| 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 | 44.1 | Very low | 45.7 | Very low | 235 Ų | 235 | 164.9 Ų | 164.9 | 100% | 1.158 | 87% | 0.866 | S | S | * | * | 0 | 107.6 | 0 | -75.6 | 165.9 | 166.7 | 0 | 0 | 108.2 | |||||
| 2 | N | 39.1 | Very low | 45.9 | Very low | 172 Ų | 172 | 160.7 Ų | 160.7 | 92% | 0.92 | 87% | 0.873 | S | S | * | * | trans | -177.5 | 110.8 | 147.3 | -90.7 | -30.4 | 0 | 0 | 0 | 107.2 | ||||
| 3 | S | 43.3 | Very low | 45.5 | Very low | 109 Ų | 109 | 153.8 Ų | 153.8 | 76% | 0.762 | 86% | 0.863 | S | S | * | * | trans | -85.7 | 143 | 177.3 | -167.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 4 | S | 49.9 | Very low | 45.8 | Very low | 123 Ų | 123 | 156.7 Ų | 156.7 | 86% | 0.86 | 87% | 0.866 | S | S | * | * | trans | -146 | 102.8 | 165.1 | -78.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 5 | M | 43.4 | Very low | 45.8 | Very low | 168 Ų | 168 | 154.3 Ų | 154.3 | 83% | 0.828 | 85% | 0.851 | S | S | * | * | trans | -59.6 | 134.4 | 164.7 | -67.7 | 163.1 | 68.6 | 0 | 0 | 109.7 | ||||
| 6 | K | 57.1 | Low | 46.3 | Very low | 219 Ų | 219 | 150.6 Ų | 150.6 | 95% | 0.952 | 83% | 0.834 | S | S | * | * | trans | -122 | 118.4 | 154.6 | -92.5 | -169.6 | 173.7 | -173.6 | 0 | 109 | ||||
| 7 | Q | 51.8 | Low | 46.8 | Very low | 177 Ų | 177 | 152.1 Ų | 152.1 | 83% | 0.827 | 83% | 0.83 | S | S | * | * | trans | -104.9 | 135.7 | 171.2 | -179.3 | -177.3 | 9.2 | 0 | 0 | 107.8 | ||||
| 8 | K | 48.6 | Very low | 47.2 | Very low | 181 Ų | 181 | 151.1 Ų | 151.1 | 79% | 0.787 | 82% | 0.823 | S | S | * | * | trans | 135.7 | 137.6 | 166.1 | -95.5 | -174.6 | 164.1 | -166.1 | 0 | 109.1 | ||||
| 9 | Q | 44.4 | Very low | 47.9 | Very low | 162 Ų | 162 | 147.7 Ų | 147.7 | 76% | 0.757 | 81% | 0.812 | S | S | * | * | cis | -160.2 | 151.4 | 16.6 | -154 | 162.4 | -37 | 0 | 0 | 109.2 | ||||
| 10 | E | 44.9 | Very low | 48.6 | Very low | 192 Ų | 192 | 146.6 Ų | 146.6 | 90% | 0.897 | 81% | 0.812 | S | S | * | * | trans | -59.5 | 147.3 | 168 | -165.4 | 174.8 | -158.4 | 0 | 0 | 112.6 | ||||
| 11 | G | 36.1 | Very low | 49.6 | Very low | 76 Ų | 76 | 144.4 Ų | 144.4 | 78% | 0.784 | 80% | 0.803 | S | S | * | * | trans | 173.1 | 101.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 12 | A | 48 | Very low | 51.1 | Low | 114 Ų | 114 | 138.5 Ų | 138.5 | 94% | 0.942 | 78% | 0.782 | S | S | * | * | trans | -55.9 | 148.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 13 | G | 40.9 | Very low | 52.7 | Low | 72 Ų | 72 | 141.7 Ų | 141.7 | 74% | 0.742 | 78% | 0.781 | S | S | * | * | trans | -174.3 | 67.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | N15 | G13-N15 PolarHBondContact O-N 3.1Å; G13-N15 VanDerWaalsContact O-N 3.1Å | ||
| 14 | E | 49.7 | Very low | 54.4 | Low | 194 Ų | 194 | 147.7 Ų | 147.7 | 91% | 0.907 | 79% | 0.787 | S | S | * | * | trans | -50.3 | 113.5 | 159.1 | -93 | 179.2 | 132.8 | 0 | 0 | 108.9 | ||||
| 15 | N | 46 | Very low | 55.8 | Low | 121 Ų | 121 | 147.9 Ų | 147.9 | 65% | 0.647 | 78% | 0.783 | S | S | * | * | trans | -139.2 | 78.3 | 154.5 | -165.3 | -22.4 | 0 | 0 | 0 | 107.7 | G13 K17 | G13-N15 PolarHBondContact O-N 3.1Å; G13-N15 VanDerWaalsContact O-N 3.1Å; N15-K17 PolarHBondContact O-N 3.48Å; N15-K17 WeakPolarHBondContact OD1-CG 3.37Å | ||
| 16 | V | 52.8 | Low | 57.5 | Low | 95 Ų | 95 | 148.2 Ų | 148.2 | 58% | 0.576 | 79% | 0.787 | S | S | * | * | trans | -64.2 | 93 | 161.1 | -173.8 | 0 | 0 | 0 | 0 | 106.1 | N18 | V16-N18 WeakPolarHBondContact CG1-ND2 3.11Å; V16-N18 WeakPolarHBondContact CG1-OD1 3.49Å; V16-N18 PolarHBondContact O-N 2.98Å; V16-N18 PolarHBondContact O-ND2 2.81Å | ||
| 17 | K | 54.7 | Low | 58.7 | Low | 176 Ų | 176 | 146.7 Ų | 146.7 | 77% | 0.765 | 78% | 0.781 | S | S | * | * | trans | -69.4 | 79 | 167.5 | -65.6 | -179.4 | -176.8 | 176.9 | 0 | 107.8 | N15 S19 | N15-K17 PolarHBondContact O-N 3.48Å; N15-K17 WeakPolarHBondContact OD1-CG 3.37Å; K17-S19 VanDerWaalsContact C-N 3.3Å; K17-S19 PolarHBondContact O-N 2.92Å | ||
| 18 | N | 55.2 | Low | 59.8 | Low | 133 Ų | 133 | 145.6 Ų | 145.6 | 71% | 0.711 | 78% | 0.778 | S | S | * | * | trans | -67.2 | 94 | 165.2 | -61 | -56.7 | 0 | 0 | 0 | 106.8 | V16 | V16-N18 WeakPolarHBondContact CG1-ND2 3.11Å; V16-N18 WeakPolarHBondContact CG1-OD1 3.49Å; V16-N18 PolarHBondContact O-N 2.98Å; V16-N18 PolarHBondContact O-ND2 2.81Å | ||
| 19 | S | 60.5 | Low | 61.2 | Low | 87 Ų | 87 | 144.5 Ų | 144.5 | 61% | 0.608 | 78% | 0.778 | S | S | * | * | trans | -64.8 | 132.7 | 165.5 | 58 | 0 | 0 | 0 | 0 | 107.8 | K17 V21 | K17-S19 VanDerWaalsContact C-N 3.3Å; K17-S19 PolarHBondContact O-N 2.92Å; S19-V21 PolarHBondContact O-N 2.83Å | ||
| 20 | P | 62.4 | Low | 62.6 | Low | 126 Ų | 126 | 143.7 Ų | 143.7 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -77.3 | 76.9 | 173.9 | 31.8 | -30.9 | 0 | 0 | 0 | 107.1 | P22 | P20-P22 VanDerWaalsContact O-CD 3.22Å; P20-P22 WeakPolarHBondContact O-CD 3.22Å | ||
| 21 | V | 69.5 | Low | 64.1 | Low | 101 Ų | 101 | 139.9 Ų | 139.9 | 61% | 0.612 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 117.4 | 167.4 | -178.9 | 0 | 0 | 0 | 0 | 106.3 | S19 R23 | S19-V21 PolarHBondContact O-N 2.83Å; V21-R23 PolarHBondContact O-N 3.2Å; V21-R23 VanDerWaalsContact O-N 3.09Å |
| 22 | P | 74.5 | Confident | 65.6 | Low | 110 Ų | 110 | 140.7 Ų | 140.7 | 71% | 0.714 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 120.7 | 176.2 | -18.9 | 31.7 | 0 | 0 | 0 | 108.4 | P20 R24 | P20-P22 VanDerWaalsContact O-CD 3.22Å; P20-P22 WeakPolarHBondContact O-CD 3.22Å; P22-R24 PolarHBondContact O-N 3.09Å |
| 23 | R | 73.2 | Confident | 66.5 | Low | 239 Ų | 239 | 139.4 Ų | 139.4 | 90% | 0.902 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 123 | 174.3 | -76.6 | 179.2 | 153.9 | 162.4 | -5.7 | 108.3 | V21 T25 | V21-R23 PolarHBondContact O-N 3.2Å; V21-R23 VanDerWaalsContact O-N 3.09Å; R23-T25 PolarHBondContact O-N 3.26Å |
| 24 | R | 78.9 | Confident | 67.6 | Low | 235 Ų | 235 | 143.2 Ų | 143.2 | 89% | 0.887 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 116.5 | 171.1 | -72.3 | -175.1 | 170.6 | 91.8 | -1.1 | 107.9 | P22 | P22-R24 PolarHBondContact O-N 3.09Š|
| 25 | T | 79.1 | Confident | 68.5 | Low | 128 Ų | 128 | 136.6 Ų | 136.6 | 79% | 0.785 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 140.6 | 170.9 | 52.9 | 0 | 0 | 0 | 0 | 109.4 | R23 K27 | R23-T25 PolarHBondContact O-N 3.26Å; T25-K27 PolarHBondContact O-N 3.05Å |
| 26 | L | 79.5 | Confident | 69.5 | Low | 175 Ų | 175 | 135.4 Ų | 135.4 | 92% | 0.916 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 135.1 | 176.6 | -65.9 | 173.1 | 0 | 0 | 0 | 109.9 | ||
| 27 | K | 81.8 | Confident | 70 | Confident | 187 Ų | 187 | 138.4 Ų | 138.4 | 81% | 0.813 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -88 | 138.6 | 173.6 | -69.1 | -176.6 | 176.5 | 177.9 | 0 | 109 | T25 I29 | T25-K27 PolarHBondContact O-N 3.05Å; K27-I29 WeakPolarHBondContact O-CG1 3.28Å; K27-I29 PolarHBondContact O-N 3.09Å |
| 28 | M | 75.7 | Confident | 70.3 | Confident | 154 Ų | 154 | 137.1 Ų | 137.1 | 76% | 0.759 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 118.3 | 167.6 | -69.2 | -155.4 | -51 | 0 | 0 | 108.7 | Q30 | M28-Q30 VanDerWaalsContact C-N 3.34Š|
| 29 | I | 77.1 | Confident | 70.5 | Confident | 157 Ų | 157 | 134.5 Ų | 134.5 | 81% | 0.805 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -85.6 | -17.2 | -179.4 | -45.7 | 178.7 | 0 | 0 | 0 | 110.3 | K27 | K27-I29 WeakPolarHBondContact O-CG1 3.28Å; K27-I29 PolarHBondContact O-N 3.09Å |
| 30 | Q | 75.4 | Confident | 70.5 | Confident | 146 Ų | 146 | 140.4 Ų | 140.4 | 68% | 0.682 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -132.4 | 140 | -179.7 | -60.5 | -71.5 | -75.5 | 0 | 0 | 109.3 | M28 | M28-Q30 VanDerWaalsContact C-N 3.34Š|
| 31 | P | 75.1 | Confident | 70.2 | Confident | 111 Ų | 111 | 142.9 Ų | 142.9 | 72% | 0.721 | 78% | 0.776 | S | S | * | * | trans | -55.9 | 140.3 | 169.3 | -17.7 | 29.2 | 0 | 0 | 0 | 109.5 | A33 | P31-A33 PolarHBondContact O-N 3.46Š| ||
| 32 | S | 68.1 | Low | 69.2 | Low | 94 Ų | 94 | 145.8 Ų | 145.8 | 66% | 0.657 | 79% | 0.789 | S | S | * | * | trans | -56.6 | 106.8 | 172.7 | -174 | 0 | 0 | 0 | 0 | 108.2 | T34 | S32-T34 PolarHBondContact O-N 3.18Å; S32-T34 PolarHBondContact O-OG1 3.46Å | ||
| 33 | A | 66.5 | Low | 68.1 | Low | 87 Ų | 87 | 149.3 Ų | 149.3 | 72% | 0.719 | 80% | 0.795 | S | S | * | * | trans | -64.3 | 105.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 107.9 | P31 G35 | P31-A33 PolarHBondContact O-N 3.46Å; A33-G35 PolarHBondContact O-N 2.93Å | ||
| 34 | T | 64.4 | Low | 67.1 | Low | 152 Ų | 152 | 142.8 Ų | 142.8 | 93% | 0.933 | 79% | 0.786 | S | S | * | * | trans | -80.6 | 69.5 | 170.8 | -40.3 | 0 | 0 | 0 | 0 | 106.8 | S32 | S32-T34 PolarHBondContact O-N 3.18Å; S32-T34 PolarHBondContact O-OG1 3.46Å | ||
| 35 | G | 67.3 | Low | 65.8 | Low | 55 Ų | 55 | 137.4 Ų | 137.4 | 57% | 0.567 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -170.4 | 149.7 | -171.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | A33 L37 | A33-G35 PolarHBondContact O-N 2.93Å; G35-L37 PolarHBondContact O-N 2.91Å |
| 36 | S | 67.1 | Low | 64.5 | Low | 96 Ų | 96 | 141 Ų | 141 | 67% | 0.671 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 123.3 | 177.8 | -170.5 | 0 | 0 | 0 | 0 | 110.1 | V38 | S36-V38 PolarHBondContact O-N 3.43Š|
| 37 | L | 63.2 | Low | 62.7 | Low | 157 Ų | 157 | 136.3 Ų | 136.3 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 123.3 | 176.7 | -142.7 | 118.3 | 0 | 0 | 0 | 108.6 | G35 G39 | G35-L37 PolarHBondContact O-N 2.91Å; L37-G39 PolarHBondContact O-N 3.49Å; L37-G39 VanDerWaalsContact O-N 3.14Å |
| 38 | V | 62.6 | Low | 61.3 | Low | 150 Ų | 150 | 136 Ų | 136 | 91% | 0.909 | 79% | 0.787 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.3 | 121.1 | 179.4 | 173.9 | 0 | 0 | 0 | 0 | 108.3 | S36 | S36-V38 PolarHBondContact O-N 3.43Š|
| 39 | G | 58.3 | Low | 60.1 | Low | 78 Ų | 78 | 134.3 Ų | 134.3 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 137.4 | -13.3 | -176.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | L37 | L37-G39 PolarHBondContact O-N 3.49Å; L37-G39 VanDerWaalsContact O-N 3.14Å |
