| 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 | 39.3 | Very low | 43.5 | Very low | 255 Ų | 255 | 143.5 Ų | 143.5 | 100% | 1.256 | 85% | 0.853 | S | S | * | * | 0 | 98.7 | 0 | -148.4 | 142.5 | 172.1 | 0 | 0 | 106.1 | |||||
| 2 | A | 41.4 | Very low | 44.3 | Very low | 109 Ų | 109 | 147.9 Ų | 147.9 | 90% | 0.901 | 86% | 0.858 | S | S | * | * | trans | -116.8 | 113.4 | -172.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 3 | S | 38.1 | Very low | 44.7 | Very low | 132 Ų | 132 | 141.9 Ų | 141.9 | 92% | 0.923 | 85% | 0.847 | S | S | * | * | trans | -164.6 | 132.1 | 166.9 | -173.8 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 4 | G | 35.8 | Very low | 45 | Very low | 67 Ų | 67 | 141.2 Ų | 141.2 | 69% | 0.691 | 84% | 0.837 | S | S | * | * | cis | -164.7 | 148.4 | 1.2 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 5 | S | 40 | Very low | 44.9 | Very low | 119 Ų | 119 | 143.1 Ų | 143.1 | 83% | 0.832 | 83% | 0.831 | S | S | * | * | trans | -90 | 118.8 | 176.8 | 41.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 6 | D | 44.9 | Very low | 45.2 | Very low | 139 Ų | 139 | 146.6 Ų | 146.6 | 74% | 0.743 | 83% | 0.826 | S | S | * | * | trans | -46.5 | 129.4 | 162.5 | -105.1 | -76.9 | 0 | 0 | 0 | 112.4 | ||||
| 7 | K | 48.1 | Very low | 45.5 | Very low | 203 Ų | 203 | 143.7 Ų | 143.7 | 88% | 0.883 | 81% | 0.807 | S | S | * | * | trans | -146.7 | 101.8 | 151.3 | -73.5 | -165.8 | 179.5 | 163.2 | 0 | 109.3 | ||||
| 8 | D | 44.6 | Very low | 45.9 | Very low | 146 Ų | 146 | 141.6 Ų | 141.6 | 78% | 0.781 | 80% | 0.8 | S | S | * | * | trans | -50.1 | 133.8 | 158.9 | -62.6 | -75 | 0 | 0 | 0 | 112.1 | ||||
| 9 | A | 52.2 | Low | 46.8 | Very low | 93 Ų | 93 | 138.2 Ų | 138.2 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | 159.2 | 144.5 | 118.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 10 | P | 50.4 | Low | 47.2 | Very low | 106 Ų | 106 | 139.2 Ų | 139.2 | 69% | 0.688 | 80% | 0.801 | S | S | * | * | trans | -91.1 | 141.9 | -161.7 | 36.2 | -33.1 | 0 | 0 | 0 | 112.3 | ||||
| 11 | K | 44.1 | Very low | 47.5 | Very low | 210 Ų | 210 | 143 Ų | 143 | 91% | 0.913 | 80% | 0.802 | S | S | * | * | trans | -137.8 | 78.5 | 160.7 | -70.9 | -170.3 | -179.7 | 157.8 | 0 | 110.3 | G13 | K11-G13 PolarHBondContact O-N 3.15Å; K11-G13 VanDerWaalsContact O-N 3.13Å | ||
| 12 | E | 52.7 | Low | 48.3 | Very low | 196 Ų | 196 | 134 Ų | 134 | 92% | 0.916 | 78% | 0.775 | S | S | * | * | trans | -63.5 | 103 | 158.5 | -54 | -170 | -151.9 | 0 | 0 | 107.9 | ||||
| 13 | G | 49.9 | Very low | 48.9 | Very low | 70 Ų | 70 | 131.3 Ų | 131.3 | 72% | 0.722 | 75% | 0.753 | S | S | * | * | trans | -159.6 | 13 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | K11 F15 | K11-G13 PolarHBondContact O-N 3.15Å; K11-G13 VanDerWaalsContact O-N 3.13Å; G13-F15 PolarHBondContact O-N 3.38Å; G13-F15 VanDerWaalsContact O-N 3.14Å | ||
| 14 | N | 48.7 | Very low | 49.6 | Very low | 132 Ų | 132 | 135.1 Ų | 135.1 | 71% | 0.706 | 75% | 0.753 | S | S | * | * | trans | -89.2 | 62.7 | 173.8 | -156.7 | 41.2 | 0 | 0 | 0 | 109.8 | R16 | N14-R16 PolarHBondContact O-N 3.16Š| ||
| 15 | F | 43.2 | Very low | 50.2 | Low | 170 Ų | 170 | 136.7 Ų | 136.7 | 75% | 0.746 | 75% | 0.749 | S | S | * | * | trans | -67.5 | 85.7 | 162.6 | -171.4 | -106.1 | 0 | 0 | 0 | 106.9 | G13 I17 | G13-F15 PolarHBondContact O-N 3.38Å; G13-F15 VanDerWaalsContact O-N 3.14Å; F15-I17 VanDerWaalsContact C-N 3.29Å; F15-I17 HydrophobicContact CD1-CD1 4.46Å; F15-I17 HydrophobicContact CD1-CG1 3.54Å; F15-I17 HydrophobicContact CE1-CG1 3.72Å; F15-I17 PolarHBondContact O-N 3.45Å | ||
| 16 | R | 49.9 | Very low | 50.9 | Low | 199 Ų | 199 | 135.4 Ų | 135.4 | 75% | 0.751 | 74% | 0.737 | S | S | * | * | trans | -54.9 | 98.9 | 163.4 | -68.9 | -168.5 | 173.2 | -174.4 | -1 | 106.6 | N14 P18 | N14-R16 PolarHBondContact O-N 3.16Å; R16-P18 WeakPolarHBondContact O-CD 3.27Å | ||
| 17 | I | 49.4 | Very low | 51.4 | Low | 97 Ų | 97 | 134.5 Ų | 134.5 | 50% | 0.497 | 74% | 0.736 | S | S | . | * | trans | -70.4 | 107.3 | 164 | -54.1 | 172.9 | 0 | 0 | 0 | 104.6 | F15 | F15-I17 VanDerWaalsContact C-N 3.29Å; F15-I17 HydrophobicContact CD1-CD1 4.46Å; F15-I17 HydrophobicContact CD1-CG1 3.54Å; F15-I17 HydrophobicContact CE1-CG1 3.72Å; F15-I17 PolarHBondContact O-N 3.45Å | ||
| 18 | P | 53.8 | Low | 51.8 | Low | 106 Ų | 106 | 131.2 Ų | 131.2 | 69% | 0.688 | 73% | 0.727 | S | S | * | * | trans | -71.1 | 142.6 | 174.5 | 14.3 | 1.8 | 0 | 0 | 0 | 107.3 | R16 L20 | R16-P18 WeakPolarHBondContact O-CD 3.27Å; P18-L20 PolarHBondContact O-N 3.39Å; P18-L20 VanDerWaalsContact O-N 3.15Å | ||
