| 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 | 41.1 | Very low | 32.2 | Very low | 248 Ų | 248 | 154.4 Ų | 154.4 | 100% | 1.222 | 86% | 0.858 | S | S | * | * | 0 | 126.5 | 0 | -69.5 | -176.2 | 95.6 | 0 | 0 | 107.9 | |||||
| 2 | S | 34.1 | Very low | 32.6 | Very low | 112 Ų | 112 | 149.5 Ų | 149.5 | 78% | 0.783 | 85% | 0.852 | S | S | * | * | trans | -78.5 | 158.6 | -163.3 | -48.4 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 3 | T | 31.2 | Very low | 33 | Very low | 118 Ų | 118 | 150.2 Ų | 150.2 | 72% | 0.724 | 85% | 0.852 | S | S | * | * | trans | 66.5 | 122.7 | 145.1 | -17.4 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 4 | K | 36.9 | Very low | 33.2 | Very low | 203 Ų | 203 | 153.1 Ų | 153.1 | 88% | 0.883 | 85% | 0.85 | S | S | * | * | -165.4 | 100.2 | 124.3 | -101 | 162.9 | -170.2 | -170.2 | 0 | 110 | |||||
| 5 | Q | 27.7 | Very low | 33.3 | Very low | 174 Ų | 174 | 151.2 Ų | 151.2 | 81% | 0.813 | 85% | 0.848 | S | S | * | * | trans | -66 | 134.6 | 151.9 | -86.6 | 161.9 | -31.7 | 0 | 0 | 108.1 | ||||
| 6 | C | 33.2 | Very low | 33.7 | Very low | 135 Ų | 135 | 146.6 Ų | 146.6 | 91% | 0.912 | 84% | 0.835 | S | S | * | * | trans | -131.3 | 100.1 | 164.3 | -111.8 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 7 | T | 26.5 | Very low | 33.5 | Very low | 125 Ų | 125 | 149.1 Ų | 149.1 | 77% | 0.767 | 84% | 0.838 | S | S | * | * | trans | -99.6 | 130.9 | 164.5 | -2.9 | 0 | 0 | 0 | 0 | 107 | ||||
| 8 | L | 28.7 | Very low | 33.5 | Very low | 179 Ų | 179 | 153.9 Ų | 153.9 | 94% | 0.937 | 84% | 0.841 | S | S | * | * | trans | 151.9 | 137.8 | 161.4 | -86.2 | 159.9 | 0 | 0 | 0 | 106.5 | ||||
| 9 | A | 30.5 | Very low | 33.5 | Very low | 82 Ų | 82 | 153.9 Ų | 153.9 | 68% | 0.678 | 84% | 0.838 | S | S | * | * | cis | -161.8 | 148.4 | -7.6 | 0 | 0 | 0 | 0 | 0 | 106.1 | K11 | A9-K11 PolarHBondContact O-N 2.89Š| ||
| 10 | S | 28.6 | Very low | 33.4 | Very low | 119 Ų | 119 | 150.7 Ų | 150.7 | 83% | 0.832 | 83% | 0.833 | S | S | * | * | trans | -50.5 | 117.5 | 165.9 | 169.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 11 | K | 35.6 | Very low | 33.6 | Very low | 203 Ų | 203 | 149.2 Ų | 149.2 | 88% | 0.883 | 83% | 0.832 | S | S | * | * | trans | -134.2 | 91.2 | 155.6 | -124.1 | 177 | -176.3 | 177.7 | 0 | 107.1 | A9 N13 | A9-K11 PolarHBondContact O-N 2.89Å; K11-N13 PolarHBondContact O-N 3.48Å | ||
| 12 | A | 37.5 | Very low | 33.2 | Very low | 96 Ų | 96 | 144.2 Ų | 144.2 | 79% | 0.793 | 81% | 0.81 | S | S | * | * | trans | -56.2 | 102.2 | 170.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 13 | N | 36.9 | Very low | 33.1 | Very low | 159 Ų | 159 | 147.6 Ų | 147.6 | 85% | 0.85 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 125.9 | 175 | -146.2 | 4.1 | 0 | 0 | 0 | 108 | K11 | K11-N13 PolarHBondContact O-N 3.48Š|
