 WeakPolarHBondContact O-CB 3.49Å; I175-T179 PolarHBondContact O-N 2.97Å; I175-T179 PolarHBondContact O-OG1 3.42Å; G176-T179 WeakPolarHBondContact O-CB 3.03Å; G176-T179 PolarHBondContact O-N 2.97Å; G176-T179 VanDerWaalsContact O-N 3.11Å; T179-L181 VanDerWaalsContact C-N 3.34Å; T179-L181 PolarHBondContact O-N 3.22Å; T179-L182 PolarHBondContact O-N 2.89Å; T179-N183 VanDerWaalsContact O-CG 3.29Å; T179-N183 PolarHBondContact O-N 3.3Å; T179-N183 PolarHBondContact O-ND2 3.07Å |
| 180 | D | 96.1 | Very high | 86.7 | Confident | 96 Ų | 96 | 106.5 Ų | 106.5 | 51% | 0.513 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.3 | -40.8 | 176.3 | -69.2 | -18 | 0 | 0 | 0 | 111.9 | G176 E177 N183 R184 | G176-D180 PolarHBondContact O-N 3.23Å; E177-D180 PolarHBondContact O-N 3.27Å; D180-N183 PolarHBondContact O-N 3.23Å; D180-R184 WeakPolarHBondContact O-CG 3.19Å; D180-R184 PolarHBondContact O-N 3.31Å |
| 181 | L | 96.1 | Very high | 84.4 | Confident | 119 Ų | 119 | 112.8 Ų | 112.8 | 62% | 0.623 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -61.5 | -44.1 | 176.7 | -175.7 | 67.5 | 0 | 0 | 0 | 111.7 | E177 L178 T179 R184 G185 | E177-L181 WeakPolarHBondContact O-CB 3.42Å; E177-L181 PolarHBondContact O-N 3.01Å; L178-L181 PolarHBondContact O-N 2.93Å; T179-L181 VanDerWaalsContact C-N 3.34Å; T179-L181 PolarHBondContact O-N 3.22Å; L181-R184 PolarHBondContact O-N 2.75Å; L181-G185 PolarHBondContact O-N 3.01Å |
| 182 | L | 95.6 | Very high | 82.2 | Confident | 129 Ų | 129 | 117.7 Ų | 117.7 | 68% | 0.675 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -65.7 | -38.1 | 177.2 | -70.5 | 173.4 | 0 | 0 | 0 | 112.2 | L178 T179 G185 R186 | L178-L182 WeakPolarHBondContact O-CG 3.4Å; L178-L182 PolarHBondContact O-N 3.3Å; T179-L182 PolarHBondContact O-N 2.89Å; L182-G185 PolarHBondContact O-N 2.64Å; L182-R186 PolarHBondContact O-N 3.39Å |
| 183 | N | 93.8 | Very high | 79.4 | Confident | 95 Ų | 95 | 120.1 Ų | 120.1 | 51% | 0.508 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -68.4 | -41.2 | 177.9 | -71.2 | -27.4 | 0 | 0 | 0 | 112.1 | T179 D180 G185 R186 E187 | T179-N183 VanDerWaalsContact O-CG 3.29Å; T179-N183 PolarHBondContact O-N 3.3Å; T179-N183 PolarHBondContact O-ND2 3.07Å; D180-N183 PolarHBondContact O-N 3.23Å; N183-G185 VanDerWaalsContact C-N 3.29Å; N183-G185 PolarHBondContact O-N 2.89Å; N183-R186 PolarHBondContact O-N 3.36Å; N183-R186 VanDerWaalsContact O-N 3.07Å; N183-E187 PolarHBondContact O-N 3.3Å |
| 184 | R | 90.3 | Very high | 78.5 | Confident | 196 Ų | 196 | 120 Ų | 120 | 74% | 0.74 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -60.7 | -37.2 | 174.7 | -73.5 | 175.8 | -178.6 | -76.2 | -2.2 | 112.8 | D180 L181 R186 | D180-R184 WeakPolarHBondContact O-CG 3.19Å; D180-R184 PolarHBondContact O-N 3.31Å; L181-R184 PolarHBondContact O-N 2.75Å; R184-R186 PolarHBondContact O-N 3.08Å |