| 19 | G | 62.5 | Low | 52 | Low | 77 Ų | 77 | 131.7 Ų | 131.7 | 79% | 0.794 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -54.5 | 120 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 20 | L | 55 | Low | 52.1 | Low | 157 Ų | 157 | 133.8 Ų | 133.8 | 82% | 0.822 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -142.5 | 25.2 | 132.3 | -158.2 | 74.5 | 0 | 0 | 0 | 109.7 | P18 | P18-L20 PolarHBondContact O-N 3.39Å; P18-L20 VanDerWaalsContact O-N 3.15Å |
| 21 | R | 54.1 | Low | 52.3 | Low | 219 Ų | 219 | 132.6 Ų | 132.6 | 83% | 0.826 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -102.7 | 2.7 | 171.5 | -79.6 | -177.6 | 162.6 | 165.7 | -2.6 | 112.7 | ||
| 22 | G | 55.3 | Low | 52.9 | Low | 67 Ų | 67 | 128.2 Ų | 128.2 | 69% | 0.691 | 70% | 0.701 | S | S | * | * | trans | -105.3 | -3.9 | -179 | 0 | 0 | 0 | 0 | 0 | 115.5 | K24 | G22-K24 PolarHBondContact O-N 2.81Š| ||
| 23 | A | 53.3 | Low | 52.8 | Low | 52 Ų | 52 | 122.7 Ų | 122.7 | 43% | 0.43 | 68% | 0.678 | S | S | . | * | trans | -82.6 | 119.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | T25 | A23-T25 PolarHBondContact O-N 2.65Š| ||
| 24 | K | 54.3 | Low | 53.2 | Low | 212 Ų | 212 | 124 Ų | 124 | 92% | 0.922 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.7 | 45.1 | -172.1 | -59.6 | -179.9 | 179.2 | -176.4 | 0 | 114.4 | G22 | G22-K24 PolarHBondContact O-N 2.81Š|
| 25 | T | 48.3 | Very low | 53.3 | Low | 100 Ų | 100 | 124.5 Ų | 124.5 | 61% | 0.613 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129.2 | 12.2 | -177.8 | 55.5 | 0 | 0 | 0 | 0 | 114.3 | A23 | A23-T25 PolarHBondContact O-N 2.65Š|
| 26 | T | 53.6 | Low | 53.9 | Low | 93 Ų | 93 | 123.3 Ų | 123.3 | 57% | 0.571 | 67% | 0.672 | S | S | * | * | trans | -100.7 | 10.5 | -172.3 | 58.5 | 0 | 0 | 0 | 0 | 115.4 | L28 R30 | T26-L28 VanDerWaalsContact C-N 3.33Å; T26-R30 WeakPolarHBondContact O-CB 3.05Å; T26-R30 PolarHBondContact O-N 3.49Å | ||
| 27 | T | 55.2 | Low | 54 | Low | 120 Ų | 120 | 118.4 Ų | 118.4 | 74% | 0.736 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -68.1 | -34.4 | 171.4 | 39.4 | 0 | 0 | 0 | 0 | 112 | ||
| 28 | L | 56.6 | Low | 54.2 | Low | 133 Ų | 133 | 119.4 Ų | 119.4 | 70% | 0.696 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -74.8 | -40.8 | 179.4 | -71.1 | 167.9 | 0 | 0 | 0 | 112.2 | T26 R30 A31 V32 | T26-L28 VanDerWaalsContact C-N 3.33Å; L28-R30 VanDerWaalsContact C-N 3.29Å; L28-R30 PolarHBondContact O-N 2.57Å; L28-A31 PolarHBondContact O-N 2.84Å; L28-V32 WeakPolarHBondContact O-CG2 2.85Å |
| 29 | F | 49.7 | Very low | 54.5 | Low | 156 Ų | 156 | 125.2 Ų | 125.2 | 68% | 0.684 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -73 | -18.4 | 177.3 | -70 | -76.5 | 0 | 0 | 0 | 114.2 | A31 V32 N33 | F29-A31 VanDerWaalsContact C-N 3.34Å; F29-V32 PolarHBondContact O-N 3.04Å; F29-N33 PolarHBondContact O-N 3.03Å |
| 30 | R | 54.7 | Low | 54.2 | Low | 138 Ų | 138 | 126.7 Ų | 126.7 | 52% | 0.521 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -75.8 | -21.8 | 172.7 | -160.9 | -179.9 | 175.6 | 160.8 | -7.3 | 113 | T26 L28 F37 | T26-R30 WeakPolarHBondContact O-CB 3.05Å; T26-R30 PolarHBondContact O-N 3.49Å; L28-R30 VanDerWaalsContact C-N 3.29Å; L28-R30 PolarHBondContact O-N 2.57Å; R30-F37 VanDerWaalsContact CD-CE2 3.46Å; R30-F37 HydrophobicContact CG-CD2 3.86Å; R30-F37 HydrophobicContact CG-CE2 3.47Å; R30-F37 VanDerWaalsContact CG-CE2 3.47Å; R30-F37 HydrophobicContact CG-CZ 4.37Å |
| 31 | A | 54.7 | Low | 54.7 | Low | 81 Ų | 81 | 121.6 Ų | 121.6 | 67% | 0.669 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -80.3 | -26.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | L28 F29 | L28-A31 PolarHBondContact O-N 2.84Å; F29-A31 VanDerWaalsContact C-N 3.34Å |
| 32 | V | 55.7 | Low | 55.3 | Low | 118 Ų | 118 | 118.7 Ų | 118.7 | 72% | 0.715 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -91.4 | -15.7 | -175.1 | -173.7 | 0 | 0 | 0 | 0 | 112.5 | L28 F29 P34 | L28-V32 WeakPolarHBondContact O-CG2 2.85Å; F29-V32 PolarHBondContact O-N 3.04Å; V32-P34 WeakPolarHBondContact O-CD 2.98Å |
| 33 | N | 51.4 | Low | 56.4 | Low | 80 Ų | 80 | 119.8 Ų | 119.8 | 43% | 0.428 | 63% | 0.627 | S | S | . | * | trans | -117.5 | 86.5 | 169.7 | -164.3 | -9.5 | 0 | 0 | 0 | 110.9 | F29 E35 L36 | F29-N33 PolarHBondContact O-N 3.03Å; N33-E35 PolarHBondContact O-N 3.2Å; N33-E35 WeakPolarHBondContact OD1-CB 3.34Å; N33-E35 PolarHBondContact OD1-N 2.62Å; N33-E35 VanDerWaalsContact OD1-N 3.12Å; N33-L36 PolarHBondContact O-N 3.39Å | ||