| 40 | R | 61.1 | Low | 59 | Low | 211 Ų | 211 | 135 Ų | 135 | 80% | 0.796 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -89.9 | 114.2 | 162.9 | -90.3 | -171.3 | 173.5 | -128.6 | -0.9 | 109.5 | ||
| 41 | E | 54.8 | Low | 57.8 | Low | 177 Ų | 177 | 137.6 Ų | 137.6 | 83% | 0.827 | 79% | 0.79 | S | S | * | * | trans | -55.4 | 138.2 | 168.8 | 62 | -155 | 164.4 | 0 | 0 | 111.3 | E43 | E41-E43 PolarHBondContact O-N 3.06Š| ||
| 42 | N | 49.8 | Very low | 56.3 | Low | 163 Ų | 163 | 140.3 Ų | 140.3 | 87% | 0.872 | 79% | 0.791 | S | S | * | * | trans | -80.7 | 98.5 | -171.4 | -56.8 | -60.4 | 0 | 0 | 0 | 109.8 | ||||
| 43 | E | 50.6 | Low | 55.4 | Low | 183 Ų | 183 | 142.9 Ų | 142.9 | 86% | 0.855 | 80% | 0.797 | S | S | * | * | trans | -81.9 | 120.4 | 160 | -66.5 | -152.7 | 158.2 | 0 | 0 | 109.7 | E41 | E41-E43 PolarHBondContact O-N 3.06Š| ||
| 44 | S | 52.6 | Low | 53.8 | Low | 102 Ų | 102 | 150 Ų | 150 | 71% | 0.713 | 81% | 0.805 | S | S | * | * | trans | -61.9 | 146 | -177.1 | 60.5 | 0 | 0 | 0 | 0 | 112.9 | K46 | S44-K46 PolarHBondContact O-N 2.95Š| ||
| 45 | P | 51.1 | Low | 52.6 | Low | 122 Ų | 122 | 148.9 Ų | 148.9 | 79% | 0.792 | 79% | 0.793 | S | S | * | * | trans | -85.1 | 106.5 | -178.8 | 33 | -29.9 | 0 | 0 | 0 | 110.4 | ||||
| 46 | K | 52.4 | Low | 51.4 | Low | 205 Ų | 205 | 153.5 Ų | 153.5 | 89% | 0.891 | 81% | 0.805 | S | S | * | * | trans | -154.7 | 116.8 | 155.8 | -97.9 | 131.7 | -176.5 | -175.3 | 0 | 109.5 | S44 | S44-K46 PolarHBondContact O-N 2.95Š| ||
| 47 | G | 41.3 | Very low | 50 | Low | 75 Ų | 75 | 157.3 Ų | 157.3 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | trans | 127.3 | 89.2 | 166.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | S49 | G47-S49 PolarHBondContact O-N 3.45Å; G47-S49 VanDerWaalsContact O-N 3.16Å | ||
| 48 | L | 52.3 | Low | 49.3 | Very low | 182 Ų | 182 | 156.9 Ų | 156.9 | 95% | 0.953 | 81% | 0.81 | S | S | * | * | trans | -58.9 | 113 | 157.9 | -67.8 | 167.6 | 0 | 0 | 0 | 108.5 | ||||
| 49 | S | 51.6 | Low | 47.9 | Very low | 118 Ų | 118 | 156.6 Ų | 156.6 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | -138.3 | 113 | 152.7 | -173.7 | 0 | 0 | 0 | 0 | 108.9 | G47 | G47-S49 PolarHBondContact O-N 3.45Å; G47-S49 VanDerWaalsContact O-N 3.16Å | ||
| 50 | K | 53.1 | Low | 47.3 | Very low | 171 Ų | 171 | 158 Ų | 158 | 74% | 0.743 | 81% | 0.806 | S | S | * | * | trans | -69.7 | 148.7 | 177.7 | -68.4 | -162.7 | 174.1 | -175.4 | 0 | 109.9 | ||||
| 51 | R | 49.5 | Very low | 46.2 | Very low | 200 Ų | 200 | 157.3 Ų | 157.3 | 76% | 0.755 | 81% | 0.809 | S | S | * | * | trans | 73 | 115.8 | 139.2 | -174.2 | -173.5 | -64.8 | 145 | -5.4 | 114.5 | ||||
| 52 | K | 44.7 | Very low | 45 | Very low | 169 Ų | 169 | 154.4 Ų | 154.4 | 74% | 0.735 | 80% | 0.804 | S | S | * | * | -168.4 | 109.3 | 110.6 | -91.1 | -78.6 | 177.1 | 170.2 | 0 | 109.5 | |||||
| 53 | L | 48.2 | Very low | 44.5 | Very low | 148 Ų | 148 | 152 Ų | 152 | 78% | 0.775 | 80% | 0.8 | S | S | * | * | trans | -60.4 | 117.8 | 157.2 | 173.9 | 72.5 | 0 | 0 | 0 | 108.2 | ||||
| 54 | W | 34.2 | Very low | 44.2 | Very low | 235 Ų | 235 | 149.3 Ų | 149.3 | 89% | 0.89 | 80% | 0.801 | S | S | * | * | trans | -112.3 | 101.9 | 166.4 | -88.8 | 30.9 | 0 | 0 | 0 | 108 | ||||
| 55 | N | 38.8 | Very low | 43.5 | Very low | 129 Ų | 129 | 150.6 Ų | 150.6 | 69% | 0.69 | 81% | 0.81 | S | S | * | * | trans | -108 | 142.8 | 157.3 | -93 | -61 | 0 | 0 | 0 | 107.6 | ||||
| 56 | D | 42 | Very low | 42.6 | Very low | 152 Ų | 152 | 148 Ų | 148 | 81% | 0.813 | 81% | 0.805 | S | S | * | * | trans | 19.5 | 117.3 | 152.2 | -80.9 | -23.7 | 0 | 0 | 0 | 119.2 | ||||
| 57 | Q | 38 | Very low | 42.6 | Very low | 177 Ų | 177 | 144.1 Ų | 144.1 | 83% | 0.827 | 80% | 0.801 | S | S | * | * | -164.8 | 111.8 | 124.9 | -152.4 | 154.4 | 93.6 | 0 | 0 | 112.7 | |||||
| 58 | L | 47.6 | Very low | 42.5 | Very low | 148 Ų | 148 | 149.5 Ų | 149.5 | 78% | 0.775 | 81% | 0.806 | S | S | * | * | 22.7 | 115.8 | 129.9 | -55.4 | 165.7 | 0 | 0 | 0 | 117.4 | |||||
| 59 | T | 35 | Very low | 42.4 | Very low | 143 Ų | 143 | 145.6 Ų | 145.6 | 88% | 0.877 | 80% | 0.8 | S | S | * | * | trans | -127.6 | 95.7 | 146.4 | 59.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 60 | S | 44 | Very low | 41.8 | Very low | 108 Ų | 108 | 144.7 Ų | 144.7 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | trans | -65.8 | 132.3 | 164.4 | -49 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 61 | K | 39.5 | Very low | 41.5 | Very low | 197 Ų | 197 | 144.3 Ų | 144.3 | 86% | 0.857 | 79% | 0.794 | S | S | * | * | trans | -156.8 | 108.3 | 157.7 | -111.9 | 176.2 | 179.8 | -172.3 | 0 | 112.4 | ||||
| 62 | T | 29.2 | Very low | 41.5 | Very low | 116 Ų | 116 | 141.2 Ų | 141.2 | 71% | 0.712 | 79% | 0.792 | S | S | * | * | trans | 63.9 | 102.1 | 139.2 | -171.1 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 63 | S | 39.2 | Very low | 41.8 | Very low | 113 Ų | 113 | 141.8 Ų | 141.8 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | 57.5 | 103.7 | 121 | -28.6 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 64 | S | 43 | Very low | 41.9 | Very low | 125 Ų | 125 | 140.5 Ų | 140.5 | 87% | 0.874 | 79% | 0.788 | S | S | * | * | trans | -147.4 | 128.7 | 130.3 | 69.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 65 | S | 38.9 | Very low | 42.5 | Very low | 130 Ų | 130 | 136.8 Ų | 136.8 | 91% | 0.909 | 79% | 0.791 | S | S | * | * | trans | -62.7 | 144.8 | -177.1 | 172.7 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 66 | G | 33.1 | Very low | 42.8 | Very low | 67 Ų | 67 | 133.7 Ų | 133.7 | 69% | 0.691 | 79% | 0.79 | S | S | * | * | trans | 157.7 | 115.6 | 158.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 67 | P | 50.9 | Low | 43.1 | Very low | 123 Ų | 123 | 131.9 Ų | 131.9 | 80% | 0.799 | 78% | 0.78 | S | S | * | * | trans | -98.1 | 123.8 | -170 | 35.4 | -26.9 | 0 | 0 | 0 | 112.3 | ||||
| 68 | E | 39.5 | Very low | 43.9 | Very low | 188 Ų | 188 | 127.2 Ų | 127.2 | 88% | 0.879 | 76% | 0.764 | S | S | * | * | trans | -132.9 | 106.6 | 163 | -74.2 | -81.5 | 142.5 | 0 | 0 | 107 | C70 | E68-C70 PolarHBondContact O-N 3.05Å; E68-C70 VanDerWaalsContact O-N 3.13Å | ||
| 69 | A | 49.6 | Very low | 45 | Very low | 100 Ų | 100 | 123.7 Ų | 123.7 | 83% | 0.826 | 75% | 0.748 | S | S | * | * | trans | -64.6 | 108 | 170.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 70 | C | 39.8 | Very low | 46.7 | Very low | 100 Ų | 100 | 122.2 Ų | 122.2 | 68% | 0.676 | 73% | 0.731 | S | S | * | * | trans | -108.7 | 91.4 | 155.6 | -154.9 | 0 | 0 | 0 | 0 | 106.9 | E68 N72 | E68-C70 PolarHBondContact O-N 3.05Å; E68-C70 VanDerWaalsContact O-N 3.13Å; C70-N72 PolarHBondContact O-N 3.07Å; C70-N72 PolarHBondContact SG-ND2 3.07Å | ||
| 71 | E | 47.1 | Very low | 47.6 | Very low | 163 Ų | 163 | 120.8 Ų | 120.8 | 76% | 0.762 | 71% | 0.713 | S | S | * | * | trans | -61.1 | 82.3 | 159.4 | -77.4 | -173.9 | 123.4 | 0 | 0 | 108.5 | ||||
| 72 | N | 48.4 | Very low | 49.1 | Very low | 134 Ų | 134 | 112.6 Ų | 112.6 | 72% | 0.717 | 68% | 0.682 | S | S | * | * | trans | -98.6 | 93.3 | 154.6 | -71.5 | -39.6 | 0 | 0 | 0 | 106.5 | C70 D74 | C70-N72 PolarHBondContact O-N 3.07Å; C70-N72 PolarHBondContact SG-ND2 3.07Å; N72-D74 PolarHBondContact O-N 3.5Å | ||
| 73 | K | 51.5 | Low | 51.1 | Low | 181 Ų | 181 | 111.8 Ų | 111.8 | 79% | 0.787 | 67% | 0.669 | S | S | * | * | trans | -59.2 | 84.9 | 162.2 | -66.9 | -176.7 | 178.3 | 177.5 | 0 | 108.1 | ||||
| 74 | D | 50.7 | Low | 52.5 | Low | 121 Ų | 121 | 106.8 Ų | 106.8 | 65% | 0.647 | 63% | 0.633 | S | S | * | * | trans | -115.4 | 58.3 | 159.4 | -165.8 | 28 | 0 | 0 | 0 | 109.8 | N72 G76 D77 | N72-D74 PolarHBondContact O-N 3.5Å; D74-G76 VanDerWaalsContact C-N 3.29Å; D74-D77 WeakPolarHBondContact OD1-CB 3.25Å; D74-D77 PolarHBondContact OD1-N 3.22Å | ||
| 75 | V | 46.3 | Very low | 53.8 | Low | 157 Ų | 157 | 105.7 Ų | 105.7 | 95% | 0.952 | 62% | 0.617 | S | S | * | * | S | Bend | trans | -107 | 27.8 | 159 | -161.7 | 0 | 0 | 0 | 0 | 107.8 | ||
| 76 | G | 45.4 | Very low | 55.2 | Low | 64 Ų | 64 | 106 Ų | 106 | 66% | 0.66 | 61% | 0.606 | S | S | * | * | trans | -122.2 | -16.8 | -169.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | D74 V78 | D74-G76 VanDerWaalsContact C-N 3.29Å; G76-V78 PolarHBondContact O-N 3.09Å | ||
| 77 | D | 48.7 | Very low | 56.7 | Low | 114 Ų | 114 | 108.1 Ų | 108.1 | 61% | 0.61 | 60% | 0.6 | S | S | * | * | trans | -99.9 | 65.7 | 179.4 | -144.7 | 76.2 | 0 | 0 | 0 | 111.5 | D74 T79 | D74-D77 WeakPolarHBondContact OD1-CB 3.25Å; D74-D77 PolarHBondContact OD1-N 3.22Å; D77-T79 VanDerWaalsContact C-N 3.26Å; D77-T79 PolarHBondContact O-N 3.37Å; D77-T79 VanDerWaalsContact O-N 3.08Å | ||
| 78 | V | 54.3 | Low | 57.3 | Low | 80 Ų | 80 | 107.8 Ų | 107.8 | 49% | 0.485 | 59% | 0.586 | S | S | . | * | trans | -62 | 107.3 | 141.8 | 164.2 | 0 | 0 | 0 | 0 | 103.6 | G76 Q80 A82 F83 M86 | G76-V78 PolarHBondContact O-N 3.09Å; V78-Q80 PolarHBondContact O-N 3.24Å; V78-A82 HydrophobicContact CG1-CB 3.75Å; V78-F83 HydrophobicContact CG1-CB 3.83Å; V78-M86 HydrophobicContact CG1-CE 4.41Å | ||
| 79 | T | 71.2 | Confident | 58.7 | Low | 73 Ų | 73 | 108.6 Ų | 108.6 | 45% | 0.448 | 59% | 0.59 | S | S | . | * | trans | -45.4 | 135.3 | 178.1 | 51.5 | 0 | 0 | 0 | 0 | 108.3 | D77 E81 A82 F83 | D77-T79 VanDerWaalsContact C-N 3.26Å; D77-T79 PolarHBondContact O-N 3.37Å; D77-T79 VanDerWaalsContact O-N 3.08Å; T79-E81 CarbonylContact O-C 3.53Å; T79-E81 PolarHBondContact O-N 3.49Å; T79-A82 WeakPolarHBondContact O-CA 3.28Å; T79-A82 WeakPolarHBondContact O-CB 3.23Å; T79-A82 PolarHBondContact O-N 3.37Å; T79-A82 WeakPolarHBondContact OG1-CB 3.15Å; T79-A82 PolarHBondContact OG1-N 3.21Å; T79-F83 PolarHBondContact O-N 2.88Å | ||
| 80 | Q | 70.3 | Confident | 59.9 | Low | 113 Ų | 113 | 109.5 Ų | 109.5 | 53% | 0.528 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -49.5 | -30.4 | -178.5 | -174.1 | 64.9 | 52.9 | 0 | 0 | 111.8 | V78 F83 D84 | V78-Q80 PolarHBondContact O-N 3.24Å; Q80-F83 PolarHBondContact O-N 2.72Å; Q80-D84 PolarHBondContact NE2-OD1 2.96Å; Q80-D84 WeakPolarHBondContact O-CB 3.29Å; Q80-D84 PolarHBondContact O-N 2.89Å |