| 14 | K | 35.8 | Very low | 33.1 | Very low | 190 Ų | 190 | 148 Ų | 148 | 83% | 0.826 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 138.9 | -168.9 | -63.6 | 176.5 | 177.3 | -177.8 | 0 | 111.7 | ||
| 15 | P | 34.9 | Very low | 32.9 | Very low | 125 Ų | 125 | 144.7 Ų | 144.7 | 81% | 0.812 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 142.8 | 176.6 | 30.6 | -32 | 0 | 0 | 0 | 110.7 | E17 | P15-E17 PolarHBondContact O-N 2.9Š|
| 16 | A | 39.9 | Very low | 33.2 | Very low | 78 Ų | 78 | 142.2 Ų | 142.2 | 65% | 0.645 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -49.3 | 129.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112 | W18 | A16-W18 PolarHBondContact O-N 2.55Å; A16-W18 VanDerWaalsContact O-N 3.16Å |
| 17 | E | 30.7 | Very low | 32.9 | Very low | 189 Ų | 189 | 146.2 Ų | 146.2 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | trans | -71.2 | 101.8 | 177.7 | -170.5 | 173.2 | -178.1 | 0 | 0 | 109.1 | P15 | P15-E17 PolarHBondContact O-N 2.9Š| ||
| 18 | W | 32.6 | Very low | 33.1 | Very low | 235 Ų | 235 | 147.5 Ų | 147.5 | 89% | 0.89 | 80% | 0.804 | S | S | * | * | trans | -82.1 | 115 | 172.6 | -69.5 | 82.7 | 0 | 0 | 0 | 108.7 | A16 A20 | A16-W18 PolarHBondContact O-N 2.55Å; A16-W18 VanDerWaalsContact O-N 3.16Å; W18-A20 PolarHBondContact O-N 3.24Å; W18-A20 VanDerWaalsContact O-N 3.11Å | ||
| 19 | I | 34.3 | Very low | 33 | Very low | 155 Ų | 155 | 147.2 Ų | 147.2 | 80% | 0.795 | 80% | 0.797 | S | S | * | * | trans | -69 | 107.1 | 170.8 | -60.6 | 172.3 | 0 | 0 | 0 | 107.3 | C21 | I19-C21 PolarHBondContact O-N 3.44Å; I19-C21 VanDerWaalsContact O-N 3.11Å | ||
| 20 | A | 30.9 | Very low | 33.2 | Very low | 88 Ų | 88 | 148.9 Ų | 148.9 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | trans | -68.7 | 103.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | W18 D22 | W18-A20 PolarHBondContact O-N 3.24Å; W18-A20 VanDerWaalsContact O-N 3.11Å; A20-D22 PolarHBondContact O-N 3.19Å | ||
| 21 | C | 36.9 | Very low | 33.1 | Very low | 121 Ų | 121 | 153.2 Ų | 153.2 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -75.6 | 110.5 | 154.8 | -81 | 0 | 0 | 0 | 0 | 107.7 | I19 K23 | I19-C21 PolarHBondContact O-N 3.44Å; I19-C21 VanDerWaalsContact O-N 3.11Å; C21-K23 PolarHBondContact O-N 3.17Å | ||
| 22 | D | 34.1 | Very low | 32.9 | Very low | 142 Ų | 142 | 154.3 Ų | 154.3 | 76% | 0.759 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -44.8 | 124.4 | -179.5 | -96.7 | -42.5 | 0 | 0 | 0 | 113.3 | A20 | A20-D22 PolarHBondContact O-N 3.19Š|
| 23 | K | 31.9 | Very low | 32.5 | Very low | 184 Ų | 184 | 157.5 Ų | 157.5 | 80% | 0.8 | 79% | 0.794 | S | S | * | * | S | Bend | trans | 65.4 | 59.1 | 153.7 | -53.2 | -176.9 | -175.6 | -176.4 | 0 | 117.7 | C21 | C21-K23 PolarHBondContact O-N 3.17Š|