| 185 | G | 78.2 | Confident | 77.5 | Confident | 71 Ų | 71 | 122.7 Ų | 122.7 | 73% | 0.732 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | -13.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | L181 L182 N183 | L181-G185 PolarHBondContact O-N 3.01Å; L182-G185 PolarHBondContact O-N 2.64Å; N183-G185 VanDerWaalsContact C-N 3.29Å; N183-G185 PolarHBondContact O-N 2.89Å |
| 186 | R | 70.7 | Confident | 76.3 | Confident | 212 Ų | 212 | 124.1 Ų | 124.1 | 80% | 0.8 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.9 | 2 | 179.1 | -170.4 | 174 | -87.2 | -125.4 | 0.8 | 112.7 | L182 N183 R184 P188 | L182-R186 PolarHBondContact O-N 3.39Å; N183-R186 PolarHBondContact O-N 3.36Å; N183-R186 VanDerWaalsContact O-N 3.07Å; R184-R186 PolarHBondContact O-N 3.08Å; R186-P188 WeakPolarHBondContact O-CD 3.36Å |
| 187 | E | 58.1 | Low | 75.1 | Confident | 149 Ų | 149 | 129.6 Ų | 129.6 | 70% | 0.696 | 70% | 0.703 | S | S | * | * | trans | -50.8 | 116.2 | 172.2 | -87.8 | -67.1 | 124.4 | 0 | 0 | 109.5 | N183 R189 | N183-E187 PolarHBondContact O-N 3.3Å; E187-R189 PolarHBondContact O-N 3.3Å; E187-R189 VanDerWaalsContact O-N 3.08Å | ||
| 188 | P | 58.9 | Low | 73.7 | Confident | 101 Ų | 101 | 131.9 Ų | 131.9 | 66% | 0.656 | 72% | 0.719 | S | S | * | * | trans | -65.6 | 117.1 | 178.6 | 26.3 | -29.8 | 0 | 0 | 0 | 106.2 | R186 A190 | R186-P188 WeakPolarHBondContact O-CD 3.36Å; P188-A190 PolarHBondContact O-N 3.02Å | ||
| 189 | R | 52.4 | Low | 72.1 | Confident | 234 Ų | 234 | 136.3 Ų | 136.3 | 88% | 0.883 | 74% | 0.744 | S | S | * | * | trans | -47.3 | 96.8 | 164.4 | 179.2 | -176.5 | 177.1 | 156.2 | -0.5 | 107.2 | E187 Q191 | E187-R189 PolarHBondContact O-N 3.3Å; E187-R189 VanDerWaalsContact O-N 3.08Å; R189-Q191 PolarHBondContact O-N 3.12Å | ||
| 190 | A | 54.6 | Low | 70.3 | Confident | 92 Ų | 92 | 141.3 Ų | 141.3 | 76% | 0.76 | 77% | 0.768 | S | S | * | * | trans | -55.8 | 116.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 105.9 | P188 S192 | P188-A190 PolarHBondContact O-N 3.02Å; A190-S192 PolarHBondContact O-N 2.81Å | ||
| 191 | Q | 49.5 | Very low | 68.3 | Low | 188 Ų | 188 | 144.8 Ų | 144.8 | 88% | 0.879 | 79% | 0.788 | S | S | * | * | trans | -64.6 | 105.1 | -177.6 | -64.4 | 171.6 | 22.6 | 0 | 0 | 106.4 | R189 A193 | R189-Q191 PolarHBondContact O-N 3.12Å; Q191-A193 PolarHBondContact O-N 3.15Å | ||
| 192 | S | 51.5 | Low | 66 | Low | 125 Ų | 125 | 146.9 Ų | 146.9 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | trans | -69.5 | 106 | 161.9 | 165.8 | 0 | 0 | 0 | 0 | 107.5 | A190 | A190-S192 PolarHBondContact O-N 2.81Š| ||
| 193 | A | 38.8 | Very low | 63.3 | Low | 171 Ų | 171 | 148.5 Ų | 148.5 | 100% | 1.413 | 81% | 0.813 | S | S | * | * | trans | -152.8 | 0 | 153.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | Q191 | Q191-A193 PolarHBondContact O-N 3.15Š|
Retrieved 193 of 193 residues in 722.8 ms
(Link to these results)