| 81 | E | 63.8 | Low | 61.9 | Low | 77 Ų | 77 | 106.3 Ų | 106.3 | 36% | 0.36 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -60.6 | -45.8 | 171.5 | -169.8 | 156.4 | -153.9 | 0 | 0 | 113.2 | T79 L85 Y95 K102 | T79-E81 CarbonylContact O-C 3.53Å; T79-E81 PolarHBondContact O-N 3.49Å; E81-L85 HydrophobicContact CG-CD1 4.02Å; E81-L85 VanDerWaalsContact O-CB 3.26Å; E81-L85 WeakPolarHBondContact O-CB 3.26Å; E81-L85 WeakPolarHBondContact O-CD1 3.46Å; E81-L85 WeakPolarHBondContact O-CG 3.39Å; E81-L85 PolarHBondContact O-N 3.02Å; E81-Y95 HydrophobicContact CG-CE2 4.26Å; E81-K102 IonicContact OE1-NZ 3.58Å; E81-K102 PolarHBondContact OE1-NZ 3.08Å; E81-K102 IonicContact OE2-NZ 2.88Å; E81-K102 PolarHBondContact OE2-NZ 3.26Å; E81-K102 VanDerWaalsContact OE2-NZ 3.14Å |
| 82 | A | 71.3 | Confident | 63.8 | Low | 26 Ų | 26 | 100.3 Ų | 100.3 | 22% | 0.215 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -70.2 | -35.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V78 T79 L85 M86 | V78-A82 HydrophobicContact CG1-CB 3.75Å; T79-A82 WeakPolarHBondContact O-CA 3.28Å; T79-A82 WeakPolarHBondContact O-CB 3.23Å; T79-A82 PolarHBondContact O-N 3.37Å; T79-A82 WeakPolarHBondContact OG1-CB 3.15Å; T79-A82 PolarHBondContact OG1-N 3.21Å; A82-L85 PolarHBondContact O-N 3.11Å; A82-M86 HydrophobicContact CB-CE 3.82Å; A82-M86 VanDerWaalsContact O-CB 3.23Å; A82-M86 WeakPolarHBondContact O-CB 3.34Å; A82-M86 VanDerWaalsContact O-CG 3.28Å; A82-M86 WeakPolarHBondContact O-CG 3.38Å; A82-M86 PolarHBondContact O-N 2.93Å |
| 83 | F | 70.6 | Confident | 65.7 | Low | 98 Ų | 98 | 98.9 Ų | 98.9 | 43% | 0.43 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.1 | -47.8 | 175.2 | -171.3 | -86.5 | 0 | 0 | 0 | 111.2 | V78 T79 Q80 L85 I87 | V78-F83 HydrophobicContact CG1-CB 3.83Å; T79-F83 PolarHBondContact O-N 2.88Å; Q80-F83 PolarHBondContact O-N 2.72Å; F83-L85 VanDerWaalsContact C-N 3.32Å; F83-L85 PolarHBondContact O-N 3.21Å; F83-I87 HydrophobicContact CD2-CD1 3.56Å; F83-I87 HydrophobicContact CD2-CG1 4.46Å; F83-I87 HydrophobicContact CE2-CD1 3.62Å; F83-I87 HydrophobicContact CE2-CG2 4.5Å; F83-I87 HydrophobicContact CG-CD1 4.23Å; F83-I87 HydrophobicContact CZ-CD1 4.33Å; F83-I87 HydrophobicContact CZ-CG2 4.24Å; F83-I87 VanDerWaalsContact O-CB 3.28Å; F83-I87 WeakPolarHBondContact O-CB 3.4Å; F83-I87 PolarHBondContact O-N 3.37Å |
| 84 | D | 67.7 | Low | 67.5 | Low | 9 Ų | 9 | 95.6 Ų | 95.6 | 5% | 0.048 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -64.7 | -34.7 | 177.9 | -90.7 | 28.3 | 0 | 0 | 0 | 112.5 | Q80 S92 Y95 | Q80-D84 PolarHBondContact NE2-OD1 2.96Å; Q80-D84 WeakPolarHBondContact O-CB 3.29Å; Q80-D84 PolarHBondContact O-N 2.89Å; D84-S92 WeakPolarHBondContact OD2-CB 3.43Å; D84-S92 PolarHBondContact OD2-N 2.96Å; D84-Y95 HydrophobicContact CB-CD2 4.48Å; D84-Y95 WeakPolarHBondContact OD2-CB 3.24Å |
| 85 | L | 70.6 | Confident | 69.3 | Low | 101 Ų | 101 | 91.6 Ų | 91.6 | 53% | 0.529 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -80.9 | -32.5 | -180 | -74 | 169 | 0 | 0 | 0 | 114.1 | E81 A82 F83 Y95 | E81-L85 HydrophobicContact CG-CD1 4.02Å; E81-L85 VanDerWaalsContact O-CB 3.26Å; E81-L85 WeakPolarHBondContact O-CB 3.26Å; E81-L85 WeakPolarHBondContact O-CD1 3.46Å; E81-L85 WeakPolarHBondContact O-CG 3.39Å; E81-L85 PolarHBondContact O-N 3.02Å; A82-L85 PolarHBondContact O-N 3.11Å; F83-L85 VanDerWaalsContact C-N 3.32Å; F83-L85 PolarHBondContact O-N 3.21Å; L85-Y95 HydrophobicContact CD1-CE2 4.41Å; L85-Y95 HydrophobicContact CD2-CE2 4.24Å; L85-Y95 HydrophobicContact CG-CE2 4.2Å |
| 86 | M | 69.6 | Low | 71.4 | Confident | 138 Ų | 138 | 90.1 Ų | 90.1 | 68% | 0.68 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -98.6 | -18.8 | -174.3 | -62.5 | -169.6 | -63.9 | 0 | 0 | 114.1 | V78 A82 | V78-M86 HydrophobicContact CG1-CE 4.41Å; A82-M86 HydrophobicContact CB-CE 3.82Å; A82-M86 VanDerWaalsContact O-CB 3.23Å; A82-M86 WeakPolarHBondContact O-CB 3.34Å; A82-M86 VanDerWaalsContact O-CG 3.28Å; A82-M86 WeakPolarHBondContact O-CG 3.38Å; A82-M86 PolarHBondContact O-N 2.93Å |
| 87 | I | 63.4 | Low | 73.8 | Confident | 110 Ų | 110 | 94.7 Ų | 94.7 | 56% | 0.564 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -120.2 | -15.8 | -166.2 | -52 | -170 | 0 | 0 | 0 | 113.2 | F83 | F83-I87 HydrophobicContact CD2-CD1 3.56Å; F83-I87 HydrophobicContact CD2-CG1 4.46Å; F83-I87 HydrophobicContact CE2-CD1 3.62Å; F83-I87 HydrophobicContact CE2-CG2 4.5Å; F83-I87 HydrophobicContact CG-CD1 4.23Å; F83-I87 HydrophobicContact CZ-CD1 4.33Å; F83-I87 HydrophobicContact CZ-CG2 4.24Å; F83-I87 VanDerWaalsContact O-CB 3.28Å; F83-I87 WeakPolarHBondContact O-CB 3.4Å; F83-I87 PolarHBondContact O-N 3.37Å |
| 88 | K | 63.1 | Low | 76 | Confident | 117 Ų | 117 | 93 Ų | 93 | 51% | 0.509 | 47% | 0.466 | S | S | . | . | trans | -124.1 | 124.2 | -176 | -152.7 | 176.6 | 176.1 | -174.3 | 0 | 112.5 | N90 | K88-N90 VanDerWaalsContact CD-O 3.25Å; K88-N90 WeakPolarHBondContact CD-O 3.46Å; K88-N90 VanDerWaalsContact CG-O 3.29Å; K88-N90 WeakPolarHBondContact CG-O 2.97Å; K88-N90 PolarHBondContact O-N 3.2Å; K88-N90 VanDerWaalsContact O-N 3.09Å | ||
| 89 | E | 69.9 | Low | 77.9 | Confident | 204 Ų | 204 | 89.8 Ų | 89.8 | 95% | 0.953 | 45% | 0.447 | S | S | * | . | S | Bend | trans | -57 | -25.8 | 178.6 | -71.1 | -173.2 | 155.7 | 0 | 0 | 113.7 | ||
| 90 | N | 73.6 | Confident | 79.2 | Confident | 120 Ų | 120 | 89.1 Ų | 89.1 | 64% | 0.642 | 45% | 0.449 | S | S | * | . | S | Bend | trans | -129.1 | 121.5 | 170.6 | -108.7 | -68.3 | 0 | 0 | 0 | 109.7 | K88 | K88-N90 VanDerWaalsContact CD-O 3.25Å; K88-N90 WeakPolarHBondContact CD-O 3.46Å; K88-N90 VanDerWaalsContact CG-O 3.29Å; K88-N90 WeakPolarHBondContact CG-O 2.97Å; K88-N90 PolarHBondContact O-N 3.2Å; K88-N90 VanDerWaalsContact O-N 3.09Å |
| 91 | P | 82.1 | Confident | 80.5 | Confident | 32 Ų | 32 | 87.3 Ų | 87.3 | 21% | 0.208 | 44% | 0.44 | C | S | . | . | trans | -56.5 | 153.8 | 178.1 | -24 | 32.5 | 0 | 0 | 0 | 112.6 | Y95 W96 | P91-Y95 HydrophobicContact CB-CD1 3.34Å; P91-Y95 HydrophobicContact CB-CE1 3.95Å; P91-Y95 HydrophobicContact CB-CG 3.8Å; P91-Y95 HydrophobicContact CG-CD1 4.06Å; P91-Y95 HydrophobicContact CG-CE1 4.16Å; P91-W96 HydrophobicContact CG-CZ2 4.34Å | ||
| 92 | S | 86.5 | Confident | 82.1 | Confident | 37 Ų | 37 | 88.7 Ų | 88.7 | 26% | 0.259 | 45% | 0.445 | S | S | . | . | trans | -63.6 | 156.3 | 179.3 | -171.5 | 0 | 0 | 0 | 0 | 112.2 | D84 Q94 Y95 W96 | D84-S92 WeakPolarHBondContact OD2-CB 3.43Å; D84-S92 PolarHBondContact OD2-N 2.96Å; S92-Q94 PolarHBondContact O-N 3.34Å; S92-Q94 PolarHBondContact OG-N 2.88Å; S92-Y95 WeakPolarHBondContact O-CB 3.47Å; S92-Y95 PolarHBondContact O-N 2.87Å; S92-Y95 VanDerWaalsContact O-N 3.09Å; S92-W96 PolarHBondContact O-N 3.43Å | ||
| 93 | S | 89.7 | Confident | 83.4 | Confident | 104 Ų | 104 | 94.8 Ų | 94.8 | 73% | 0.727 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -55.5 | -34.7 | 169.8 | 178.8 | 0 | 0 | 0 | 0 | 111.5 | W96 K97 | S93-W96 PolarHBondContact O-N 3.2Å; S93-K97 WeakPolarHBondContact O-CB 3.39Å; S93-K97 PolarHBondContact O-N 2.89Å |
| 94 | Q | 88.9 | Confident | 84.7 | Confident | 112 Ų | 112 | 96.3 Ų | 96.3 | 52% | 0.523 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64 | -42.8 | 176.1 | -176.1 | 172.3 | -27.8 | 0 | 0 | 112.3 | S92 W96 K97 E98 | S92-Q94 PolarHBondContact O-N 3.34Å; S92-Q94 PolarHBondContact OG-N 2.88Å; Q94-W96 VanDerWaalsContact C-N 3.35Å; Q94-W96 PolarHBondContact O-N 3.14Å; Q94-K97 WeakPolarHBondContact O-CB 3.31Å; Q94-K97 PolarHBondContact O-N 3.38Å; Q94-E98 WeakPolarHBondContact CG-OE1 3.48Å; Q94-E98 PolarHBondContact NE2-OE1 2.87Å; Q94-E98 VanDerWaalsContact NE2-OE1 3.11Å; Q94-E98 WeakPolarHBondContact O-CG 3.5Å; Q94-E98 PolarHBondContact O-N 3.37Å |
| 95 | Y | 88.7 | Confident | 86.2 | Confident | 38 Ų | 38 | 101.3 Ų | 101.3 | 15% | 0.149 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -56.8 | -48.8 | 174.2 | 171.9 | -91.6 | 0 | 0 | 0 | 111.2 | E81 D84 L85 P91 S92 K97 E98 V99 | E81-Y95 HydrophobicContact CG-CE2 4.26Å; D84-Y95 HydrophobicContact CB-CD2 4.48Å; D84-Y95 WeakPolarHBondContact OD2-CB 3.24Å; L85-Y95 HydrophobicContact CD1-CE2 4.41Å; L85-Y95 HydrophobicContact CD2-CE2 4.24Å; L85-Y95 HydrophobicContact CG-CE2 4.2Å; P91-Y95 HydrophobicContact CB-CD1 3.34Å; P91-Y95 HydrophobicContact CB-CE1 3.95Å; P91-Y95 HydrophobicContact CB-CG 3.8Å; P91-Y95 HydrophobicContact CG-CD1 4.06Å; P91-Y95 HydrophobicContact CG-CE1 4.16Å; S92-Y95 WeakPolarHBondContact O-CB 3.47Å; S92-Y95 PolarHBondContact O-N 2.87Å; S92-Y95 VanDerWaalsContact O-N 3.09Å; Y95-K97 VanDerWaalsContact C-N 3.31Å; Y95-K97 PolarHBondContact O-N 3.48Å; Y95-E98 PolarHBondContact O-N 2.85Å; Y95-V99 HydrophobicContact CD1-CG2 4.12Å; Y95-V99 HydrophobicContact CD2-CG2 4.35Å; Y95-V99 HydrophobicContact CE1-CG2 3.71Å; Y95-V99 HydrophobicContact CE2-CG2 3.95Å; Y95-V99 HydrophobicContact CG-CG2 4.42Å; Y95-V99 WeakPolarHBondContact O-CB 3.45Å; Y95-V99 VanDerWaalsContact O-CG2 3.31Å; Y95-V99 WeakPolarHBondContact O-CG2 3.46Å; Y95-V99 PolarHBondContact O-N 2.84Å |
| 96 | W | 90.5 | Very high | 87.5 | Confident | 125 Ų | 125 | 99.1 Ų | 99.1 | 47% | 0.473 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.7 | -34.7 | 178.7 | -72.5 | 113.1 | 0 | 0 | 0 | 113.3 | P91 S92 S93 Q94 A100 | P91-W96 HydrophobicContact CG-CZ2 4.34Å; S92-W96 PolarHBondContact O-N 3.43Å; S93-W96 PolarHBondContact O-N 3.2Å; Q94-W96 VanDerWaalsContact C-N 3.35Å; Q94-W96 PolarHBondContact O-N 3.14Å; W96-A100 VanDerWaalsContact O-CB 3.24Å; W96-A100 WeakPolarHBondContact O-CB 3.4Å; W96-A100 PolarHBondContact O-N 3.14Å |
| 97 | K | 95.3 | Very high | 88.9 | Confident | 161 Ų | 161 | 97.5 Ų | 97.5 | 70% | 0.7 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -62 | -47.3 | 172.8 | -177.9 | -176.4 | 177.8 | -176.3 | 0 | 111.3 | S93 Q94 Y95 A100 E101 | S93-K97 WeakPolarHBondContact O-CB 3.39Å; S93-K97 PolarHBondContact O-N 2.89Å; Q94-K97 WeakPolarHBondContact O-CB 3.31Å; Q94-K97 PolarHBondContact O-N 3.38Å; Y95-K97 VanDerWaalsContact C-N 3.31Å; Y95-K97 PolarHBondContact O-N 3.48Å; K97-A100 PolarHBondContact O-N 2.86Å; K97-E101 PolarHBondContact O-N 3.46Å |