| 24 | V | 30.8 | Very low | 32.1 | Very low | 125 Ų | 125 | 154.4 Ų | 154.4 | 76% | 0.758 | 79% | 0.785 | S | S | * | * | trans | -132.6 | 83.1 | 140.4 | -172.3 | 0 | 0 | 0 | 0 | 108.7 | V26 | V24-V26 HydrophobicContact CG1-CG2 3.89Å; V24-V26 PolarHBondContact O-N 3.42Å; V24-V26 VanDerWaalsContact O-N 3.16Å | ||
| 25 | V | 32.6 | Very low | 31.8 | Very low | 134 Ų | 134 | 152.7 Ų | 152.7 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | -78.5 | 94.4 | 164.4 | 179.9 | 0 | 0 | 0 | 0 | 106.4 | R27 | V25-R27 PolarHBondContact O-N 3.27Š| ||
| 26 | V | 33.3 | Very low | 31.7 | Very low | 122 Ų | 122 | 152.6 Ų | 152.6 | 74% | 0.739 | 78% | 0.782 | S | S | * | * | trans | -66.5 | 104.1 | 162.2 | -177.2 | 0 | 0 | 0 | 0 | 105.5 | V24 D28 | V24-V26 HydrophobicContact CG1-CG2 3.89Å; V24-V26 PolarHBondContact O-N 3.42Å; V24-V26 VanDerWaalsContact O-N 3.16Å; V26-D28 PolarHBondContact O-N 3.31Å; V26-D28 VanDerWaalsContact O-N 3.13Å | ||
| 27 | R | 27.6 | Very low | 31.2 | Very low | 220 Ų | 220 | 153.6 Ų | 153.6 | 83% | 0.83 | 78% | 0.784 | S | S | * | * | trans | -53.6 | 120.6 | 168.4 | -110.8 | -177.7 | -178.4 | 140.3 | -0.8 | 107.2 | V25 Q29 | V25-R27 PolarHBondContact O-N 3.27Å; R27-Q29 VanDerWaalsContact C-N 3.26Å; R27-Q29 PolarHBondContact O-N 3.13Å | ||
| 28 | D | 30 | Very low | 31.3 | Very low | 151 Ų | 151 | 150.5 Ų | 150.5 | 81% | 0.807 | 78% | 0.778 | S | S | * | * | trans | -64.2 | 94.6 | 165 | -164.5 | 17.3 | 0 | 0 | 0 | 106.3 | V26 V30 | V26-D28 PolarHBondContact O-N 3.31Å; V26-D28 VanDerWaalsContact O-N 3.13Å; D28-V30 PolarHBondContact O-N 2.67Å; D28-V30 VanDerWaalsContact O-N 3.09Å | ||
| 29 | Q | 28.7 | Very low | 31.2 | Very low | 173 Ų | 173 | 147.5 Ų | 147.5 | 81% | 0.808 | 77% | 0.771 | S | S | * | * | trans | -66.2 | 112.4 | 169.5 | -96.9 | -172.5 | -12.1 | 0 | 0 | 106.1 | R27 R31 | R27-Q29 VanDerWaalsContact C-N 3.26Å; R27-Q29 PolarHBondContact O-N 3.13Å; Q29-R31 PolarHBondContact O-N 3.21Å | ||
| 30 | V | 33.6 | Very low | 31 | Very low | 117 Ų | 117 | 145.6 Ų | 145.6 | 71% | 0.709 | 77% | 0.769 | S | S | * | * | trans | -0.8 | 99.2 | 161.4 | -178.1 | 0 | 0 | 0 | 0 | 110.6 | D28 W32 | D28-V30 PolarHBondContact O-N 2.67Å; D28-V30 VanDerWaalsContact O-N 3.09Å; V30-W32 VanDerWaalsContact C-N 3.25Å; V30-W32 PolarHBondContact O-N 3.44Å | ||
| 31 | R | 26.7 | Very low | 30.9 | Very low | 211 Ų | 211 | 149.5 Ų | 149.5 | 80% | 0.796 | 77% | 0.769 | S | S | * | * | trans | -44.6 | 101.3 | 160 | 176.9 | -177.7 | -69 | -133.1 | -1 | 105.7 | Q29 Q33 | Q29-R31 PolarHBondContact O-N 3.21Å; R31-Q33 PolarHBondContact O-N 3.15Å | ||
| 32 | W | 30.4 | Very low | 30.6 | Very low | 225 Ų | 225 | 148.7 Ų | 148.7 | 85% | 0.852 | 76% | 0.76 | S | S | * | * | trans | -56 | 101.7 | 160.5 | -74.9 | 94.5 | 0 | 0 | 0 | 102.8 | V30 S34 | V30-W32 VanDerWaalsContact C-N 3.25Å; V30-W32 PolarHBondContact O-N 3.44Å; W32-S34 VanDerWaalsContact C-N 3.26Å; W32-S34 PolarHBondContact O-N 3.14Å | ||