| 34 | P | 57.3 | Low | 57.6 | Low | 98 Ų | 98 | 121.5 Ų | 121.5 | 64% | 0.636 | 63% | 0.632 | S | S | * | * | G | 310 helix | trans | -62.7 | -6.4 | 176.3 | 26.5 | -33.7 | 0 | 0 | 0 | 113.1 | V32 | V32-P34 WeakPolarHBondContact O-CD 2.98Š|
| 35 | E | 51.1 | Low | 59 | Low | 142 Ų | 142 | 117.3 Ų | 117.3 | 66% | 0.664 | 62% | 0.617 | S | S | * | * | G | 310 helix | trans | -78.3 | -19.8 | -176.6 | -142 | -173.2 | -149.7 | 0 | 0 | 114.1 | N33 I38 | N33-E35 PolarHBondContact O-N 3.2Å; N33-E35 WeakPolarHBondContact OD1-CB 3.34Å; N33-E35 PolarHBondContact OD1-N 2.62Å; N33-E35 VanDerWaalsContact OD1-N 3.12Å; E35-I38 HydrophobicContact CB-CD1 4.36Å; E35-I38 HydrophobicContact CG-CD1 3.85Å; E35-I38 WeakPolarHBondContact O-CB 3.48Å |
| 36 | L | 55.4 | Low | 60.8 | Low | 144 Ų | 144 | 114.9 Ų | 114.9 | 75% | 0.754 | 61% | 0.607 | S | S | * | * | G | 310 helix | trans | -91.6 | -5.8 | 176.3 | -147.2 | 72.9 | 0 | 0 | 0 | 113.7 | N33 I38 | N33-L36 PolarHBondContact O-N 3.39Å; L36-I38 VanDerWaalsContact C-N 3.27Å |
| 37 | F | 52.2 | Low | 62.4 | Low | 96 Ų | 96 | 117.4 Ų | 117.4 | 42% | 0.421 | 61% | 0.611 | S | S | . | * | G | 310 helix | trans | -91.5 | 16.5 | 166.2 | -93.8 | -72.6 | 0 | 0 | 0 | 112.5 | R30 N41 | R30-F37 VanDerWaalsContact CD-CE2 3.46Å; R30-F37 HydrophobicContact CG-CD2 3.86Å; R30-F37 HydrophobicContact CG-CE2 3.47Å; R30-F37 VanDerWaalsContact CG-CE2 3.47Å; R30-F37 HydrophobicContact CG-CZ 4.37Å; F37-N41 WeakPolarHBondContact O-CB 3.16Å; F37-N41 PolarHBondContact O-ND2 3.22Å; F37-N41 VanDerWaalsContact O-ND2 3.09Å |
| 38 | I | 54.6 | Low | 64 | Low | 118 Ų | 118 | 112.9 Ų | 112.9 | 61% | 0.605 | 59% | 0.587 | S | S | * | * | trans | -92.2 | -0.6 | 177.5 | -70.8 | 173.6 | 0 | 0 | 0 | 113 | E35 L36 | E35-I38 HydrophobicContact CB-CD1 4.36Å; E35-I38 HydrophobicContact CG-CD1 3.85Å; E35-I38 WeakPolarHBondContact O-CB 3.48Å; L36-I38 VanDerWaalsContact C-N 3.27Å | ||
| 39 | R | 59.4 | Low | 65.8 | Low | 229 Ų | 229 | 111.3 Ų | 111.3 | 86% | 0.864 | 58% | 0.579 | S | S | * | * | S | Bend | trans | -61.9 | 128 | 158.1 | -91.9 | -172.3 | 175.9 | -159.2 | -1.2 | 108.2 | N41 | R39-N41 PolarHBondContact O-N 3.18Š|
| 40 | P | 55.2 | Low | 67.9 | Low | 107 Ų | 107 | 108.2 Ų | 108.2 | 70% | 0.695 | 57% | 0.573 | S | S | * | * | trans | -46.8 | 109.4 | -137 | 24.2 | -34.8 | 0 | 0 | 0 | 112 | K42 | P40-K42 PolarHBondContact O-N 3.24Š| ||
| 41 | N | 66.6 | Low | 69.7 | Low | 50 Ų | 50 | 104 Ų | 104 | 27% | 0.267 | 56% | 0.563 | S | S | . | * | trans | -82.3 | 60.6 | -166.6 | -152.3 | -9.3 | 0 | 0 | 0 | 112.1 | F37 R39 P43 V44 M45 | F37-N41 WeakPolarHBondContact O-CB 3.16Å; F37-N41 PolarHBondContact O-ND2 3.22Å; F37-N41 VanDerWaalsContact O-ND2 3.09Å; R39-N41 PolarHBondContact O-N 3.18Å; N41-P43 WeakPolarHBondContact OD1-CD 3.23Å; N41-P43 VanDerWaalsContact OD1-CG 3.31Å; N41-P43 WeakPolarHBondContact OD1-CG 3.44Å; N41-V44 HydrophobicContact CB-CB 4.27Å; N41-V44 VanDerWaalsContact CG-CB 3.48Å; N41-V44 VanDerWaalsContact CG-CG2 3.42Å; N41-V44 WeakPolarHBondContact ND2-CB 3.18Å; N41-V44 WeakPolarHBondContact ND2-CG2 2.96Å; N41-V44 PolarHBondContact O-N 2.66Å; N41-V44 VanDerWaalsContact OD1-CG2 3.31Å; N41-V44 WeakPolarHBondContact OD1-CG2 3.07Å; N41-V44 PolarHBondContact OD1-N 2.83Å; N41-M45 PolarHBondContact O-N 3.01Å; N41-M45 VanDerWaalsContact O-N 3.13Å | ||
| 42 | K | 66.1 | Low | 71.6 | Confident | 158 Ų | 158 | 105.3 Ų | 105.3 | 69% | 0.687 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -47.9 | -40.4 | 167.8 | -65.5 | 179 | -177.5 | 175.1 | 0 | 112.8 | P40 A46 | P40-K42 PolarHBondContact O-N 3.24Å; K42-A46 WeakPolarHBondContact O-CB 3.42Å; K42-A46 PolarHBondContact O-N 3.44Å |
| 43 | P | 79.2 | Confident | 73.4 | Confident | 90 Ų | 90 | 104 Ų | 104 | 58% | 0.584 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -71 | -35.6 | -179.6 | 24.4 | -30.9 | 0 | 0 | 0 | 113.3 | N41 A46 F47 | N41-P43 WeakPolarHBondContact OD1-CD 3.23Å; N41-P43 VanDerWaalsContact OD1-CG 3.31Å; N41-P43 WeakPolarHBondContact OD1-CG 3.44Å; P43-A46 PolarHBondContact O-N 3.43Å; P43-F47 VanDerWaalsContact O-CB 3.29Å; P43-F47 WeakPolarHBondContact O-CB 3.44Å; P43-F47 PolarHBondContact O-N 3.04Å |
| 44 | V | 79.1 | Confident | 75.5 | Confident | 88 Ų | 88 | 106.1 Ų | 106.1 | 53% | 0.533 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -69.9 | -37.8 | 175.6 | 168.6 | 0 | 0 | 0 | 0 | 111.8 | N41 F47 G48 | N41-V44 HydrophobicContact CB-CB 4.27Å; N41-V44 VanDerWaalsContact CG-CB 3.48Å; N41-V44 VanDerWaalsContact CG-CG2 3.42Å; N41-V44 WeakPolarHBondContact ND2-CB 3.18Å; N41-V44 WeakPolarHBondContact ND2-CG2 2.96Å; N41-V44 PolarHBondContact O-N 2.66Å; N41-V44 VanDerWaalsContact OD1-CG2 3.31Å; N41-V44 WeakPolarHBondContact OD1-CG2 3.07Å; N41-V44 PolarHBondContact OD1-N 2.83Å; V44-F47 PolarHBondContact O-N 3.23Å; V44-G48 PolarHBondContact O-N 3.46Å |