| 98 | E | 94.1 | Very high | 90.6 | Very high | 78 Ų | 78 | 99.1 Ų | 99.1 | 36% | 0.364 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -65 | -42.9 | 178.4 | -72 | 174 | -159.3 | 0 | 0 | 111.7 | Q94 Y95 E101 K102 | Q94-E98 WeakPolarHBondContact CG-OE1 3.48Å; Q94-E98 PolarHBondContact NE2-OE1 2.87Å; Q94-E98 VanDerWaalsContact NE2-OE1 3.11Å; Q94-E98 WeakPolarHBondContact O-CG 3.5Å; Q94-E98 PolarHBondContact O-N 3.37Å; Y95-E98 PolarHBondContact O-N 2.85Å; E98-E101 PolarHBondContact O-N 3.4Å; E98-K102 WeakPolarHBondContact O-CG 3.44Å; E98-K102 PolarHBondContact O-N 3.22Å |
| 99 | V | 95.5 | Very high | 92.3 | Very high | 13 Ų | 13 | 99.9 Ų | 99.9 | 8% | 0.079 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -64.2 | -41.3 | 176.2 | 173.8 | 0 | 0 | 0 | 0 | 111.5 | Y95 E101 K102 R103 | Y95-V99 HydrophobicContact CD1-CG2 4.12Å; Y95-V99 HydrophobicContact CD2-CG2 4.35Å; Y95-V99 HydrophobicContact CE1-CG2 3.71Å; Y95-V99 HydrophobicContact CE2-CG2 3.95Å; Y95-V99 HydrophobicContact CG-CG2 4.42Å; Y95-V99 WeakPolarHBondContact O-CB 3.45Å; Y95-V99 VanDerWaalsContact O-CG2 3.31Å; Y95-V99 WeakPolarHBondContact O-CG2 3.46Å; Y95-V99 PolarHBondContact O-N 2.84Å; V99-E101 VanDerWaalsContact C-N 3.3Å; V99-E101 PolarHBondContact O-N 3.27Å; V99-K102 PolarHBondContact O-N 3.04Å; V99-R103 HydrophobicContact CG1-CG 4.47Å; V99-R103 WeakPolarHBondContact O-CB 3.39Å; V99-R103 WeakPolarHBondContact O-CG 3.4Å; V99-R103 PolarHBondContact O-N 2.98Å |
| 100 | A | 97.4 | Very high | 93.7 | Very high | 58 Ų | 58 | 92.1 Ų | 92.1 | 48% | 0.479 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61.1 | -41.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | W96 K97 R103 R104 | W96-A100 VanDerWaalsContact O-CB 3.24Å; W96-A100 WeakPolarHBondContact O-CB 3.4Å; W96-A100 PolarHBondContact O-N 3.14Å; K97-A100 PolarHBondContact O-N 2.86Å; A100-R103 PolarHBondContact O-N 3.44Å; A100-R104 WeakPolarHBondContact O-CB 3.35Å; A100-R104 PolarHBondContact O-N 3.16Å |
| 101 | E | 97.9 | Very high | 94.9 | Very high | 76 Ų | 76 | 91.2 Ų | 91.2 | 36% | 0.355 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -68.5 | -41.1 | 177 | -176.8 | 58.7 | -164.1 | 0 | 0 | 112.4 | K97 E98 V99 R103 R104 K105 | K97-E101 PolarHBondContact O-N 3.46Å; E98-E101 PolarHBondContact O-N 3.4Å; V99-E101 VanDerWaalsContact C-N 3.3Å; V99-E101 PolarHBondContact O-N 3.27Å; E101-R103 VanDerWaalsContact C-N 3.35Å; E101-R103 PolarHBondContact O-N 3.34Å; E101-R104 PolarHBondContact O-N 3.13Å; E101-R104 IonicContact OE1-CZ 3.14Å; E101-R104 IonicContact OE1-NE 2.67Å; E101-R104 PolarHBondContact OE1-NE 3.05Å; E101-R104 IonicContact OE1-NH2 3.39Å; E101-R104 PolarHBondContact OE1-NH2 3.34Å; E101-R104 IonicContact OE2-CZ 3.02Å; E101-R104 IonicContact OE2-NE 3.76Å; E101-R104 PolarHBondContact OE2-NE 3.3Å; E101-R104 IonicContact OE2-NH2 3.73Å; E101-K105 WeakPolarHBondContact O-CG 3.36Å; E101-K105 PolarHBondContact O-N 3.23Å; E101-K105 VanDerWaalsContact OE1-CE 3.3Å; E101-K105 WeakPolarHBondContact OE1-CE 3.5Å |
| 102 | K | 97.8 | Very high | 95.7 | Very high | 105 Ų | 105 | 96 Ų | 96 | 46% | 0.457 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -57.6 | -47.2 | 171.7 | -74.3 | 176.3 | -178.1 | 173.7 | 0 | 110.5 | E81 E98 V99 R104 K105 A106 | E81-K102 IonicContact OE1-NZ 3.58Å; E81-K102 PolarHBondContact OE1-NZ 3.08Å; E81-K102 IonicContact OE2-NZ 2.88Å; E81-K102 PolarHBondContact OE2-NZ 3.26Å; E81-K102 VanDerWaalsContact OE2-NZ 3.14Å; E98-K102 WeakPolarHBondContact O-CG 3.44Å; E98-K102 PolarHBondContact O-N 3.22Å; V99-K102 PolarHBondContact O-N 3.04Å; K102-R104 PolarHBondContact O-N 2.94Å; K102-K105 PolarHBondContact O-N 3.41Å; K102-A106 WeakPolarHBondContact O-CB 3.3Å; K102-A106 PolarHBondContact O-N 3.5Å |
| 103 | R | 98.4 | Very high | 96.2 | Very high | 154 Ų | 154 | 99.9 Ų | 99.9 | 58% | 0.581 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -64.4 | -39 | 177.6 | -74.3 | -179.5 | -178.2 | 130.4 | 6.8 | 112.7 | V99 A100 E101 K105 A106 L107 | V99-R103 HydrophobicContact CG1-CG 4.47Å; V99-R103 WeakPolarHBondContact O-CB 3.39Å; V99-R103 WeakPolarHBondContact O-CG 3.4Å; V99-R103 PolarHBondContact O-N 2.98Å; A100-R103 PolarHBondContact O-N 3.44Å; E101-R103 VanDerWaalsContact C-N 3.35Å; E101-R103 PolarHBondContact O-N 3.34Å; R103-K105 VanDerWaalsContact C-N 3.35Å; R103-K105 PolarHBondContact O-N 2.86Å; R103-A106 PolarHBondContact O-N 3.1Å; R103-L107 VanDerWaalsContact O-CB 3.28Å; R103-L107 WeakPolarHBondContact O-CB 3.28Å; R103-L107 PolarHBondContact O-N 3.31Å |
| 104 | R | 98.6 | Very high | 96.7 | Very high | 131 Ų | 131 | 98.8 Ų | 98.8 | 49% | 0.494 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -60.7 | -44 | 176.1 | -171.2 | -163.5 | 65.8 | 71.2 | -1.2 | 111.3 | A100 E101 K102 Y108 | A100-R104 WeakPolarHBondContact O-CB 3.35Å; A100-R104 PolarHBondContact O-N 3.16Å; E101-R104 PolarHBondContact O-N 3.13Å; E101-R104 IonicContact OE1-CZ 3.14Å; E101-R104 IonicContact OE1-NE 2.67Å; E101-R104 PolarHBondContact OE1-NE 3.05Å; E101-R104 IonicContact OE1-NH2 3.39Å; E101-R104 PolarHBondContact OE1-NH2 3.34Å; E101-R104 IonicContact OE2-CZ 3.02Å; E101-R104 IonicContact OE2-NE 3.76Å; E101-R104 PolarHBondContact OE2-NE 3.3Å; E101-R104 IonicContact OE2-NH2 3.73Å; K102-R104 PolarHBondContact O-N 2.94Å; R104-Y108 PolarHBondContact O-N 3.5Å; R104-Y108 VanDerWaalsContact O-N 3.1Å |
| 105 | K | 98.6 | Very high | 97.1 | Very high | 113 Ų | 113 | 98.6 Ų | 98.6 | 49% | 0.491 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -66 | -48.2 | 176.6 | -69.7 | 176.9 | -177.7 | 178.6 | 0 | 111.9 | E101 K102 R103 L107 Y108 E109 | E101-K105 WeakPolarHBondContact O-CG 3.36Å; E101-K105 PolarHBondContact O-N 3.23Å; E101-K105 VanDerWaalsContact OE1-CE 3.3Å; E101-K105 WeakPolarHBondContact OE1-CE 3.5Å; K102-K105 PolarHBondContact O-N 3.41Å; R103-K105 VanDerWaalsContact C-N 3.35Å; R103-K105 PolarHBondContact O-N 2.86Å; K105-L107 VanDerWaalsContact C-N 3.27Å; K105-L107 PolarHBondContact O-N 3.29Å; K105-Y108 WeakPolarHBondContact O-CB 3.27Å; K105-Y108 PolarHBondContact O-N 2.86Å; K105-Y108 VanDerWaalsContact O-N 3.09Å; K105-E109 PolarHBondContact O-N 3.42Å |
| 106 | A | 98.6 | Very high | 97.6 | Very high | 55 Ų | 55 | 103.3 Ų | 103.3 | 46% | 0.455 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.1 | -39.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | K102 R103 E109 A110 | K102-A106 WeakPolarHBondContact O-CB 3.3Å; K102-A106 PolarHBondContact O-N 3.5Å; R103-A106 PolarHBondContact O-N 3.1Å; A106-E109 PolarHBondContact O-N 2.67Å; A106-A110 WeakPolarHBondContact O-CB 3.46Å; A106-A110 PolarHBondContact O-N 2.84Å |
| 107 | L | 98.8 | Very high | 98 | Very high | 104 Ų | 104 | 100.5 Ų | 100.5 | 55% | 0.545 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 174.9 | 178.3 | 62.6 | 0 | 0 | 0 | 111.7 | R103 K105 A110 L111 | R103-L107 VanDerWaalsContact O-CB 3.28Å; R103-L107 WeakPolarHBondContact O-CB 3.28Å; R103-L107 PolarHBondContact O-N 3.31Å; K105-L107 VanDerWaalsContact C-N 3.27Å; K105-L107 PolarHBondContact O-N 3.29Å; L107-A110 PolarHBondContact O-N 3.39Å; L107-L111 HydrophobicContact CD1-CD1 4.21Å; L107-L111 HydrophobicContact CD1-CG 4.16Å; L107-L111 HydrophobicContact CG-CD1 4.07Å; L107-L111 HydrophobicContact CG-CG 4.43Å; L107-L111 WeakPolarHBondContact O-CB 3.38Å; L107-L111 VanDerWaalsContact O-CG 3.27Å; L107-L111 WeakPolarHBondContact O-CG 3.45Å; L107-L111 PolarHBondContact O-N 3.01Å |
| 108 | Y | 98.7 | Very high | 98.2 | Very high | 144 Ų | 144 | 99.2 Ų | 99.2 | 57% | 0.565 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -61 | -45.4 | 177 | 172.6 | -97.5 | 0 | 0 | 0 | 112 | R104 K105 L111 K112 | R104-Y108 PolarHBondContact O-N 3.5Å; R104-Y108 VanDerWaalsContact O-N 3.1Å; K105-Y108 WeakPolarHBondContact O-CB 3.27Å; K105-Y108 PolarHBondContact O-N 2.86Å; K105-Y108 VanDerWaalsContact O-N 3.09Å; Y108-L111 PolarHBondContact O-N 2.99Å; Y108-K112 WeakPolarHBondContact O-CB 3.45Å; Y108-K112 PolarHBondContact O-N 3.45Å |
| 109 | E | 98.7 | Very high | 98.4 | Very high | 133 Ų | 133 | 101.2 Ų | 101.2 | 62% | 0.621 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.8 | -45.7 | 176.9 | -69.8 | 178.1 | 175.4 | 0 | 0 | 111.6 | K105 A106 L111 K112 E113 | K105-E109 PolarHBondContact O-N 3.42Å; A106-E109 PolarHBondContact O-N 2.67Å; E109-L111 VanDerWaalsContact C-N 3.35Å; E109-L111 PolarHBondContact O-N 3.09Å; E109-K112 PolarHBondContact O-N 3.35Å; E109-E113 WeakPolarHBondContact O-CB 3.44Å; E109-E113 PolarHBondContact O-N 2.91Å |
| 110 | A | 98.8 | Very high | 98.6 | Very high | 42 Ų | 42 | 103.8 Ų | 103.8 | 35% | 0.347 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.1 | -39.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | A106 L107 E113 N114 | A106-A110 WeakPolarHBondContact O-CB 3.46Å; A106-A110 PolarHBondContact O-N 2.84Å; L107-A110 PolarHBondContact O-N 3.39Å; A110-E113 PolarHBondContact O-N 3.25Å; A110-N114 WeakPolarHBondContact O-CB 3.23Å; A110-N114 VanDerWaalsContact O-CG 3.27Å; A110-N114 PolarHBondContact O-N 2.89Å |
| 111 | L | 98.8 | Very high | 98.6 | Very high | 101 Ų | 101 | 105.2 Ų | 105.2 | 53% | 0.529 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.6 | -41.4 | 176.3 | -73.4 | 173.9 | 0 | 0 | 0 | 111.9 | L107 Y108 E109 E113 N114 E115 | L107-L111 HydrophobicContact CD1-CD1 4.21Å; L107-L111 HydrophobicContact CD1-CG 4.16Å; L107-L111 HydrophobicContact CG-CD1 4.07Å; L107-L111 HydrophobicContact CG-CG 4.43Å; L107-L111 WeakPolarHBondContact O-CB 3.38Å; L107-L111 VanDerWaalsContact O-CG 3.27Å; L107-L111 WeakPolarHBondContact O-CG 3.45Å; L107-L111 PolarHBondContact O-N 3.01Å; Y108-L111 PolarHBondContact O-N 2.99Å; E109-L111 VanDerWaalsContact C-N 3.35Å; E109-L111 PolarHBondContact O-N 3.09Å; L111-E113 VanDerWaalsContact C-N 3.35Å; L111-N114 PolarHBondContact O-N 3.47Å; L111-E115 PolarHBondContact O-N 2.87Å |