| 33 | Q | 29 | Very low | 30.2 | Very low | 163 Ų | 163 | 151 Ų | 151 | 76% | 0.762 | 76% | 0.76 | S | S | * | * | trans | -51.4 | 111 | 164.5 | -71 | 179.7 | -6.6 | 0 | 0 | 102.8 | R31 L35 | R31-Q33 PolarHBondContact O-N 3.15Å; Q33-L35 VanDerWaalsContact C-N 3.27Å; Q33-L35 PolarHBondContact O-N 3.43Å | ||
| 34 | S | 28.6 | Very low | 30.1 | Very low | 95 Ų | 95 | 150.3 Ų | 150.3 | 66% | 0.664 | 76% | 0.759 | S | S | * | * | trans | -46.4 | 106.6 | 168.6 | -53.2 | 0 | 0 | 0 | 0 | 104.8 | W32 T36 | W32-S34 VanDerWaalsContact C-N 3.26Å; W32-S34 PolarHBondContact O-N 3.14Å; S34-T36 WeakPolarHBondContact CB-OG1 3.18Å; S34-T36 PolarHBondContact O-N 3.44Å | ||
| 35 | L | 30.5 | Very low | 30.6 | Very low | 153 Ų | 153 | 149.4 Ų | 149.4 | 80% | 0.801 | 76% | 0.756 | S | S | * | * | trans | -70 | 50.7 | 165.2 | -88.4 | 134.5 | 0 | 0 | 0 | 107.3 | Q33 S37 | Q33-L35 VanDerWaalsContact C-N 3.27Å; Q33-L35 PolarHBondContact O-N 3.43Å; L35-S37 PolarHBondContact O-N 3Å | ||
| 36 | T | 32.4 | Very low | 30.6 | Very low | 124 Ų | 124 | 152 Ų | 152 | 76% | 0.761 | 76% | 0.756 | S | S | * | * | trans | -92.7 | 62.6 | 162.4 | 53.7 | 0 | 0 | 0 | 0 | 106.3 | S34 | S34-T36 WeakPolarHBondContact CB-OG1 3.18Å; S34-T36 PolarHBondContact O-N 3.44Å | ||
| 37 | S | 30 | Very low | 30.7 | Very low | 99 Ų | 99 | 152.2 Ų | 152.2 | 69% | 0.692 | 76% | 0.758 | S | S | * | * | trans | -161.3 | 51.5 | 159.5 | -175.4 | 0 | 0 | 0 | 0 | 110.1 | L35 | L35-S37 PolarHBondContact O-N 3Š| ||
| 38 | V | 32.8 | Very low | 30.9 | Very low | 124 Ų | 124 | 151 Ų | 151 | 75% | 0.752 | 76% | 0.762 | S | S | * | * | trans | -94.4 | 101.3 | 147.9 | -173.8 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 39 | K | 30.7 | Very low | 30.9 | Very low | 171 Ų | 171 | 153.2 Ų | 153.2 | 74% | 0.743 | 76% | 0.764 | S | S | * | * | trans | -50.1 | 143.9 | 170 | -72.7 | 175.9 | 178 | 177.6 | 0 | 108.7 | F41 | K39-F41 PolarHBondContact O-N 3.44Š| ||
| 40 | P | 28.7 | Very low | 31.4 | Very low | 115 Ų | 115 | 150.9 Ų | 150.9 | 75% | 0.747 | 76% | 0.764 | S | S | * | * | trans | -55.2 | 120.5 | -177.8 | 22.6 | -31.5 | 0 | 0 | 0 | 108.9 | V42 | P40-V42 VanDerWaalsContact C-N 3.3Å; P40-V42 PolarHBondContact O-N 2.94Å | ||
| 41 | F | 30.6 | Very low | 31.4 | Very low | 170 Ų | 170 | 151.8 Ų | 151.8 | 75% | 0.746 | 77% | 0.77 | S | S | * | * | trans | -66.3 | 94.4 | 174.7 | -173.7 | -95.3 | 0 | 0 | 0 | 107.5 | K39 Y43 | K39-F41 PolarHBondContact O-N 3.44Å; F41-Y43 HydrophobicContact CD1-CD2 4.15Å; F41-Y43 HydrophobicContact CD1-CE2 4.31Å; F41-Y43 HydrophobicContact CE1-CD2 4.44Å; F41-Y43 PolarHBondContact O-N 3.02Å | ||