| 45 | M | 82.6 | Confident | 77.2 | Confident | 125 Ų | 125 | 105 Ų | 105 | 62% | 0.616 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -62.8 | -45 | 172.8 | -173 | -174.9 | 74.8 | 0 | 0 | 111.4 | N41 G48 L49 | N41-M45 PolarHBondContact O-N 3.01Å; N41-M45 VanDerWaalsContact O-N 3.13Å; M45-G48 PolarHBondContact O-N 3.46Å; M45-L49 HydrophobicContact CG-CD1 4.38Å; M45-L49 WeakPolarHBondContact O-CG 3.47Å; M45-L49 PolarHBondContact O-N 3.14Å |
| 46 | A | 85.8 | Confident | 79.2 | Confident | 49 Ų | 49 | 102.8 Ų | 102.8 | 41% | 0.405 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -62.8 | -42.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | K42 P43 L49 V50 | K42-A46 WeakPolarHBondContact O-CB 3.42Å; K42-A46 PolarHBondContact O-N 3.44Å; P43-A46 PolarHBondContact O-N 3.43Å; A46-L49 PolarHBondContact O-N 2.83Å; A46-V50 WeakPolarHBondContact O-CB 3.4Å; A46-V50 VanDerWaalsContact O-CG2 3.24Å; A46-V50 WeakPolarHBondContact O-CG2 3.26Å; A46-V50 PolarHBondContact O-N 3.46Å |
| 47 | F | 87.6 | Confident | 80.9 | Confident | 146 Ų | 146 | 98 Ų | 98 | 64% | 0.64 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.3 | -46.5 | 175.8 | -175.2 | -99.2 | 0 | 0 | 0 | 111.5 | P43 V44 L49 V50 T51 | P43-F47 VanDerWaalsContact O-CB 3.29Å; P43-F47 WeakPolarHBondContact O-CB 3.44Å; P43-F47 PolarHBondContact O-N 3.04Å; V44-F47 PolarHBondContact O-N 3.23Å; F47-L49 PolarHBondContact O-N 2.69Å; F47-V50 PolarHBondContact O-N 2.81Å; F47-T51 HydrophobicContact CD1-CG2 4.13Å; F47-T51 HydrophobicContact CE1-CG2 3.76Å; F47-T51 HydrophobicContact CE2-CG2 4.27Å; F47-T51 HydrophobicContact CZ-CG2 3.84Å; F47-T51 WeakPolarHBondContact O-CG2 3.26Å; F47-T51 PolarHBondContact O-N 2.78Å; F47-T51 PolarHBondContact O-OG1 3.41Å |
| 48 | G | 89.8 | Confident | 82.6 | Confident | 24 Ų | 24 | 100.1 Ų | 100.1 | 25% | 0.247 | 54% | 0.542 | C | S | . | . | H | α-helix | trans | -61.2 | -40.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | V44 M45 T51 I52 | V44-G48 PolarHBondContact O-N 3.46Å; M45-G48 PolarHBondContact O-N 3.46Å; G48-T51 WeakPolarHBondContact CA-OG1 3.34Å; G48-T51 PolarHBondContact O-N 2.81Å; G48-T51 PolarHBondContact O-OG1 3.27Å; G48-I52 WeakPolarHBondContact O-CB 3.33Å; G48-I52 WeakPolarHBondContact O-CD1 3.44Å; G48-I52 WeakPolarHBondContact O-CG1 3.48Å; G48-I52 PolarHBondContact O-N 3.26Å |
| 49 | L | 93.2 | Very high | 84.2 | Confident | 100 Ų | 100 | 99.8 Ų | 99.8 | 52% | 0.524 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -66.5 | -42.1 | 175.6 | -71.8 | 175.4 | 0 | 0 | 0 | 111.9 | M45 A46 F47 T53 | M45-L49 HydrophobicContact CG-CD1 4.38Å; M45-L49 WeakPolarHBondContact O-CG 3.47Å; M45-L49 PolarHBondContact O-N 3.14Å; A46-L49 PolarHBondContact O-N 2.83Å; F47-L49 PolarHBondContact O-N 2.69Å; L49-T53 WeakPolarHBondContact O-CB 3.24Å; L49-T53 WeakPolarHBondContact O-CG2 3.38Å; L49-T53 PolarHBondContact O-N 2.94Å; L49-T53 PolarHBondContact O-OG1 2.77Å |
| 50 | V | 94.7 | Very high | 85.5 | Confident | 92 Ų | 92 | 90.7 Ų | 90.7 | 56% | 0.558 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.5 | -43 | 176.2 | 171.5 | 0 | 0 | 0 | 0 | 111.3 | A46 F47 T53 L54 | A46-V50 WeakPolarHBondContact O-CB 3.4Å; A46-V50 VanDerWaalsContact O-CG2 3.24Å; A46-V50 WeakPolarHBondContact O-CG2 3.26Å; A46-V50 PolarHBondContact O-N 3.46Å; F47-V50 PolarHBondContact O-N 2.81Å; V50-T53 WeakPolarHBondContact CA-OG1 3.29Å; V50-T53 PolarHBondContact O-OG1 3.13Å; V50-L54 VanDerWaalsContact O-CB 3.26Å; V50-L54 WeakPolarHBondContact O-CB 3.47Å; V50-L54 PolarHBondContact O-N 3.5Å |
| 51 | T | 92.9 | Very high | 87 | Confident | 50 Ų | 50 | 92.8 Ų | 92.8 | 31% | 0.307 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68.5 | -44.1 | 179.7 | 55.5 | 0 | 0 | 0 | 0 | 111.8 | F47 G48 L54 C55 | F47-T51 HydrophobicContact CD1-CG2 4.13Å; F47-T51 HydrophobicContact CE1-CG2 3.76Å; F47-T51 HydrophobicContact CE2-CG2 4.27Å; F47-T51 HydrophobicContact CZ-CG2 3.84Å; F47-T51 WeakPolarHBondContact O-CG2 3.26Å; F47-T51 PolarHBondContact O-N 2.78Å; F47-T51 PolarHBondContact O-OG1 3.41Å; G48-T51 WeakPolarHBondContact CA-OG1 3.34Å; G48-T51 PolarHBondContact O-N 2.81Å; G48-T51 PolarHBondContact O-OG1 3.27Å; T51-L54 PolarHBondContact O-N 3Å; T51-C55 WeakPolarHBondContact O-CB 3.48Å; T51-C55 PolarHBondContact O-N 3Å; T51-C55 PolarHBondContact O-SG 3.25Å |