| 112 | K | 98.8 | Very high | 98.7 | Very high | 132 Ų | 132 | 107.9 Ų | 107.9 | 57% | 0.574 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.4 | -41.8 | 175.6 | -175.5 | 179.9 | 179.6 | -179.5 | 0 | 111.6 | Y108 E109 K116 | Y108-K112 WeakPolarHBondContact O-CB 3.45Å; Y108-K112 PolarHBondContact O-N 3.45Å; E109-K112 PolarHBondContact O-N 3.35Å; K112-K116 PolarHBondContact O-N 3.24Å; K112-K116 VanDerWaalsContact O-N 3.14Å |
| 113 | E | 98.7 | Very high | 98.7 | Very high | 118 Ų | 118 | 109.7 Ų | 109.7 | 55% | 0.551 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.2 | -44.3 | 174.8 | -174.7 | 175.6 | -174 | 0 | 0 | 111.5 | E109 A110 L111 E115 K116 L117 | E109-E113 WeakPolarHBondContact O-CB 3.44Å; E109-E113 PolarHBondContact O-N 2.91Å; A110-E113 PolarHBondContact O-N 3.25Å; L111-E113 VanDerWaalsContact C-N 3.35Å; E113-E115 VanDerWaalsContact C-N 3.33Å; E113-E115 PolarHBondContact O-N 3.27Å; E113-K116 WeakPolarHBondContact O-CB 3.5Å; E113-K116 PolarHBondContact O-N 2.83Å; E113-K116 VanDerWaalsContact O-N 3.12Å; E113-L117 HydrophobicContact CG-CD1 4.08Å; E113-L117 HydrophobicContact CG-CG 4.3Å; E113-L117 WeakPolarHBondContact O-CG 3.45Å; E113-L117 PolarHBondContact O-N 3.35Å |
| 114 | N | 98.7 | Very high | 98.7 | Very high | 82 Ų | 82 | 107.9 Ų | 107.9 | 44% | 0.439 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58.4 | -43.9 | 175.9 | -79.6 | -15.6 | 0 | 0 | 0 | 112.1 | A110 L111 K116 L117 H118 | A110-N114 WeakPolarHBondContact O-CB 3.23Å; A110-N114 VanDerWaalsContact O-CG 3.27Å; A110-N114 PolarHBondContact O-N 2.89Å; L111-N114 PolarHBondContact O-N 3.47Å; N114-K116 VanDerWaalsContact C-N 3.31Å; N114-K116 PolarHBondContact O-N 3.12Å; N114-L117 PolarHBondContact O-N 3.39Å; N114-H118 PolarHBondContact O-CD2 3.39Å; N114-H118 PolarHBondContact O-N 2.98Å |
| 115 | E | 98.7 | Very high | 98.7 | Very high | 107 Ų | 107 | 106 Ų | 106 | 50% | 0.5 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.8 | -43.3 | 175.8 | -168.5 | -164.5 | 147.2 | 0 | 0 | 111.5 | L111 E113 H118 K119 | L111-E115 PolarHBondContact O-N 2.87Å; E113-E115 VanDerWaalsContact C-N 3.33Å; E113-E115 PolarHBondContact O-N 3.27Å; E115-H118 PolarHBondContact O-N 2.65Å; E115-K119 PolarHBondContact O-N 2.97Å; E115-K119 WeakPolarHBondContact OE1-CE 3.35Å; E115-K119 IonicContact OE1-NZ 3.31Å; E115-K119 PolarHBondContact OE1-NZ 2.99Å |
| 116 | K | 98.8 | Very high | 98.7 | Very high | 137 Ų | 137 | 104.3 Ų | 104.3 | 60% | 0.596 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.8 | -47.2 | 174.8 | -180 | -166.8 | 169.6 | -166 | 0 | 111.3 | K112 E113 N114 H118 K119 E120 | K112-K116 PolarHBondContact O-N 3.24Å; K112-K116 VanDerWaalsContact O-N 3.14Å; E113-K116 WeakPolarHBondContact O-CB 3.5Å; E113-K116 PolarHBondContact O-N 2.83Å; E113-K116 VanDerWaalsContact O-N 3.12Å; N114-K116 VanDerWaalsContact C-N 3.31Å; N114-K116 PolarHBondContact O-N 3.12Å; K116-H118 VanDerWaalsContact C-N 3.31Å; K116-H118 PolarHBondContact O-N 3.14Å; K116-K119 PolarHBondContact O-N 3.43Å; K116-E120 PolarHBondContact O-N 3.22Å |
| 117 | L | 98.8 | Very high | 98.8 | Very high | 67 Ų | 67 | 105.5 Ų | 105.5 | 35% | 0.351 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.7 | -38.1 | -179.6 | -71.1 | 173.9 | 0 | 0 | 0 | 111.7 | E113 N114 K119 E120 I121 | E113-L117 HydrophobicContact CG-CD1 4.08Å; E113-L117 HydrophobicContact CG-CG 4.3Å; E113-L117 WeakPolarHBondContact O-CG 3.45Å; E113-L117 PolarHBondContact O-N 3.35Å; N114-L117 PolarHBondContact O-N 3.39Å; L117-K119 PolarHBondContact O-N 3.09Å; L117-E120 PolarHBondContact O-N 2.89Å; L117-I121 WeakPolarHBondContact O-CB 3.37Å; L117-I121 VanDerWaalsContact O-CG1 3.23Å; L117-I121 WeakPolarHBondContact O-CG1 3.47Å; L117-I121 PolarHBondContact O-N 3.41Å |
| 118 | H | 98.8 | Very high | 98.8 | Very high | 134 Ų | 134 | 104.4 Ų | 104.4 | 62% | 0.62 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60 | -44.2 | 174.5 | -80.1 | -59.6 | 0 | 0 | 0 | 112.4 | N114 E115 K116 I121 E122 | N114-H118 PolarHBondContact O-CD2 3.39Å; N114-H118 PolarHBondContact O-N 2.98Å; E115-H118 PolarHBondContact O-N 2.65Å; K116-H118 VanDerWaalsContact C-N 3.31Å; K116-H118 PolarHBondContact O-N 3.14Å; H118-I121 PolarHBondContact O-N 2.82Å; H118-E122 PolarHBondContact O-N 3.02Å |
| 119 | K | 98.8 | Very high | 98.8 | Very high | 120 Ų | 120 | 100.3 Ų | 100.3 | 52% | 0.522 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.3 | -40.8 | 175.9 | -66.1 | 174.1 | -172.6 | 170.3 | 0 | 111.9 | E115 K116 L117 E122 Q123 | E115-K119 PolarHBondContact O-N 2.97Å; E115-K119 WeakPolarHBondContact OE1-CE 3.35Å; E115-K119 IonicContact OE1-NZ 3.31Å; E115-K119 PolarHBondContact OE1-NZ 2.99Å; K116-K119 PolarHBondContact O-N 3.43Å; L117-K119 PolarHBondContact O-N 3.09Å; K119-E122 PolarHBondContact O-N 3.36Å; K119-Q123 PolarHBondContact O-N 3.48Å |
| 120 | E | 98.8 | Very high | 98.8 | Very high | 66 Ų | 66 | 99.7 Ų | 99.7 | 31% | 0.308 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.7 | -39.8 | 178 | -170.6 | -178.2 | 150.4 | 0 | 0 | 112.1 | K116 L117 Q123 K124 | K116-E120 PolarHBondContact O-N 3.22Å; L117-E120 PolarHBondContact O-N 2.89Å; E120-Q123 PolarHBondContact O-N 3.43Å; E120-K124 HydrophobicContact CG-CD 4.29Å; E120-K124 WeakPolarHBondContact O-CB 3.23Å; E120-K124 WeakPolarHBondContact O-CG 3.42Å; E120-K124 PolarHBondContact O-N 3.48Å; E120-K124 WeakPolarHBondContact OE1-CE 3.37Å; E120-K124 IonicContact OE1-NZ 2.84Å; E120-K124 PolarHBondContact OE1-NZ 3.43Å |
| 121 | I | 98.8 | Very high | 98.8 | Very high | 88 Ų | 88 | 101 Ų | 101 | 45% | 0.451 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.1 | -48.9 | 174.7 | -71.4 | 164.8 | 0 | 0 | 0 | 109.9 | L117 H118 Q123 K124 D125 | L117-I121 WeakPolarHBondContact O-CB 3.37Å; L117-I121 VanDerWaalsContact O-CG1 3.23Å; L117-I121 WeakPolarHBondContact O-CG1 3.47Å; L117-I121 PolarHBondContact O-N 3.41Å; H118-I121 PolarHBondContact O-N 2.82Å; I121-Q123 VanDerWaalsContact C-N 3.32Å; I121-Q123 PolarHBondContact O-N 3.4Å; I121-K124 PolarHBondContact O-N 3.01Å; I121-K124 VanDerWaalsContact O-N 3.14Å; I121-D125 WeakPolarHBondContact CG2-OD2 3.44Å; I121-D125 WeakPolarHBondContact O-CB 3.46Å; I121-D125 PolarHBondContact O-N 3.46Å |
| 122 | E | 98.8 | Very high | 98.8 | Very high | 133 Ų | 133 | 103.2 Ų | 103.2 | 62% | 0.621 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -58.7 | -42.8 | 178.8 | -178.8 | 175.1 | -132.2 | 0 | 0 | 112.4 | H118 K119 D125 S126 | H118-E122 PolarHBondContact O-N 3.02Å; K119-E122 PolarHBondContact O-N 3.36Å; E122-D125 PolarHBondContact O-N 2.89Å; E122-S126 WeakPolarHBondContact O-CB 3.38Å; E122-S126 PolarHBondContact O-N 2.9Å; E122-S126 PolarHBondContact O-OG 2.85Å |
| 123 | Q | 98.8 | Very high | 98.8 | Very high | 143 Ų | 143 | 103.4 Ų | 103.4 | 67% | 0.668 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.3 | -46.1 | 175.2 | -175.5 | -177.1 | 0.4 | 0 | 0 | 111.6 | K119 E120 I121 S126 E127 | K119-Q123 PolarHBondContact O-N 3.48Å; E120-Q123 PolarHBondContact O-N 3.43Å; I121-Q123 VanDerWaalsContact C-N 3.32Å; I121-Q123 PolarHBondContact O-N 3.4Å; Q123-S126 WeakPolarHBondContact O-CB 3.46Å; Q123-S126 PolarHBondContact O-N 3.27Å; Q123-E127 PolarHBondContact O-N 3.39Å; Q123-E127 VanDerWaalsContact O-N 3.07Å |
| 124 | K | 98.8 | Very high | 98.8 | Very high | 115 Ų | 115 | 101.8 Ų | 101.8 | 50% | 0.5 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.9 | -39.4 | 179.4 | -78.3 | 175.8 | 170.7 | 167.6 | 0 | 112.2 | E120 I121 S126 E127 I128 | E120-K124 HydrophobicContact CG-CD 4.29Å; E120-K124 WeakPolarHBondContact O-CB 3.23Å; E120-K124 WeakPolarHBondContact O-CG 3.42Å; E120-K124 PolarHBondContact O-N 3.48Å; E120-K124 WeakPolarHBondContact OE1-CE 3.37Å; E120-K124 IonicContact OE1-NZ 2.84Å; E120-K124 PolarHBondContact OE1-NZ 3.43Å; I121-K124 PolarHBondContact O-N 3.01Å; I121-K124 VanDerWaalsContact O-N 3.14Å; K124-S126 VanDerWaalsContact C-N 3.32Å; K124-S126 PolarHBondContact O-N 3.26Å; K124-E127 PolarHBondContact O-N 2.7Å; K124-I128 WeakPolarHBondContact O-CB 3.28Å; K124-I128 VanDerWaalsContact O-CG1 3.23Å; K124-I128 WeakPolarHBondContact O-CG1 3.29Å; K124-I128 PolarHBondContact O-N 3.08Å |
| 125 | D | 98.8 | Very high | 98.7 | Very high | 93 Ų | 93 | 102.8 Ų | 102.8 | 50% | 0.497 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.8 | -39.2 | 177.3 | -76 | -23.8 | 0 | 0 | 0 | 111.5 | I121 E122 I128 A129 | I121-D125 WeakPolarHBondContact CG2-OD2 3.44Å; I121-D125 WeakPolarHBondContact O-CB 3.46Å; I121-D125 PolarHBondContact O-N 3.46Å; E122-D125 PolarHBondContact O-N 2.89Å; D125-I128 PolarHBondContact O-N 3.33Å; D125-A129 WeakPolarHBondContact O-CB 3.44Å; D125-A129 PolarHBondContact O-N 2.92Å |
| 126 | S | 98.6 | Very high | 98.7 | Very high | 77 Ų | 77 | 104.1 Ų | 104.1 | 54% | 0.538 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 174 | -58.7 | 0 | 0 | 0 | 0 | 111.7 | E122 Q123 K124 A129 R130 | E122-S126 WeakPolarHBondContact O-CB 3.38Å; E122-S126 PolarHBondContact O-N 2.9Å; E122-S126 PolarHBondContact O-OG 2.85Å; Q123-S126 WeakPolarHBondContact O-CB 3.46Å; Q123-S126 PolarHBondContact O-N 3.27Å; K124-S126 VanDerWaalsContact C-N 3.32Å; K124-S126 PolarHBondContact O-N 3.26Å; S126-A129 PolarHBondContact O-N 3.07Å; S126-R130 PolarHBondContact O-N 3.43Å |
| 127 | E | 98.8 | Very high | 98.7 | Very high | 80 Ų | 80 | 102 Ų | 102 | 37% | 0.374 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.2 | -40.8 | 177.3 | 179.9 | 60.9 | -174.5 | 0 | 0 | 112.2 | Q123 K124 A129 R130 L131 | Q123-E127 PolarHBondContact O-N 3.39Å; Q123-E127 VanDerWaalsContact O-N 3.07Å; K124-E127 PolarHBondContact O-N 2.7Å; E127-A129 VanDerWaalsContact C-N 3.31Å; E127-A129 PolarHBondContact O-N 3.29Å; E127-R130 PolarHBondContact O-N 3.49Å; E127-R130 IonicContact OE1-CZ 3.95Å; E127-R130 IonicContact OE1-NE 2.69Å; E127-R130 IonicContact OE1-NH2 3.54Å; E127-R130 PolarHBondContact OE1-NH2 3.06Å; E127-R130 IonicContact OE2-CZ 3.88Å; E127-R130 IonicContact OE2-NE 3.5Å; E127-R130 PolarHBondContact OE2-NE 3.38Å; E127-R130 IonicContact OE2-NH2 3.61Å; E127-L131 HydrophobicContact CG-CD1 4.04Å; E127-L131 WeakPolarHBondContact O-CB 3.42Å; E127-L131 WeakPolarHBondContact O-CG 3.46Å; E127-L131 PolarHBondContact O-N 3.14Å |