| 42 | V | 28.7 | Very low | 31.8 | Very low | 104 Ų | 104 | 145.9 Ų | 145.9 | 63% | 0.63 | 77% | 0.767 | S | S | * | * | trans | -68.5 | 110.7 | 170.9 | 176.6 | 0 | 0 | 0 | 0 | 106.5 | P40 H44 | P40-V42 VanDerWaalsContact C-N 3.3Å; P40-V42 PolarHBondContact O-N 2.94Å; V42-H44 PolarHBondContact O-N 3.42Å | ||
| 43 | Y | 25.8 | Very low | 31.9 | Very low | 192 Ų | 192 | 139.3 Ų | 139.3 | 75% | 0.753 | 76% | 0.755 | S | S | * | * | trans | -57.3 | 109.3 | 171.7 | -94.4 | -99.3 | 0 | 0 | 0 | 109.3 | F41 P45 | F41-Y43 HydrophobicContact CD1-CD2 4.15Å; F41-Y43 HydrophobicContact CD1-CE2 4.31Å; F41-Y43 HydrophobicContact CE1-CD2 4.44Å; F41-Y43 PolarHBondContact O-N 3.02Å; Y43-P45 WeakPolarHBondContact O-CD 3.45Å | ||
| 44 | H | 31.4 | Very low | 31.9 | Very low | 168 Ų | 168 | 137.7 Ų | 137.7 | 78% | 0.778 | 76% | 0.756 | S | S | * | * | trans | -97.4 | 107 | 154.6 | -85.2 | -64.9 | 0 | 0 | 0 | 107.8 | V42 K46 | V42-H44 PolarHBondContact O-N 3.42Å; H44-K46 PolarHBondContact O-N 2.87Å | ||
| 45 | P | 41.1 | Very low | 32 | Very low | 106 Ų | 106 | 142.4 Ų | 142.4 | 69% | 0.688 | 76% | 0.761 | S | S | * | * | trans | -78.9 | 94.5 | 176.9 | 31.1 | -28.6 | 0 | 0 | 0 | 107.2 | Y43 | Y43-P45 WeakPolarHBondContact O-CD 3.45Š| ||
| 46 | K | 32 | Very low | 32 | Very low | 188 Ų | 188 | 140.9 Ų | 140.9 | 82% | 0.817 | 76% | 0.76 | S | S | * | * | trans | -164.9 | 114.5 | 157.3 | -100.9 | 146.9 | -167.2 | -167.6 | 0 | 110.1 | H44 | H44-K46 PolarHBondContact O-N 2.87Š| ||
| 47 | T | 35 | Very low | 32 | Very low | 128 Ų | 128 | 141.4 Ų | 141.4 | 79% | 0.785 | 76% | 0.763 | S | S | * | * | trans | 63.8 | 85.7 | 149.6 | 62.1 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 48 | Q | 31.7 | Very low | 32.2 | Very low | 195 Ų | 195 | 141.6 Ų | 141.6 | 91% | 0.911 | 76% | 0.762 | S | S | * | * | trans | -164 | 90.2 | 130.9 | -103.7 | 166.3 | 19.1 | 0 | 0 | 107.8 | ||||
| 49 | K | 31.6 | Very low | 32.2 | Very low | 197 Ų | 197 | 141.7 Ų | 141.7 | 86% | 0.857 | 77% | 0.765 | S | S | * | * | trans | -61.8 | 128.5 | 163.7 | -102 | -178.3 | 173.3 | -177.7 | 0 | 106.9 | T51 | K49-T51 PolarHBondContact O-N 3.25Å; K49-T51 VanDerWaalsContact O-N 3.07Å | ||
| 50 | P | 37.2 | Very low | 32.3 | Very low | 124 Ų | 124 | 140.4 Ų | 140.4 | 81% | 0.805 | 77% | 0.771 | S | S | * | * | trans | -67.3 | 108.3 | 169.1 | 24.8 | -28.8 | 0 | 0 | 0 | 108.5 | A52 | P50-A52 PolarHBondContact O-N 2.87Š| ||
| 51 | T | 34.4 | Very low | 32.4 | Very low | 135 Ų | 135 | 143.7 Ų | 143.7 | 83% | 0.828 | 77% | 0.774 | S | S | * | * | trans | -67.9 | 95 | 170.3 | -57.6 | 0 | 0 | 0 | 0 | 108.3 | K49 S53 | K49-T51 PolarHBondContact O-N 3.25Å; K49-T51 VanDerWaalsContact O-N 3.07Å; T51-S53 PolarHBondContact O-N 3.26Å | ||