| 52 | I | 92.9 | Very high | 87.6 | Confident | 107 Ų | 107 | 92.6 Ų | 92.6 | 55% | 0.549 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.5 | -45.6 | 178.2 | -68.7 | 168.5 | 0 | 0 | 0 | 111 | G48 L54 C55 V56 | G48-I52 WeakPolarHBondContact O-CB 3.33Å; G48-I52 WeakPolarHBondContact O-CD1 3.44Å; G48-I52 WeakPolarHBondContact O-CG1 3.48Å; G48-I52 PolarHBondContact O-N 3.26Å; I52-L54 VanDerWaalsContact C-N 3.34Å; I52-L54 PolarHBondContact O-N 3.43Å; I52-C55 PolarHBondContact O-N 3.23Å; I52-V56 HydrophobicContact CG2-CG2 4.44Å; I52-V56 WeakPolarHBondContact O-CG2 3.4Å; I52-V56 PolarHBondContact O-N 3.34Å |
| 53 | T | 94.7 | Very high | 87.9 | Confident | 91 Ų | 91 | 90.9 Ų | 90.9 | 56% | 0.558 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62.2 | -41.2 | 177.5 | 50.5 | 0 | 0 | 0 | 0 | 112 | L49 V50 G57 | L49-T53 WeakPolarHBondContact O-CB 3.24Å; L49-T53 WeakPolarHBondContact O-CG2 3.38Å; L49-T53 PolarHBondContact O-N 2.94Å; L49-T53 PolarHBondContact O-OG1 2.77Å; V50-T53 WeakPolarHBondContact CA-OG1 3.29Å; V50-T53 PolarHBondContact O-OG1 3.13Å; T53-G57 PolarHBondContact O-N 2.86Å |
| 54 | L | 94.9 | Very high | 87.6 | Confident | 124 Ų | 124 | 89.1 Ų | 89.1 | 65% | 0.649 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.7 | -43.7 | 174.3 | -175.6 | 69.6 | 0 | 0 | 0 | 111.8 | V50 T51 I52 G57 Y58 | V50-L54 VanDerWaalsContact O-CB 3.26Å; V50-L54 WeakPolarHBondContact O-CB 3.47Å; V50-L54 PolarHBondContact O-N 3.5Å; T51-L54 PolarHBondContact O-N 3Å; I52-L54 VanDerWaalsContact C-N 3.34Å; I52-L54 PolarHBondContact O-N 3.43Å; L54-G57 PolarHBondContact O-N 2.95Å; L54-Y58 VanDerWaalsContact O-CB 3.24Å; L54-Y58 WeakPolarHBondContact O-CB 3.35Å; L54-Y58 PolarHBondContact O-N 3.16Å |
| 55 | C | 92.7 | Very high | 87 | Confident | 74 Ų | 74 | 86.4 Ų | 86.4 | 50% | 0.5 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.9 | -49.2 | 178.4 | -71.9 | 0 | 0 | 0 | 0 | 112.2 | T51 I52 Y58 L59 | T51-C55 WeakPolarHBondContact O-CB 3.48Å; T51-C55 PolarHBondContact O-N 3Å; T51-C55 PolarHBondContact O-SG 3.25Å; I52-C55 PolarHBondContact O-N 3.23Å; C55-Y58 PolarHBondContact O-N 2.86Å; C55-L59 WeakPolarHBondContact O-CG 3.21Å; C55-L59 PolarHBondContact O-N 2.97Å |
| 56 | V | 93.2 | Very high | 85.8 | Confident | 96 Ų | 96 | 85.7 Ų | 85.7 | 58% | 0.582 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -67 | -39.7 | 178.9 | 176.9 | 0 | 0 | 0 | 0 | 110.7 | I52 L59 G60 | I52-V56 HydrophobicContact CG2-CG2 4.44Å; I52-V56 WeakPolarHBondContact O-CG2 3.4Å; I52-V56 PolarHBondContact O-N 3.34Å; V56-L59 PolarHBondContact O-N 3.47Å; V56-G60 PolarHBondContact O-N 2.99Å |
| 57 | G | 92.3 | Very high | 84.4 | Confident | 44 Ų | 44 | 88 Ų | 88 | 45% | 0.454 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.5 | -40 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | T53 L54 G60 Y61 | T53-G57 PolarHBondContact O-N 2.86Å; L54-G57 PolarHBondContact O-N 2.95Å; G57-G60 PolarHBondContact O-N 2.83Å; G57-Y61 VanDerWaalsContact O-CB 3.26Å; G57-Y61 WeakPolarHBondContact O-CB 3.2Å; G57-Y61 PolarHBondContact O-N 3.49Å |
| 58 | Y | 87.8 | Confident | 82.7 | Confident | 140 Ų | 140 | 86.6 Ų | 86.6 | 55% | 0.549 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -68.3 | -42.5 | 176 | -179.6 | -109.4 | 0 | 0 | 0 | 112.2 | L54 C55 Y61 L62 | L54-Y58 VanDerWaalsContact O-CB 3.24Å; L54-Y58 WeakPolarHBondContact O-CB 3.35Å; L54-Y58 PolarHBondContact O-N 3.16Å; C55-Y58 PolarHBondContact O-N 2.86Å; Y58-Y61 PolarHBondContact O-N 2.93Å; Y58-L62 HydrophobicContact CD1-CD1 3.95Å; Y58-L62 HydrophobicContact CE1-CD1 3.37Å; Y58-L62 HydrophobicContact CE1-CG 4.24Å; Y58-L62 HydrophobicContact CE2-CD1 4.2Å; Y58-L62 HydrophobicContact CE2-CG 4.25Å; Y58-L62 WeakPolarHBondContact O-CB 3.48Å; Y58-L62 WeakPolarHBondContact O-CG 3.47Å; Y58-L62 PolarHBondContact O-N 3.22Å |
| 59 | L | 87.3 | Confident | 81 | Confident | 111 Ų | 111 | 89.8 Ų | 89.8 | 58% | 0.581 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64.3 | -41.7 | 174.1 | -70.7 | 174.1 | 0 | 0 | 0 | 111.5 | C55 V56 L62 H63 | C55-L59 WeakPolarHBondContact O-CG 3.21Å; C55-L59 PolarHBondContact O-N 2.97Å; V56-L59 PolarHBondContact O-N 3.47Å; L59-L62 PolarHBondContact O-N 2.91Å; L59-H63 VanDerWaalsContact O-CB 3.23Å; L59-H63 WeakPolarHBondContact O-CB 3.44Å; L59-H63 PolarHBondContact O-N 3.36Å |
| 60 | G | 87.8 | Confident | 78.8 | Confident | 38 Ų | 38 | 91.1 Ų | 91.1 | 39% | 0.392 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.9 | -41.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V56 G57 H63 A64 | V56-G60 PolarHBondContact O-N 2.99Å; G57-G60 PolarHBondContact O-N 2.83Å; G60-H63 PolarHBondContact O-N 3.37Å; G60-A64 WeakPolarHBondContact O-CB 3.34Å; G60-A64 PolarHBondContact O-N 2.94Å |