| 128 | I | 98.8 | Very high | 98.7 | Very high | 80 Ų | 80 | 103.7 Ų | 103.7 | 41% | 0.41 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.9 | -43.3 | 173.8 | -72.1 | 165.2 | 0 | 0 | 0 | 110.5 | K124 D125 K132 | K124-I128 WeakPolarHBondContact O-CB 3.28Å; K124-I128 VanDerWaalsContact O-CG1 3.23Å; K124-I128 WeakPolarHBondContact O-CG1 3.29Å; K124-I128 PolarHBondContact O-N 3.08Å; D125-I128 PolarHBondContact O-N 3.33Å; I128-K132 HydrophobicContact CG2-CD 3.94Å; I128-K132 HydrophobicContact CG2-CG 4.33Å; I128-K132 VanDerWaalsContact O-CB 3.29Å; I128-K132 WeakPolarHBondContact O-CB 3.49Å; I128-K132 VanDerWaalsContact O-CG 3.28Å; I128-K132 WeakPolarHBondContact O-CG 3.49Å; I128-K132 PolarHBondContact O-N 3.4Å |
| 129 | A | 98.8 | Very high | 98.7 | Very high | 59 Ų | 59 | 100.1 Ų | 100.1 | 49% | 0.488 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.7 | -44 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | D125 S126 E127 K132 K133 | D125-A129 WeakPolarHBondContact O-CB 3.44Å; D125-A129 PolarHBondContact O-N 2.92Å; S126-A129 PolarHBondContact O-N 3.07Å; E127-A129 VanDerWaalsContact C-N 3.31Å; E127-A129 PolarHBondContact O-N 3.29Å; A129-K132 PolarHBondContact O-N 3.31Å; A129-K133 PolarHBondContact O-N 3.01Å; A129-K133 VanDerWaalsContact O-N 3.08Å |
| 130 | R | 98.8 | Very high | 98.7 | Very high | 119 Ų | 119 | 99.3 Ų | 99.3 | 45% | 0.449 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.3 | -52.8 | 176 | -170 | -168.5 | 69.3 | 71.9 | -1.7 | 111.6 | S126 E127 K132 K133 E134 | S126-R130 PolarHBondContact O-N 3.43Å; E127-R130 PolarHBondContact O-N 3.49Å; E127-R130 IonicContact OE1-CZ 3.95Å; E127-R130 IonicContact OE1-NE 2.69Å; E127-R130 IonicContact OE1-NH2 3.54Å; E127-R130 PolarHBondContact OE1-NH2 3.06Å; E127-R130 IonicContact OE2-CZ 3.88Å; E127-R130 IonicContact OE2-NE 3.5Å; E127-R130 PolarHBondContact OE2-NE 3.38Å; E127-R130 IonicContact OE2-NH2 3.61Å; R130-K132 VanDerWaalsContact C-N 3.34Å; R130-K132 PolarHBondContact O-N 2.96Å; R130-K133 WeakPolarHBondContact O-CB 3.49Å; R130-K133 PolarHBondContact O-N 2.99Å; R130-E134 IonicContact CZ-OE2 2.7Å; R130-E134 IonicContact NH1-OE2 3.87Å; R130-E134 PolarHBondContact NH1-OE2 3.45Å; R130-E134 PolarHBondContact O-N 3.45Å |
| 131 | L | 98.8 | Very high | 98.7 | Very high | 69 Ų | 69 | 100.4 Ų | 100.4 | 36% | 0.361 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.9 | -36 | -179.4 | -72.9 | 172.8 | 0 | 0 | 0 | 112.7 | E127 K133 E134 N135 | E127-L131 HydrophobicContact CG-CD1 4.04Å; E127-L131 WeakPolarHBondContact O-CB 3.42Å; E127-L131 WeakPolarHBondContact O-CG 3.46Å; E127-L131 PolarHBondContact O-N 3.14Å; L131-K133 VanDerWaalsContact C-N 3.34Å; L131-E134 PolarHBondContact O-N 2.85Å; L131-N135 WeakPolarHBondContact O-CB 3.45Å; L131-N135 PolarHBondContact O-N 2.91Å; L131-N135 PolarHBondContact O-ND2 3.31Å |
| 132 | K | 98.8 | Very high | 98.7 | Very high | 148 Ų | 148 | 99 Ų | 99 | 64% | 0.643 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.4 | -39.3 | 174.6 | -81.7 | -179.5 | 176.2 | 177.2 | 0 | 112.1 | I128 A129 R130 K136 | I128-K132 HydrophobicContact CG2-CD 3.94Å; I128-K132 HydrophobicContact CG2-CG 4.33Å; I128-K132 VanDerWaalsContact O-CB 3.29Å; I128-K132 WeakPolarHBondContact O-CB 3.49Å; I128-K132 VanDerWaalsContact O-CG 3.28Å; I128-K132 WeakPolarHBondContact O-CG 3.49Å; I128-K132 PolarHBondContact O-N 3.4Å; A129-K132 PolarHBondContact O-N 3.31Å; R130-K132 VanDerWaalsContact C-N 3.34Å; R130-K132 PolarHBondContact O-N 2.96Å; K132-K136 WeakPolarHBondContact O-CB 3.42Å; K132-K136 PolarHBondContact O-N 3.46Å; K132-K136 VanDerWaalsContact O-N 3.08Å |
| 133 | K | 98.7 | Very high | 98.7 | Very high | 137 Ų | 137 | 99.4 Ų | 99.4 | 60% | 0.596 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.4 | -50.3 | 175.2 | 178.4 | -179.4 | 168.7 | -177.5 | 0 | 110.6 | A129 R130 L131 N135 K136 E137 | A129-K133 PolarHBondContact O-N 3.01Å; A129-K133 VanDerWaalsContact O-N 3.08Å; R130-K133 WeakPolarHBondContact O-CB 3.49Å; R130-K133 PolarHBondContact O-N 2.99Å; L131-K133 VanDerWaalsContact C-N 3.34Å; K133-N135 PolarHBondContact O-N 3.21Å; K133-K136 WeakPolarHBondContact O-CB 3.44Å; K133-K136 PolarHBondContact O-N 2.69Å; K133-K136 VanDerWaalsContact O-N 3.11Å; K133-E137 WeakPolarHBondContact CE-OE1 3.34Å; K133-E137 IonicContact NZ-OE1 3.99Å; K133-E137 WeakPolarHBondContact O-CG 3.36Å; K133-E137 PolarHBondContact O-N 2.84Å |
| 134 | E | 98.6 | Very high | 98.6 | Very high | 83 Ų | 83 | 97.9 Ų | 97.9 | 39% | 0.388 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.8 | -46.8 | 178.8 | -174.2 | 179.4 | 165.8 | 0 | 0 | 111.9 | R130 L131 K136 E137 L138 | R130-E134 IonicContact CZ-OE2 2.7Å; R130-E134 IonicContact NH1-OE2 3.87Å; R130-E134 PolarHBondContact NH1-OE2 3.45Å; R130-E134 PolarHBondContact O-N 3.45Å; L131-E134 PolarHBondContact O-N 2.85Å; E134-K136 VanDerWaalsContact C-N 3.27Å; E134-K136 PolarHBondContact O-N 3.19Å; E134-E137 PolarHBondContact O-N 3.36Å; E134-L138 HydrophobicContact CG-CD1 4.27Å; E134-L138 WeakPolarHBondContact O-CG 3.35Å; E134-L138 PolarHBondContact O-N 2.9Å |
| 135 | N | 98.6 | Very high | 98.6 | Very high | 104 Ų | 104 | 96.5 Ų | 96.5 | 56% | 0.556 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.3 | -35.5 | 176.2 | -82 | -30.1 | 0 | 0 | 0 | 113 | L131 K133 A139 | L131-N135 WeakPolarHBondContact O-CB 3.45Å; L131-N135 PolarHBondContact O-N 2.91Å; L131-N135 PolarHBondContact O-ND2 3.31Å; K133-N135 PolarHBondContact O-N 3.21Å; N135-A139 WeakPolarHBondContact O-CB 3.48Å; N135-A139 PolarHBondContact O-N 3Å |
| 136 | K | 98.7 | Very high | 98.6 | Very high | 134 Ų | 134 | 97.8 Ų | 97.8 | 58% | 0.583 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -66.3 | -47 | 175.8 | -178.2 | -177.5 | 170.2 | -173.1 | 0 | 110.8 | K132 K133 E134 L138 A139 E140 | K132-K136 WeakPolarHBondContact O-CB 3.42Å; K132-K136 PolarHBondContact O-N 3.46Å; K132-K136 VanDerWaalsContact O-N 3.08Å; K133-K136 WeakPolarHBondContact O-CB 3.44Å; K133-K136 PolarHBondContact O-N 2.69Å; K133-K136 VanDerWaalsContact O-N 3.11Å; E134-K136 VanDerWaalsContact C-N 3.27Å; E134-K136 PolarHBondContact O-N 3.19Å; K136-L138 VanDerWaalsContact C-N 3.33Å; K136-L138 PolarHBondContact O-N 3.31Å; K136-A139 WeakPolarHBondContact O-CB 3.45Å; K136-A139 PolarHBondContact O-N 3.11Å; K136-E140 WeakPolarHBondContact CE-OE1 2.84Å; K136-E140 IonicContact NZ-OE1 2.65Å; K136-E140 WeakPolarHBondContact O-CG 3.04Å; K136-E140 PolarHBondContact O-N 3.39Å |
| 137 | E | 98.4 | Very high | 98.6 | Very high | 94 Ų | 94 | 100.4 Ų | 100.4 | 44% | 0.439 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.1 | -43.5 | 177.4 | -69.7 | 170.8 | -176.4 | 0 | 0 | 111.3 | K133 E134 A139 E140 V141 | K133-E137 WeakPolarHBondContact CE-OE1 3.34Å; K133-E137 IonicContact NZ-OE1 3.99Å; K133-E137 WeakPolarHBondContact O-CG 3.36Å; K133-E137 PolarHBondContact O-N 2.84Å; E134-E137 PolarHBondContact O-N 3.36Å; E137-A139 VanDerWaalsContact C-N 3.34Å; E137-A139 PolarHBondContact O-N 3.08Å; E137-E140 PolarHBondContact O-N 3.43Å; E137-V141 WeakPolarHBondContact O-CG2 3.46Å; E137-V141 PolarHBondContact O-N 3.31Å |
| 138 | L | 98.6 | Very high | 98.6 | Very high | 102 Ų | 102 | 101.1 Ų | 101.1 | 53% | 0.534 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64 | -37.8 | 175.8 | -69.6 | 174.4 | 0 | 0 | 0 | 112.7 | E134 K136 V141 A142 | E134-L138 HydrophobicContact CG-CD1 4.27Å; E134-L138 WeakPolarHBondContact O-CG 3.35Å; E134-L138 PolarHBondContact O-N 2.9Å; K136-L138 VanDerWaalsContact C-N 3.33Å; K136-L138 PolarHBondContact O-N 3.31Å; L138-V141 PolarHBondContact O-N 3.03Å; L138-A142 WeakPolarHBondContact O-CB 3.43Å; L138-A142 PolarHBondContact O-N 3.17Å |
| 139 | A | 98.6 | Very high | 98.5 | Very high | 59 Ų | 59 | 99.9 Ų | 99.9 | 49% | 0.488 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.1 | -41 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | N135 K136 E137 A142 E143 | N135-A139 WeakPolarHBondContact O-CB 3.48Å; N135-A139 PolarHBondContact O-N 3Å; K136-A139 WeakPolarHBondContact O-CB 3.45Å; K136-A139 PolarHBondContact O-N 3.11Å; E137-A139 VanDerWaalsContact C-N 3.34Å; E137-A139 PolarHBondContact O-N 3.08Å; A139-A142 PolarHBondContact O-N 3.03Å; A139-E143 PolarHBondContact O-N 3.2Å |
| 140 | E | 98.5 | Very high | 98.4 | Very high | 103 Ų | 103 | 101.2 Ų | 101.2 | 48% | 0.481 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.8 | -42.6 | 175.5 | -70.5 | 173.1 | -172.7 | 0 | 0 | 111.5 | K136 E137 E143 H144 | K136-E140 WeakPolarHBondContact CE-OE1 2.84Å; K136-E140 IonicContact NZ-OE1 2.65Å; K136-E140 WeakPolarHBondContact O-CG 3.04Å; K136-E140 PolarHBondContact O-N 3.39Å; E137-E140 PolarHBondContact O-N 3.43Å; E140-E143 PolarHBondContact O-N 3.29Å; E140-H144 PolarHBondContact O-N 3.48Å |
| 141 | V | 98.6 | Very high | 98.3 | Very high | 89 Ų | 89 | 97.3 Ų | 97.3 | 54% | 0.539 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.6 | -42.9 | 175.3 | 173.8 | 0 | 0 | 0 | 0 | 111.2 | E137 L138 E143 H144 V145 | E137-V141 WeakPolarHBondContact O-CG2 3.46Å; E137-V141 PolarHBondContact O-N 3.31Å; L138-V141 PolarHBondContact O-N 3.03Å; V141-E143 PolarHBondContact O-N 2.95Å; V141-H144 PolarHBondContact O-N 2.93Å; V141-V145 HydrophobicContact CG1-CG2 4.39Å; V141-V145 WeakPolarHBondContact O-CG2 3.45Å; V141-V145 PolarHBondContact O-N 3Å |
| 142 | A | 98.5 | Very high | 98.1 | Very high | 59 Ų | 59 | 99.1 Ų | 99.1 | 49% | 0.488 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.6 | -42.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112 | L138 A139 V145 Q146 | L138-A142 WeakPolarHBondContact O-CB 3.43Å; L138-A142 PolarHBondContact O-N 3.17Å; A139-A142 PolarHBondContact O-N 3.03Å; A142-V145 PolarHBondContact O-N 3.42Å; A142-Q146 WeakPolarHBondContact O-CB 3.35Å; A142-Q146 PolarHBondContact O-N 3.41Å |