| 52 | A | 35.3 | Very low | 32.6 | Very low | 88 Ų | 88 | 141.5 Ų | 141.5 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | trans | -80.5 | 103.7 | 165.4 | 0 | 0 | 0 | 0 | 0 | 108 | P50 V54 | P50-A52 PolarHBondContact O-N 2.87Å; A52-V54 PolarHBondContact O-N 3.21Å | ||
| 53 | S | 33.3 | Very low | 32.8 | Very low | 86 Ų | 86 | 144.3 Ų | 144.3 | 60% | 0.601 | 79% | 0.788 | S | S | * | * | trans | -76.5 | 109.8 | 170.5 | 67 | 0 | 0 | 0 | 0 | 109.2 | T51 | T51-S53 PolarHBondContact O-N 3.26Š| ||
| 54 | V | 27.7 | Very low | 32.9 | Very low | 130 Ų | 130 | 140.2 Ų | 140.2 | 79% | 0.788 | 79% | 0.787 | S | S | * | * | trans | -89.8 | 110.2 | 170.5 | 179.8 | 0 | 0 | 0 | 0 | 107.6 | A52 | A52-V54 PolarHBondContact O-N 3.21Š| ||
| 55 | Y | 31.5 | Very low | 32.6 | Very low | 194 Ų | 194 | 136.8 Ų | 136.8 | 76% | 0.761 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 124 | 169.1 | -77.4 | -85 | 0 | 0 | 0 | 109.1 | T57 | Y55-T57 PolarHBondContact O-N 3.38Š|
| 56 | P | 29.3 | Very low | 32.2 | Very low | 120 Ų | 120 | 138.1 Ų | 138.1 | 78% | 0.779 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 122 | 179.1 | -13.3 | 27.4 | 0 | 0 | 0 | 110.4 | ||
| 57 | T | 32.9 | Very low | 31.8 | Very low | 136 Ų | 136 | 136.7 Ų | 136.7 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -88.5 | 126.4 | 172.8 | -44.3 | 0 | 0 | 0 | 0 | 109 | Y55 | Y55-T57 PolarHBondContact O-N 3.38Š|
| 58 | P | 35.6 | Very low | 31.3 | Very low | 102 Ų | 102 | 136.7 Ų | 136.7 | 66% | 0.662 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 157.7 | -176.2 | 26.6 | -32.1 | 0 | 0 | 0 | 113.6 | ||
| 59 | P | 30.9 | Very low | 30.9 | Very low | 127 Ų | 127 | 131.3 Ų | 131.3 | 83% | 0.825 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 125.5 | -163.2 | 30.2 | -33.6 | 0 | 0 | 0 | 113 | ||
| 60 | V | 34.5 | Very low | 30.8 | Very low | 143 Ų | 143 | 130.9 Ų | 130.9 | 87% | 0.867 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 121 | 173.7 | 176.4 | 0 | 0 | 0 | 0 | 109.5 | ||
| 61 | K | 29.2 | Very low | 30.3 | Very low | 185 Ų | 185 | 129.9 Ų | 129.9 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 147.7 | 171 | -72.6 | -177.5 | 178.8 | 179.8 | 0 | 110.9 | ||
| 62 | P | 35 | Very low | 30.7 | Very low | 123 Ų | 123 | 128.9 Ų | 128.9 | 80% | 0.799 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 128.7 | -167 | 32.8 | -31.8 | 0 | 0 | 0 | 111.8 | ||
| 63 | N | 32.6 | Very low | 30.7 | Very low | 164 Ų | 164 | 133.1 Ų | 133.1 | 88% | 0.877 | 77% | 0.767 | S | S | * | * | trans | -105.5 | 123.4 | 165.4 | -75.7 | -6.7 | 0 | 0 | 0 | 109.8 | ||||