| 61 | Y | 85.4 | Confident | 76.6 | Confident | 152 Ų | 152 | 94.1 Ų | 94.1 | 60% | 0.596 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.3 | -52.3 | 172.6 | 174 | -102.6 | 0 | 0 | 0 | 110.2 | G57 Y58 H63 A64 T65 | G57-Y61 VanDerWaalsContact O-CB 3.26Å; G57-Y61 WeakPolarHBondContact O-CB 3.2Å; G57-Y61 PolarHBondContact O-N 3.49Å; Y58-Y61 PolarHBondContact O-N 2.93Å; Y61-H63 PolarHBondContact O-N 2.74Å; Y61-A64 PolarHBondContact O-N 2.86Å; Y61-T65 HydrophobicContact CD1-CG2 4.23Å; Y61-T65 HydrophobicContact CD2-CG2 3.96Å; Y61-T65 HydrophobicContact CE1-CG2 3.88Å; Y61-T65 HydrophobicContact CE2-CG2 3.58Å; Y61-T65 HydrophobicContact CG-CG2 4.28Å; Y61-T65 WeakPolarHBondContact O-CB 3.26Å; Y61-T65 VanDerWaalsContact O-CG2 3.29Å; Y61-T65 WeakPolarHBondContact O-CG2 3.35Å; Y61-T65 PolarHBondContact O-N 2.89Å; Y61-T65 PolarHBondContact O-OG1 3.13Å; Y61-T65 VanDerWaalsContact O-OG1 3.13Å |
| 62 | L | 79.5 | Confident | 74.5 | Confident | 45 Ų | 45 | 98.3 Ų | 98.3 | 24% | 0.236 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -60.7 | -32.4 | 175.8 | -77.7 | 177.2 | 0 | 0 | 0 | 112.6 | Y58 L59 T65 K66 | Y58-L62 HydrophobicContact CD1-CD1 3.95Å; Y58-L62 HydrophobicContact CE1-CD1 3.37Å; Y58-L62 HydrophobicContact CE1-CG 4.24Å; Y58-L62 HydrophobicContact CE2-CD1 4.2Å; Y58-L62 HydrophobicContact CE2-CG 4.25Å; Y58-L62 WeakPolarHBondContact O-CB 3.48Å; Y58-L62 WeakPolarHBondContact O-CG 3.47Å; Y58-L62 PolarHBondContact O-N 3.22Å; L59-L62 PolarHBondContact O-N 2.91Å; L62-T65 WeakPolarHBondContact CA-OG1 3.24Å; L62-T65 PolarHBondContact O-OG1 2.91Å; L62-K66 WeakPolarHBondContact O-CA 3.39Å; L62-K66 WeakPolarHBondContact O-CB 3.05Å; L62-K66 WeakPolarHBondContact O-CD 3.45Å; L62-K66 WeakPolarHBondContact O-CG 3.46Å; L62-K66 PolarHBondContact O-N 3.29Å |
| 63 | H | 72.8 | Confident | 72.1 | Confident | 123 Ų | 123 | 101 Ų | 101 | 57% | 0.569 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -72.3 | -43.9 | 177.3 | -171.7 | 63.2 | 0 | 0 | 0 | 111.4 | L59 G60 Y61 K66 D67 | L59-H63 VanDerWaalsContact O-CB 3.23Å; L59-H63 WeakPolarHBondContact O-CB 3.44Å; L59-H63 PolarHBondContact O-N 3.36Å; G60-H63 PolarHBondContact O-N 3.37Å; Y61-H63 PolarHBondContact O-N 2.74Å; H63-K66 WeakPolarHBondContact O-CB 3.29Å; H63-K66 PolarHBondContact O-N 3.33Å; H63-D67 PolarHBondContact O-N 3.46Å |
| 64 | A | 72.5 | Confident | 69.8 | Low | 53 Ų | 53 | 101.1 Ų | 101.1 | 44% | 0.438 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -70.7 | -35.3 | 177 | 0 | 0 | 0 | 0 | 0 | 113 | G60 Y61 N68 | G60-A64 WeakPolarHBondContact O-CB 3.34Å; G60-A64 PolarHBondContact O-N 2.94Å; Y61-A64 PolarHBondContact O-N 2.86Å; A64-N68 PolarHBondContact O-N 2.84Å; A64-N68 PolarHBondContact O-ND2 3.39Å |
| 65 | T | 66.3 | Low | 67.6 | Low | 30 Ų | 30 | 97.7 Ų | 97.7 | 18% | 0.184 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -72.2 | -35.3 | 169.7 | 65.4 | 0 | 0 | 0 | 0 | 110.3 | Y61 L62 D67 N68 D69 | Y61-T65 HydrophobicContact CD1-CG2 4.23Å; Y61-T65 HydrophobicContact CD2-CG2 3.96Å; Y61-T65 HydrophobicContact CE1-CG2 3.88Å; Y61-T65 HydrophobicContact CE2-CG2 3.58Å; Y61-T65 HydrophobicContact CG-CG2 4.28Å; Y61-T65 WeakPolarHBondContact O-CB 3.26Å; Y61-T65 VanDerWaalsContact O-CG2 3.29Å; Y61-T65 WeakPolarHBondContact O-CG2 3.35Å; Y61-T65 PolarHBondContact O-N 2.89Å; Y61-T65 PolarHBondContact O-OG1 3.13Å; Y61-T65 VanDerWaalsContact O-OG1 3.13Å; L62-T65 WeakPolarHBondContact CA-OG1 3.24Å; L62-T65 PolarHBondContact O-OG1 2.91Å; T65-D67 PolarHBondContact O-N 3.31Å; T65-N68 CarbonylContact O-C 3.53Å; T65-N68 PolarHBondContact O-N 3.24Å; T65-N68 VanDerWaalsContact O-N 3.14Å; T65-D69 VanDerWaalsContact O-CB 3.26Å; T65-D69 WeakPolarHBondContact O-CB 3.36Å; T65-D69 PolarHBondContact O-N 3.12Å |
| 66 | K | 58.7 | Low | 65.5 | Low | 110 Ų | 110 | 99.9 Ų | 99.9 | 48% | 0.478 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.4 | -39.1 | 172.7 | -84 | 163.6 | -172.1 | 155.3 | 0 | 112.2 | L62 H63 N68 D69 Q70 | L62-K66 WeakPolarHBondContact O-CA 3.39Å; L62-K66 WeakPolarHBondContact O-CB 3.05Å; L62-K66 WeakPolarHBondContact O-CD 3.45Å; L62-K66 WeakPolarHBondContact O-CG 3.46Å; L62-K66 PolarHBondContact O-N 3.29Å; H63-K66 WeakPolarHBondContact O-CB 3.29Å; H63-K66 PolarHBondContact O-N 3.33Å; K66-N68 VanDerWaalsContact C-N 3.31Å; K66-N68 PolarHBondContact O-N 3.18Å; K66-D69 CarbonylContact O-C 3.52Å; K66-D69 PolarHBondContact O-N 2.99Å; K66-Q70 HydrophobicContact CB-CG 4.4Å; K66-Q70 WeakPolarHBondContact O-CA 3.31Å; K66-Q70 WeakPolarHBondContact O-CB 3.06Å; K66-Q70 WeakPolarHBondContact O-CG 3.44Å; K66-Q70 PolarHBondContact O-N 3.42Å |