| 143 | E | 98.4 | Very high | 97.9 | Very high | 141 Ų | 141 | 97.5 Ų | 97.5 | 66% | 0.659 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60 | -46.2 | 174.4 | -176.7 | -180 | 175.2 | 0 | 0 | 111.2 | A139 E140 V141 V145 Q146 Y147 | A139-E143 PolarHBondContact O-N 3.2Å; E140-E143 PolarHBondContact O-N 3.29Å; V141-E143 PolarHBondContact O-N 2.95Å; E143-V145 PolarHBondContact O-N 3.5Å; E143-Q146 PolarHBondContact O-N 3.49Å; E143-Y147 PolarHBondContact O-N 3.46Å |
| 144 | H | 98.4 | Very high | 97.7 | Very high | 110 Ų | 110 | 98.4 Ų | 98.4 | 51% | 0.509 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.1 | -42.8 | 178.6 | -176.3 | -106.7 | 0 | 0 | 0 | 112.5 | E140 V141 Q146 Y147 M148 | E140-H144 PolarHBondContact O-N 3.48Å; V141-H144 PolarHBondContact O-N 2.93Å; H144-Q146 VanDerWaalsContact C-N 3.34Å; H144-Q146 PolarHBondContact O-N 3.4Å; H144-Y147 PolarHBondContact O-N 2.88Å; H144-M148 PolarHBondContact CE1-SD 3.37Å; H144-M148 WeakPolarHBondContact O-CG 3.4Å; H144-M148 PolarHBondContact O-N 3.02Å |
| 145 | V | 98.4 | Very high | 97.4 | Very high | 86 Ų | 86 | 100 Ų | 100 | 52% | 0.521 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.9 | -40.8 | 176.6 | 171 | 0 | 0 | 0 | 0 | 111.1 | V141 A142 E143 M148 A149 | V141-V145 HydrophobicContact CG1-CG2 4.39Å; V141-V145 WeakPolarHBondContact O-CG2 3.45Å; V141-V145 PolarHBondContact O-N 3Å; A142-V145 PolarHBondContact O-N 3.42Å; E143-V145 PolarHBondContact O-N 3.5Å; V145-M148 PolarHBondContact O-N 3.06Å; V145-A149 WeakPolarHBondContact O-CB 3.44Å; V145-A149 PolarHBondContact O-N 3.39Å |
| 146 | Q | 98.3 | Very high | 96.9 | Very high | 121 Ų | 121 | 99 Ų | 99 | 57% | 0.565 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.8 | -47.1 | 174.8 | -176.9 | 178.2 | -10.1 | 0 | 0 | 111 | A142 E143 H144 M148 A149 E150 | A142-Q146 WeakPolarHBondContact O-CB 3.35Å; A142-Q146 PolarHBondContact O-N 3.41Å; E143-Q146 PolarHBondContact O-N 3.49Å; H144-Q146 VanDerWaalsContact C-N 3.34Å; H144-Q146 PolarHBondContact O-N 3.4Å; Q146-M148 VanDerWaalsContact C-N 3.34Å; Q146-M148 PolarHBondContact O-N 2.95Å; Q146-A149 WeakPolarHBondContact O-CB 3.48Å; Q146-A149 PolarHBondContact O-N 2.94Å; Q146-E150 PolarHBondContact NE2-OE1 3.42Å; Q146-E150 WeakPolarHBondContact O-CG 3.34Å; Q146-E150 PolarHBondContact O-N 3.29Å |
| 147 | Y | 98.3 | Very high | 95.8 | Very high | 132 Ų | 132 | 99.2 Ų | 99.2 | 52% | 0.518 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -57.9 | -45.1 | 175 | 169.7 | -103.1 | 0 | 0 | 0 | 112.3 | E143 H144 A149 E150 V151 | E143-Y147 PolarHBondContact O-N 3.46Å; H144-Y147 PolarHBondContact O-N 2.88Å; Y147-A149 VanDerWaalsContact C-N 3.32Å; Y147-A149 PolarHBondContact O-N 3.07Å; Y147-E150 PolarHBondContact O-N 3.06Å; Y147-V151 HydrophobicContact CD1-CG2 4.41Å; Y147-V151 HydrophobicContact CD2-CG2 4.4Å; Y147-V151 HydrophobicContact CE1-CG2 3.91Å; Y147-V151 HydrophobicContact CE2-CG2 3.9Å; Y147-V151 WeakPolarHBondContact O-CG2 3.42Å; Y147-V151 PolarHBondContact O-N 3.16Å |
| 148 | M | 98.1 | Very high | 94.3 | Very high | 94 Ų | 94 | 101.4 Ų | 101.4 | 46% | 0.463 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.5 | -40.4 | 176.5 | -72.8 | -173.7 | 72.2 | 0 | 0 | 112.1 | H144 V145 Q146 V151 I152 | H144-M148 PolarHBondContact CE1-SD 3.37Å; H144-M148 WeakPolarHBondContact O-CG 3.4Å; H144-M148 PolarHBondContact O-N 3.02Å; V145-M148 PolarHBondContact O-N 3.06Å; Q146-M148 VanDerWaalsContact C-N 3.34Å; Q146-M148 PolarHBondContact O-N 2.95Å; M148-V151 PolarHBondContact O-N 3.36Å; M148-I152 VanDerWaalsContact O-CG1 3.3Å; M148-I152 WeakPolarHBondContact O-CG1 3.48Å; M148-I152 PolarHBondContact O-N 3.39Å |
| 149 | A | 97.4 | Very high | 92.2 | Very high | 54 Ų | 54 | 101.7 Ų | 101.7 | 45% | 0.446 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.7 | -43.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | V145 Q146 Y147 V151 I152 E153 | V145-A149 WeakPolarHBondContact O-CB 3.44Å; V145-A149 PolarHBondContact O-N 3.39Å; Q146-A149 WeakPolarHBondContact O-CB 3.48Å; Q146-A149 PolarHBondContact O-N 2.94Å; Y147-A149 VanDerWaalsContact C-N 3.32Å; Y147-A149 PolarHBondContact O-N 3.07Å; A149-V151 VanDerWaalsContact C-N 3.35Å; A149-V151 PolarHBondContact O-N 2.84Å; A149-I152 PolarHBondContact O-N 3.11Å; A149-E153 WeakPolarHBondContact O-CB 3.3Å; A149-E153 PolarHBondContact O-N 3.46Å |
| 150 | E | 96.2 | Very high | 90.2 | Very high | 88 Ų | 88 | 106.2 Ų | 106.2 | 41% | 0.411 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.7 | -35.9 | 176.1 | -69.1 | 173.6 | -165.8 | 0 | 0 | 112.7 | Q146 Y147 R154 | Q146-E150 PolarHBondContact NE2-OE1 3.42Å; Q146-E150 WeakPolarHBondContact O-CG 3.34Å; Q146-E150 PolarHBondContact O-N 3.29Å; Y147-E150 PolarHBondContact O-N 3.06Å; E150-R154 WeakPolarHBondContact O-CG 3.36Å; E150-R154 PolarHBondContact O-N 3.47Å; E150-R154 VanDerWaalsContact O-N 3.11Å; E150-R154 PolarHBondContact O-NE 3.43Å |
| 151 | V | 97 | Very high | 87.7 | Confident | 37 Ų | 37 | 108.8 Ų | 108.8 | 22% | 0.224 | 56% | 0.564 | C | S | . | * | H | α-helix | trans | -65.3 | -46.6 | 173.2 | 173 | 0 | 0 | 0 | 0 | 110.6 | Y147 M148 A149 R154 L155 | Y147-V151 HydrophobicContact CD1-CG2 4.41Å; Y147-V151 HydrophobicContact CD2-CG2 4.4Å; Y147-V151 HydrophobicContact CE1-CG2 3.91Å; Y147-V151 HydrophobicContact CE2-CG2 3.9Å; Y147-V151 WeakPolarHBondContact O-CG2 3.42Å; Y147-V151 PolarHBondContact O-N 3.16Å; M148-V151 PolarHBondContact O-N 3.36Å; A149-V151 VanDerWaalsContact C-N 3.35Å; A149-V151 PolarHBondContact O-N 2.84Å; V151-R154 PolarHBondContact O-N 3.3Å; V151-L155 HydrophobicContact CG1-CD1 3.98Å; V151-L155 WeakPolarHBondContact O-CG 3.35Å; V151-L155 PolarHBondContact O-N 3.48Å |
| 152 | I | 95.8 | Very high | 85.5 | Confident | 107 Ų | 107 | 109.2 Ų | 109.2 | 55% | 0.549 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -62.5 | -45.5 | 178.8 | -68.4 | 165.2 | 0 | 0 | 0 | 110.6 | M148 A149 R154 L155 S156 | M148-I152 VanDerWaalsContact O-CG1 3.3Å; M148-I152 WeakPolarHBondContact O-CG1 3.48Å; M148-I152 PolarHBondContact O-N 3.39Å; A149-I152 PolarHBondContact O-N 3.11Å; I152-R154 PolarHBondContact O-N 2.99Å; I152-L155 PolarHBondContact O-N 2.91Å; I152-S156 WeakPolarHBondContact O-CB 3.36Å; I152-S156 PolarHBondContact O-N 2.89Å; I152-S156 PolarHBondContact O-OG 3.31Å |
| 153 | E | 94.6 | Very high | 83.2 | Confident | 113 Ų | 113 | 115 Ų | 115 | 53% | 0.528 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -55.9 | -51.6 | 177.5 | -178.2 | 172.7 | -154 | 0 | 0 | 110.3 | A149 L155 S156 H157 | A149-E153 WeakPolarHBondContact O-CB 3.3Å; A149-E153 PolarHBondContact O-N 3.46Å; E153-L155 PolarHBondContact O-N 2.86Å; E153-S156 PolarHBondContact O-N 3.27Å; E153-S156 VanDerWaalsContact O-N 3.16Å; E153-S156 PolarHBondContact O-OG 2.97Å; E153-H157 VanDerWaalsContact CG-CD2 3.48Å; E153-H157 WeakPolarHBondContact CG-CD2 3.38Å; E153-H157 PolarHBondContact O-CD2 3.37Å; E153-H157 PolarHBondContact O-N 3.05Å; E153-H157 IonicContact OE1-NE2 2.84Å |
| 154 | R | 93.9 | Very high | 80.8 | Confident | 156 Ų | 156 | 117 Ų | 117 | 59% | 0.589 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -56.8 | -45.1 | 177.6 | -75.7 | -174.6 | -65.1 | 158.2 | -3 | 113.1 | E150 V151 I152 S156 H157 E158 | E150-R154 WeakPolarHBondContact O-CG 3.36Å; E150-R154 PolarHBondContact O-N 3.47Å; E150-R154 VanDerWaalsContact O-N 3.11Å; E150-R154 PolarHBondContact O-NE 3.43Å; V151-R154 PolarHBondContact O-N 3.3Å; I152-R154 PolarHBondContact O-N 2.99Å; R154-S156 VanDerWaalsContact C-N 3.35Å; R154-H157 PolarHBondContact O-N 3.31Å; R154-E158 PolarHBondContact O-N 3.25Å |
| 155 | L | 93.1 | Very high | 78.6 | Confident | 117 Ų | 117 | 117 Ų | 117 | 61% | 0.613 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -68.7 | -33.3 | 179.2 | -67.6 | 172.9 | 0 | 0 | 0 | 112.6 | V151 I152 E153 | V151-L155 HydrophobicContact CG1-CD1 3.98Å; V151-L155 WeakPolarHBondContact O-CG 3.35Å; V151-L155 PolarHBondContact O-N 3.48Å; I152-L155 PolarHBondContact O-N 2.91Å; E153-L155 PolarHBondContact O-N 2.86Å |
| 156 | S | 88.2 | Confident | 76.3 | Confident | 83 Ų | 83 | 118.7 Ų | 118.7 | 58% | 0.58 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -76.7 | -21.7 | 179 | 70.4 | 0 | 0 | 0 | 0 | 114 | I152 E153 R154 | I152-S156 WeakPolarHBondContact O-CB 3.36Å; I152-S156 PolarHBondContact O-N 2.89Å; I152-S156 PolarHBondContact O-OG 3.31Å; E153-S156 PolarHBondContact O-N 3.27Å; E153-S156 VanDerWaalsContact O-N 3.16Å; E153-S156 PolarHBondContact O-OG 2.97Å; R154-S156 VanDerWaalsContact C-N 3.35Å |
| 157 | H | 75.3 | Confident | 73.9 | Confident | 138 Ų | 138 | 119.7 Ų | 119.7 | 64% | 0.639 | 63% | 0.629 | S | S | * | * | S | Bend | trans | -89.3 | -6.5 | 175.8 | -73.6 | -61.5 | 0 | 0 | 0 | 114.2 | E153 R154 | E153-H157 VanDerWaalsContact CG-CD2 3.48Å; E153-H157 WeakPolarHBondContact CG-CD2 3.38Å; E153-H157 PolarHBondContact O-CD2 3.37Å; E153-H157 PolarHBondContact O-N 3.05Å; E153-H157 IonicContact OE1-NE2 2.84Å; R154-H157 PolarHBondContact O-N 3.31Å |
| 158 | E | 66.3 | Low | 71.9 | Confident | 140 Ų | 140 | 118.3 Ų | 118.3 | 65% | 0.654 | 64% | 0.639 | S | S | * | * | S | Bend | trans | -85.9 | 119.4 | 172 | -168.2 | 144.8 | -160.2 | 0 | 0 | 109.6 | R154 L160 | R154-E158 PolarHBondContact O-N 3.25Å; E158-L160 PolarHBondContact O-N 3.46Å |
| 159 | P | 54.5 | Low | 69.6 | Low | 109 Ų | 109 | 121.3 Ų | 121.3 | 71% | 0.708 | 65% | 0.652 | S | S | * | * | trans | -64.1 | 122.3 | -179.1 | 24.2 | -31.7 | 0 | 0 | 0 | 110.2 | D161 | P159-D161 PolarHBondContact O-N 3.23Š| ||
| 160 | L | 56.7 | Low | 67.4 | Low | 153 Ų | 153 | 127.9 Ų | 127.9 | 80% | 0.801 | 67% | 0.673 | S | S | * | * | trans | -64.9 | 63.5 | 173.6 | -70.7 | 167.3 | 0 | 0 | 0 | 111.8 | E158 F163 | E158-L160 PolarHBondContact O-N 3.46Å; L160-F163 HydrophobicContact CD2-CD2 4.15Å | ||
| 161 | D | 46.1 | Very low | 64.7 | Low | 157 Ų | 157 | 131.5 Ų | 131.5 | 84% | 0.84 | 69% | 0.688 | S | S | * | * | trans | -117.7 | 20.4 | 178 | -146.7 | 25.9 | 0 | 0 | 0 | 112.5 | P159 | P159-D161 PolarHBondContact O-N 3.23Š| ||