| 67 | D | 55 | Low | 63.6 | Low | 99 Ų | 99 | 101.2 Ų | 101.2 | 53% | 0.529 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.8 | -33.8 | 175.3 | -73.2 | -38.4 | 0 | 0 | 0 | 112.4 | H63 T65 Q71 | H63-D67 PolarHBondContact O-N 3.46Å; T65-D67 PolarHBondContact O-N 3.31Å; D67-Q71 PolarHBondContact O-N 3.48Å |
| 68 | N | 53.4 | Low | 61.8 | Low | 115 Ų | 115 | 105 Ų | 105 | 62% | 0.615 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -72.9 | -39.4 | 172.8 | -79.5 | -82.4 | 0 | 0 | 0 | 113 | A64 T65 K66 L72 | A64-N68 PolarHBondContact O-N 2.84Å; A64-N68 PolarHBondContact O-ND2 3.39Å; T65-N68 CarbonylContact O-C 3.53Å; T65-N68 PolarHBondContact O-N 3.24Å; T65-N68 VanDerWaalsContact O-N 3.14Å; K66-N68 VanDerWaalsContact C-N 3.31Å; K66-N68 PolarHBondContact O-N 3.18Å; N68-L72 PolarHBondContact O-N 3.09Å |
| 69 | D | 52.4 | Low | 60.2 | Low | 92 Ų | 92 | 107.5 Ų | 107.5 | 49% | 0.492 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -80 | -21.2 | 177.3 | -85.7 | -57.4 | 0 | 0 | 0 | 112.3 | T65 K66 L72 Y73 | T65-D69 VanDerWaalsContact O-CB 3.26Å; T65-D69 WeakPolarHBondContact O-CB 3.36Å; T65-D69 PolarHBondContact O-N 3.12Å; K66-D69 CarbonylContact O-C 3.52Å; K66-D69 PolarHBondContact O-N 2.99Å; D69-L72 CarbonylContact O-C 3.29Å; D69-L72 VanDerWaalsContact O-C 3.29Å; D69-L72 WeakPolarHBondContact O-CA 3.31Å; D69-L72 PolarHBondContact O-N 3.26Å; D69-Y73 WeakPolarHBondContact O-CA 3.37Å; D69-Y73 WeakPolarHBondContact O-CB 3.48Å; D69-Y73 PolarHBondContact O-N 2.96Å |
| 70 | Q | 48.1 | Very low | 58.5 | Low | 127 Ų | 127 | 103.8 Ų | 103.8 | 59% | 0.593 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -81.2 | -25.4 | 171.6 | -70 | -96.9 | -106.7 | 0 | 0 | 110.2 | K66 L72 Y73 E74 | K66-Q70 HydrophobicContact CB-CG 4.4Å; K66-Q70 WeakPolarHBondContact O-CA 3.31Å; K66-Q70 WeakPolarHBondContact O-CB 3.06Å; K66-Q70 WeakPolarHBondContact O-CG 3.44Å; K66-Q70 PolarHBondContact O-N 3.42Å; Q70-L72 VanDerWaalsContact C-N 3.27Å; Q70-Y73 CarbonylContact O-C 3.44Å; Q70-E74 PolarHBondContact O-N 2.84Å |
| 71 | Q | 48.2 | Very low | 56.5 | Low | 155 Ų | 155 | 109 Ų | 109 | 72% | 0.724 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | -22.4 | 162.2 | -153.3 | 177.9 | -44 | 0 | 0 | 111.7 | D67 | D67-Q71 PolarHBondContact O-N 3.48Š|
| 72 | L | 48.2 | Very low | 54.9 | Low | 139 Ų | 139 | 106.4 Ų | 106.4 | 73% | 0.728 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.2 | -12.7 | 172.6 | -127.7 | 93.4 | 0 | 0 | 0 | 114.5 | N68 D69 Q70 | N68-L72 PolarHBondContact O-N 3.09Å; D69-L72 CarbonylContact O-C 3.29Å; D69-L72 VanDerWaalsContact O-C 3.29Å; D69-L72 WeakPolarHBondContact O-CA 3.31Å; D69-L72 PolarHBondContact O-N 3.26Å; Q70-L72 VanDerWaalsContact C-N 3.27Å |
| 73 | Y | 43.1 | Very low | 53.4 | Low | 163 Ų | 163 | 110.9 Ų | 110.9 | 64% | 0.639 | 58% | 0.576 | S | S | * | * | trans | -113.2 | 46.4 | 173 | -149.8 | -90.7 | 0 | 0 | 0 | 108.5 | D69 Q70 A75 | D69-Y73 WeakPolarHBondContact O-CA 3.37Å; D69-Y73 WeakPolarHBondContact O-CB 3.48Å; D69-Y73 PolarHBondContact O-N 2.96Å; Q70-Y73 CarbonylContact O-C 3.44Å; Y73-A75 VanDerWaalsContact C-N 3.27Å; Y73-A75 PolarHBondContact O-N 3.48Å | ||
| 74 | E | 45.3 | Very low | 52.4 | Low | 94 Ų | 94 | 114.3 Ų | 114.3 | 44% | 0.439 | 60% | 0.595 | S | S | . | * | S | Bend | trans | -51.4 | 108.8 | 136.7 | -72.7 | -178.1 | 120.2 | 0 | 0 | 105.9 | Q70 I76 K82 | Q70-E74 PolarHBondContact O-N 2.84Å; E74-I76 PolarHBondContact O-N 3.27Å; E74-K82 HydrophobicContact CB-CB 4.04Å; E74-K82 HydrophobicContact CB-CD 3.47Å; E74-K82 VanDerWaalsContact CB-CD 3.47Å; E74-K82 HydrophobicContact CB-CG 3.6Å; E74-K82 HydrophobicContact CG-CB 4.48Å; E74-K82 HydrophobicContact CG-CD 3.95Å; E74-K82 HydrophobicContact CG-CG 4.4Å; E74-K82 VanDerWaalsContact OE2-CD 3.27Å; E74-K82 WeakPolarHBondContact OE2-CD 3.13Å; E74-K82 WeakPolarHBondContact OE2-CE 3.41Å; E74-K82 IonicContact OE2-NZ 2.57Å; E74-K82 PolarHBondContact OE2-NZ 3.15Å |
| 75 | A | 50.8 | Low | 51.7 | Low | 52 Ų | 52 | 122.7 Ų | 122.7 | 43% | 0.43 | 62% | 0.615 | S | S | . | * | trans | -42.5 | 106 | -174.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | Y73 D77 | Y73-A75 VanDerWaalsContact C-N 3.27Å; Y73-A75 PolarHBondContact O-N 3.48Å; A75-D77 PolarHBondContact O-N 3.24Å | ||
| 76 | I | 47.5 | Very low | 51.3 | Low | 120 Ų | 120 | 132.9 Ų | 132.9 | 62% | 0.615 | 65% | 0.65 | S | S | * | * | trans | -78.7 | 85.9 | 159.1 | -59.3 | 178.3 | 0 | 0 | 0 | 103.5 | E74 | E74-I76 PolarHBondContact O-N 3.27Š| ||
| 77 | D | 52.6 | Low | 51.2 | Low | 123 Ų | 123 | 137.5 Ų | 137.5 | 66% | 0.658 | 67% | 0.671 | S | S | * | * | trans | -54.2 | 157.4 | 148.1 | -144 | -13.1 | 0 | 0 | 0 | 106.9 | A75 E79 G80 | A75-D77 PolarHBondContact O-N 3.24Å; D77-E79 PolarHBondContact O-N 3.37Å; D77-G80 PolarHBondContact O-N 2.87Å | ||
| 78 | S | 55.1 | Low | 51.5 | Low | 125 Ų | 125 | 138.8 Ų | 138.8 | 87% | 0.874 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.8 | 1.6 | -168.1 | -61.2 | 0 | 0 | 0 | 0 | 115.5 | ||
| 79 | E | 54.2 | Low | 52.1 | Low | 191 Ų | 191 | 137.6 Ų | 137.6 | 89% | 0.893 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126 | 16.1 | 171.9 | -65.8 | -170.7 | 95 | 0 | 0 | 115.3 | D77 E81 | D77-E79 PolarHBondContact O-N 3.37Å; E79-E81 PolarHBondContact O-N 3.5Å |
| 80 | G | 52.5 | Low | 52.6 | Low | 34 Ų | 34 | 142.4 Ų | 142.4 | 35% | 0.351 | 70% | 0.699 | S | S | . | * | trans | 74.5 | 19.3 | 159.6 | 0 | 0 | 0 | 0 | 0 | 119.2 | D77 | D77-G80 PolarHBondContact O-N 2.87Š| ||
| 81 | E | 45.2 | Very low | 53.6 | Low | 147 Ų | 147 | 147.5 Ų | 147.5 | 69% | 0.687 | 71% | 0.713 | S | S | * | * | trans | -110.3 | 130.2 | -179.8 | -86.7 | -67.2 | 159.8 | 0 | 0 | 114.3 | E79 | E79-E81 PolarHBondContact O-N 3.5Š| ||
| 82 | K | 51.9 | Low | 53.7 | Low | 98 Ų | 98 | 151.1 Ų | 151.1 | 43% | 0.426 | 74% | 0.738 | S | S | . | * | trans | -110.6 | 86.8 | -154.5 | -56 | 160 | 159 | 179.9 | 0 | 110.1 | E74 M84 | E74-K82 HydrophobicContact CB-CB 4.04Å; E74-K82 HydrophobicContact CB-CD 3.47Å; E74-K82 VanDerWaalsContact CB-CD 3.47Å; E74-K82 HydrophobicContact CB-CG 3.6Å; E74-K82 HydrophobicContact CG-CB 4.48Å; E74-K82 HydrophobicContact CG-CD 3.95Å; E74-K82 HydrophobicContact CG-CG 4.4Å; E74-K82 VanDerWaalsContact OE2-CD 3.27Å; E74-K82 WeakPolarHBondContact OE2-CD 3.13Å; E74-K82 WeakPolarHBondContact OE2-CE 3.41Å; E74-K82 IonicContact OE2-NZ 2.57Å; E74-K82 PolarHBondContact OE2-NZ 3.15Å; K82-M84 PolarHBondContact O-N 3.14Å | ||
| 83 | N | 48.2 | Very low | 54 | Low | 138 Ų | 138 | 151.8 Ų | 151.8 | 74% | 0.738 | 74% | 0.738 | S | S | * | * | trans | -98.8 | 91.5 | -174 | -76.2 | -80.7 | 0 | 0 | 0 | 112.8 | R85 | N83-R85 PolarHBondContact O-N 3.13Å; N83-R85 VanDerWaalsContact O-N 3.16Å | ||
| 84 | M | 52 | Low | 54.6 | Low | 196 Ų | 196 | 151.2 Ų | 151.2 | 97% | 0.966 | 74% | 0.743 | S | S | * | * | trans | -68.1 | 100.8 | 165.4 | -101.3 | 170 | 53.2 | 0 | 0 | 110.5 | K82 | K82-M84 PolarHBondContact O-N 3.14Š| ||
| 85 | R | 56.3 | Low | 55.1 | Low | 229 Ų | 229 | 154.3 Ų | 154.3 | 86% | 0.864 | 76% | 0.76 | S | S | * | * | trans | -112 | 112.2 | 168.4 | -86 | -77 | -172.4 | 126.2 | 0.1 | 110.9 | N83 K87 | N83-R85 PolarHBondContact O-N 3.13Å; N83-R85 VanDerWaalsContact O-N 3.16Å; R85-K87 PolarHBondContact O-N 2.88Å | ||
| 86 | R | 57.9 | Low | 55.3 | Low | 244 Ų | 244 | 160.4 Ų | 160.4 | 92% | 0.921 | 78% | 0.78 | S | S | * | * | trans | -62.1 | 122.3 | 170.8 | -161.8 | 176.4 | -173.1 | 179.5 | 2.1 | 109 | T88 | R86-T88 PolarHBondContact O-N 2.8Å; R86-T88 VanDerWaalsContact O-N 3.15Å | ||
| 87 | K | 57.8 | Low | 55.8 | Low | 207 Ų | 207 | 162.9 Ų | 162.9 | 90% | 0.9 | 79% | 0.79 | S | S | * | * | trans | -64.8 | 114 | 174.5 | -74.7 | -165.3 | 176.2 | -173.4 | 0 | 109.2 | R85 | R85-K87 PolarHBondContact O-N 2.88Š| ||
| 88 | T | 61 | Low | 56 | Low | 125 Ų | 125 | 165.5 Ų | 165.5 | 77% | 0.767 | 80% | 0.799 | S | S | * | * | trans | -84.8 | 135.2 | 166.7 | -171.2 | 0 | 0 | 0 | 0 | 109.2 | R86 | R86-T88 PolarHBondContact O-N 2.8Å; R86-T88 VanDerWaalsContact O-N 3.15Å | ||
| 89 | S | 65.8 | Low | 56.1 | Low | 90 Ų | 90 | 168.4 Ų | 168.4 | 63% | 0.629 | 79% | 0.793 | S | S | * | * | trans | -65.1 | 129.9 | 176.3 | 165.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 90 | K | 64 | Low | 56.3 | Low | 194 Ų | 194 | 166.7 Ų | 166.7 | 84% | 0.843 | 79% | 0.786 | S | S | * | * | trans | -104.9 | 46.3 | 173.3 | -65.5 | -157.1 | 75.7 | 163.2 | 0 | 111.8 | ||||
| 91 | W | 68.4 | Low | 56.6 | Low | 234 Ų | 234 | 177.8 Ų | 177.8 | 89% | 0.886 | 82% | 0.822 | S | S | * | * | trans | -109.7 | 93.8 | 169.7 | -61.3 | 106.2 | 0 | 0 | 0 | 107.7 | ||||
| 92 | D | 50.6 | Low | 57.6 | Low | 231 Ų | 231 | 180.5 Ų | 180.5 | 100% | 1.235 | 83% | 0.834 | S | S | * | * | trans | -81.9 | 0 | 141.8 | -172.6 | -109.3 | 0 | 0 | 0 | 106.7 |
Retrieved 92 of 92 residues in 76.7 ms
(Link to these results)