| 162 | S | 52.5 | Low | 62.6 | Low | 98 Ų | 98 | 136.7 Ų | 136.7 | 69% | 0.685 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -138.2 | 2.4 | 174.4 | 82.8 | 0 | 0 | 0 | 0 | 117.2 | E164 | S162-E164 PolarHBondContact O-N 3.2Å; S162-E164 VanDerWaalsContact O-N 3.12Å |
| 163 | F | 50.6 | Low | 60.6 | Low | 181 Ų | 181 | 136.6 Ų | 136.6 | 79% | 0.794 | 72% | 0.723 | S | S | * | * | trans | -89.2 | 64.5 | 167 | -65.5 | -72.2 | 0 | 0 | 0 | 109.8 | L160 S165 | L160-F163 HydrophobicContact CD2-CD2 4.15Å; F163-S165 PolarHBondContact O-N 2.88Å | ||
| 164 | E | 47 | Very low | 58.6 | Low | 184 Ų | 184 | 139.3 Ų | 139.3 | 86% | 0.86 | 74% | 0.736 | S | S | * | * | trans | -64 | 121.8 | 155.6 | -170.8 | 172 | -162.4 | 0 | 0 | 107.2 | S162 P166 | S162-E164 PolarHBondContact O-N 3.2Å; S162-E164 VanDerWaalsContact O-N 3.12Å; E164-P166 WeakPolarHBondContact O-CD 3.5Å | ||
| 165 | S | 52 | Low | 56.4 | Low | 110 Ų | 110 | 139 Ų | 139 | 77% | 0.769 | 75% | 0.745 | S | S | * | * | trans | -45.5 | 138.1 | -180 | -61 | 0 | 0 | 0 | 0 | 114.3 | F163 | F163-S165 PolarHBondContact O-N 2.88Š| ||
| 166 | P | 50.3 | Low | 54.3 | Low | 121 Ų | 121 | 141.3 Ų | 141.3 | 79% | 0.786 | 75% | 0.753 | S | S | * | * | trans | -115.5 | 95.9 | 138.2 | 31.6 | -18.3 | 0 | 0 | 0 | 107.1 | E164 | E164-P166 WeakPolarHBondContact O-CD 3.5Š| ||
| 167 | D | 48.7 | Very low | 52 | Low | 141 Ų | 141 | 142.1 Ų | 142.1 | 75% | 0.754 | 76% | 0.755 | S | S | * | * | 29.2 | 115.7 | 99.2 | -156.7 | 22.2 | 0 | 0 | 0 | 114.9 | |||||
| 168 | S | 56.6 | Low | 50.8 | Low | 104 Ų | 104 | 142.1 Ų | 142.1 | 73% | 0.727 | 76% | 0.764 | S | S | * | * | trans | 61.6 | 95.6 | 158.9 | 61.5 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 169 | Q | 49.6 | Very low | 49.8 | Very low | 156 Ų | 156 | 144.4 Ų | 144.4 | 73% | 0.729 | 77% | 0.774 | S | S | * | * | trans | -142.1 | 96.7 | 140.6 | -165.3 | 162.2 | -8.3 | 0 | 0 | 109.9 | F171 | Q169-F171 HydrophobicContact CG-CD2 4.14Å; Q169-F171 HydrophobicContact CG-CE2 3.78Å; Q169-F171 PolarHBondContact O-N 3.27Å | ||
| 170 | E | 50 | Low | 49 | Very low | 192 Ų | 192 | 145.2 Ų | 145.2 | 90% | 0.897 | 77% | 0.773 | S | S | * | * | trans | -50.6 | 119.1 | 161.6 | -85.5 | 177.4 | 143.6 | 0 | 0 | 109 | ||||
| 171 | F | 40.8 | Very low | 48.7 | Very low | 165 Ų | 165 | 142.5 Ų | 142.5 | 72% | 0.724 | 77% | 0.766 | S | S | * | * | trans | -108.7 | 98 | 152.8 | -85.1 | -82.3 | 0 | 0 | 0 | 106.8 | Q169 S173 | Q169-F171 HydrophobicContact CG-CD2 4.14Å; Q169-F171 HydrophobicContact CG-CE2 3.78Å; Q169-F171 PolarHBondContact O-N 3.27Å; F171-S173 PolarHBondContact O-N 2.77Å | ||
| 172 | D | 51.3 | Low | 48.7 | Very low | 145 Ų | 145 | 143.8 Ų | 143.8 | 78% | 0.775 | 77% | 0.767 | S | S | * | * | trans | -60.2 | 115.7 | 162 | -164 | 9.3 | 0 | 0 | 0 | 107.5 | ||||
| 173 | S | 55.6 | Low | 48.6 | Very low | 105 Ų | 105 | 144.4 Ų | 144.4 | 73% | 0.734 | 77% | 0.767 | S | S | * | * | trans | -136 | 82.9 | 168 | -70 | 0 | 0 | 0 | 0 | 105.9 | F171 L175 | F171-S173 PolarHBondContact O-N 2.77Å; S173-L175 PolarHBondContact O-N 3.4Å | ||
| 174 | E | 51.4 | Low | 48.3 | Very low | 171 Ų | 171 | 143.3 Ų | 143.3 | 80% | 0.799 | 76% | 0.764 | S | S | * | * | trans | -24.1 | 120.6 | 159.8 | 54.8 | -156.7 | 157.8 | 0 | 0 | 113.8 | E176 | E174-E176 PolarHBondContact O-N 3.12Š| ||
| 175 | L | 48.1 | Very low | 47.9 | Very low | 150 Ų | 150 | 140.4 Ų | 140.4 | 79% | 0.785 | 76% | 0.755 | S | S | * | * | trans | -49.6 | 124.2 | 161.8 | 159.5 | 139.6 | 0 | 0 | 0 | 110.5 | S173 | S173-L175 PolarHBondContact O-N 3.4Š| ||
| 176 | E | 48.3 | Very low | 47.8 | Very low | 165 Ų | 165 | 138.9 Ų | 138.9 | 77% | 0.771 | 74% | 0.744 | S | S | * | * | trans | -116.3 | 98.2 | 151.3 | -83.9 | -63.1 | 172.4 | 0 | 0 | 109.1 | E174 | E174-E176 PolarHBondContact O-N 3.12Š| ||
| 177 | T | 41.3 | Very low | 47.6 | Very low | 100 Ų | 100 | 140.9 Ų | 140.9 | 61% | 0.613 | 74% | 0.743 | S | S | * | * | trans | 42.1 | 107.3 | 136 | 54.5 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 178 | V | 48.7 | Very low | 47.4 | Very low | 137 Ų | 137 | 139.9 Ų | 139.9 | 83% | 0.83 | 74% | 0.742 | S | S | * | * | trans | -43.1 | 132 | 146.5 | 164.4 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 179 | E | 45.3 | Very low | 47.1 | Very low | 188 Ų | 188 | 139.8 Ų | 139.8 | 88% | 0.879 | 74% | 0.742 | S | S | * | * | trans | -160.4 | 99.2 | 136.9 | -99.2 | -175.1 | 138.5 | 0 | 0 | 105.7 | ||||
| 180 | D | 38.4 | Very low | 46.6 | Very low | 127 Ų | 127 | 138.6 Ų | 138.6 | 68% | 0.679 | 75% | 0.745 | S | S | * | * | 110.9 | 103 | 84.8 | -154 | 30.7 | 0 | 0 | 0 | 106.4 | |||||
| 181 | S | 50.4 | Low | 46.3 | Very low | 95 Ų | 95 | 134.9 Ų | 134.9 | 66% | 0.664 | 74% | 0.739 | S | S | * | * | 37.1 | 117.2 | 99.3 | -158.6 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 182 | E | 46.5 | Very low | 46.8 | Very low | 184 Ų | 184 | 132 Ų | 132 | 86% | 0.86 | 75% | 0.745 | S | S | * | * | -149.5 | 141.6 | 84 | -43.2 | -165 | 136.1 | 0 | 0 | 112.7 | |||||
| 183 | V | 49.6 | Very low | 46.6 | Very low | 112 Ų | 112 | 133.5 Ų | 133.5 | 68% | 0.679 | 75% | 0.748 | S | S | * | * | trans | -90.8 | 170.3 | 166.8 | 51.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 184 | E | 44 | Very low | 46.1 | Very low | 158 Ų | 158 | 137.9 Ų | 137.9 | 74% | 0.738 | 76% | 0.757 | S | S | * | * | trans | 97.7 | 143 | 171.4 | -52.9 | -64.8 | 123.6 | 0 | 0 | 113.9 | ||||
| 185 | D | 38.6 | Very low | 46 | Very low | 122 Ų | 122 | 135.7 Ų | 135.7 | 65% | 0.652 | 76% | 0.755 | S | S | * | * | cis | -168.5 | 153.8 | -23.2 | -168.4 | 7.4 | 0 | 0 | 0 | 104 | ||||
| 186 | S | 49.7 | Very low | 45.9 | Very low | 79 Ų | 79 | 134.9 Ų | 134.9 | 55% | 0.552 | 76% | 0.756 | S | S | * | * | trans | 20.8 | 152.2 | 154.7 | -61.8 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 187 | E | 47.6 | Very low | 46 | Very low | 163 Ų | 163 | 133.1 Ų | 133.1 | 76% | 0.762 | 76% | 0.762 | S | S | * | * | trans | 69.1 | 127.1 | 151.4 | 75.4 | -133.7 | 117.6 | 0 | 0 | 118.7 | ||||
| 188 | T | 42.7 | Very low | 46.3 | Very low | 119 Ų | 119 | 133.2 Ų | 133.2 | 73% | 0.73 | 77% | 0.767 | S | S | * | * | -175.7 | 153.3 | 63 | 55.6 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 189 | S | 51.3 | Low | 46.6 | Very low | 103 Ų | 103 | 132.8 Ų | 132.8 | 72% | 0.72 | 77% | 0.77 | S | S | * | * | trans | 50.4 | 117.4 | 135.7 | -173 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 190 | T | 38.8 | Very low | 47.1 | Very low | 131 Ų | 131 | 129.9 Ų | 129.9 | 80% | 0.804 | 77% | 0.765 | S | S | * | * | -170.5 | 122.1 | 110 | -76 | 0 | 0 | 0 | 0 | 111 | |||||
| 191 | C | 44.9 | Very low | 47.7 | Very low | 114 Ų | 114 | 130.5 Ų | 130.5 | 77% | 0.77 | 77% | 0.769 | S | S | * | * | trans | -68 | 142.8 | 168.9 | -54 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 192 | A | 49.7 | Very low | 48.1 | Very low | 103 Ų | 103 | 130.6 Ų | 130.6 | 85% | 0.851 | 78% | 0.775 | S | S | * | * | trans | -141.7 | 100.5 | 149.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 193 | E | 48.5 | Very low | 49.2 | Very low | 177 Ų | 177 | 130.5 Ų | 130.5 | 83% | 0.827 | 77% | 0.772 | S | S | * | * | trans | -66.5 | 124.9 | 170.4 | -61 | -166.4 | 120.9 | 0 | 0 | 109.6 | T195 | E193-T195 PolarHBondContact O-N 3.26Š| ||
| 194 | E | 43.9 | Very low | 50 | Low | 198 Ų | 198 | 131.1 Ų | 131.1 | 93% | 0.925 | 78% | 0.778 | S | S | * | * | trans | -72.4 | 115.4 | 160.6 | -83.3 | -169.6 | 119.5 | 0 | 0 | 108.5 | V196 | E194-V196 PolarHBondContact O-N 3.32Š| ||
| 195 | T | 49.3 | Very low | 50.6 | Low | 125 Ų | 125 | 129.2 Ų | 129.2 | 77% | 0.767 | 78% | 0.781 | S | S | * | * | trans | -72.5 | 121.5 | 180 | 43.2 | 0 | 0 | 0 | 0 | 111.2 | E193 S197 | E193-T195 PolarHBondContact O-N 3.26Å; T195-S197 PolarHBondContact O-N 3.43Å | ||
| 196 | V | 45.5 | Very low | 51.7 | Low | 133 Ų | 133 | 133.6 Ų | 133.6 | 81% | 0.806 | 81% | 0.812 | S | S | * | * | trans | -39.8 | 118 | 165.1 | -119.1 | 0 | 0 | 0 | 0 | 112.7 | E194 S198 | E194-V196 PolarHBondContact O-N 3.32Å; V196-S198 PolarHBondContact O-N 3.49Å | ||
| 197 | S | 52.2 | Low | 51.8 | Low | 127 Ų | 127 | 136.4 Ų | 136.4 | 89% | 0.888 | 83% | 0.825 | S | S | * | * | trans | -78 | 104.5 | 156.6 | -83.4 | 0 | 0 | 0 | 0 | 109.2 | T195 | T195-S197 PolarHBondContact O-N 3.43Š| ||
| 198 | S | 47.8 | Very low | 52 | Low | 102 Ų | 102 | 134.9 Ų | 134.9 | 71% | 0.713 | 83% | 0.829 | S | S | * | * | trans | -112.6 | 113.2 | 163.1 | -80.5 | 0 | 0 | 0 | 0 | 109.4 | V196 | V196-S198 PolarHBondContact O-N 3.49Š| ||
| 199 | S | 53 | Low | 52.5 | Low | 129 Ų | 129 | 135.8 Ų | 135.8 | 90% | 0.902 | 83% | 0.834 | S | S | * | * | trans | -83.3 | 114.5 | 173.1 | 179.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 200 | T | 55.8 | Low | 52.6 | Low | 127 Ų | 127 | 137.8 Ų | 137.8 | 78% | 0.779 | 84% | 0.841 | S | S | * | * | trans | -102.1 | 118.3 | 172.5 | 51 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 201 | D | 52.2 | Low | 53.5 | Low | 140 Ų | 140 | 138.2 Ų | 138.2 | 75% | 0.749 | 84% | 0.843 | S | S | * | * | trans | -10.5 | 127.2 | 149.2 | -167.6 | 53.7 | 0 | 0 | 0 | 116.7 | ||||
| 202 | A | 58.3 | Low | 54 | Low | 97 Ų | 97 | 139.8 Ų | 139.8 | 80% | 0.802 | 85% | 0.848 | S | S | * | * | trans | -127.4 | 111.5 | 164.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 203 | K | 69.7 | Low | 54.4 | Low | 182 Ų | 182 | 142.4 Ų | 142.4 | 79% | 0.791 | 85% | 0.848 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 151.3 | 163.2 | -85.5 | 179.2 | 177.8 | 166.7 | 0 | 110.8 | ||
| 204 | P | 65.8 | Low | 54.8 | Low | 125 Ų | 125 | 139.8 Ų | 139.8 | 81% | 0.812 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 146.8 | -178.6 | 33.8 | -32.1 | 0 | 0 | 0 | 112 | ||
| 205 | C | 57 | Low | 55.7 | Low | 118 Ų | 118 | 134.9 Ų | 134.9 | 80% | 0.797 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -98 | 138.1 | 166.4 | -94.5 | 0 | 0 | 0 | 0 | 110.7 | ||
| 206 | T | 62 | Low | 56.3 | Low | 214 Ų | 214 | 135.8 Ų | 135.8 | 100% | 1.313 | 85% | 0.85 | S | S | * | * | trans | 63.6 | 0 | 159.6 | 59.1 | 0 | 0 | 0 | 0 | 119.2 |
Retrieved 206 of 206 residues in 89.1 ms
(Link to these results)