| 64 | S | 28.1 | Very low | 30.4 | Very low | 105 Ų | 105 | 139.6 Ų | 139.6 | 73% | 0.734 | 78% | 0.778 | S | S | * | * | trans | -73.8 | 151.7 | 174.8 | 49.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 65 | S | 26.1 | Very low | 30.4 | Very low | 97 Ų | 97 | 143 Ų | 143 | 68% | 0.678 | 78% | 0.783 | S | S | * | * | trans | 68.7 | 110.6 | 148.3 | 69.6 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 66 | T | 31.7 | Very low | 30.2 | Very low | 133 Ų | 133 | 137.7 Ų | 137.7 | 82% | 0.816 | 78% | 0.779 | S | S | * | * | trans | -163.6 | 96.7 | 133.3 | 5.9 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 67 | H | 25 | Very low | 30.3 | Very low | 158 Ų | 158 | 138.9 Ų | 138.9 | 73% | 0.731 | 78% | 0.779 | S | S | * | * | 69.6 | 117.2 | 104.7 | -78.2 | -75.6 | 0 | 0 | 0 | 116.4 | |||||
| 68 | T | 23.7 | Very low | 30.5 | Very low | 128 Ų | 128 | 142 Ų | 142 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | trans | 68.8 | 133.2 | 139.8 | 50.6 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 69 | S | 24 | Very low | 30.4 | Very low | 82 Ų | 82 | 146.5 Ų | 146.5 | 57% | 0.573 | 79% | 0.793 | S | S | * | * | cis | 178.7 | 167.9 | 34.7 | 49.5 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 70 | F | 28.4 | Very low | 31 | Very low | 189 Ų | 189 | 144.1 Ų | 144.1 | 83% | 0.829 | 78% | 0.784 | S | S | * | * | trans | 68.3 | 145.4 | 156.6 | -56.9 | -65 | 0 | 0 | 0 | 119 | ||||
| 71 | S | 27.1 | Very low | 31.5 | Very low | 103 Ų | 103 | 144.2 Ų | 144.2 | 72% | 0.72 | 78% | 0.775 | S | S | * | * | cis | 176.4 | 160.2 | -27.2 | -98.8 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 72 | P | 41.9 | Very low | 32.5 | Very low | 113 Ų | 113 | 140.4 Ų | 140.4 | 73% | 0.734 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -100.3 | 149.2 | -152.9 | 36.5 | -32.1 | 0 | 0 | 0 | 115.1 | ||
| 73 | I | 36.3 | Very low | 33.3 | Very low | 178 Ų | 178 | 140.1 Ų | 140.1 | 91% | 0.913 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -98.9 | 126.8 | 167.5 | -66.9 | 174.3 | 0 | 0 | 0 | 109.5 | ||
| 74 | R | 26.1 | Very low | 34.5 | Very low | 222 Ų | 222 | 136.7 Ų | 136.7 | 84% | 0.838 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -95.8 | 162.9 | 177.6 | -72.1 | -178.8 | 170.1 | 179 | -2.8 | 111.6 | ||
| 75 | K | 28 | Very low | 36.1 | Very low | 201 Ų | 201 | 136.1 Ų | 136.1 | 87% | 0.874 | 73% | 0.729 | S | S | * | * | trans | 106.2 | 104.8 | 158.5 | -60.8 | -169.9 | 178.2 | -173.2 | 0 | 113.6 | ||||
| 76 | A | 28.4 | Very low | 38 | Very low | 83 Ų | 83 | 137 Ų | 137 | 69% | 0.686 | 72% | 0.723 | S | S | * | * | 84.2 | 107.1 | 72.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 77 | D | 31.7 | Very low | 39.9 | Very low | 144 Ų | 144 | 133.7 Ų | 133.7 | 77% | 0.77 | 70% | 0.702 | S | S | * | * | 172.3 | 117.8 | 110 | -84.4 | -33.3 | 0 | 0 | 0 | 112.6 | |||||
| 78 | K | 35.4 | Very low | 42.3 | Very low | 203 Ų | 203 | 130.4 Ų | 130.4 | 88% | 0.883 | 69% | 0.689 | S | S | * | * | trans | 24.2 | 90.5 | 142.7 | -55.1 | 177.6 | -174.6 | 176.8 | 0 | 118.1 | ||||
| 79 | E | 34.2 | Very low | 44.9 | Very low | 196 Ų | 196 | 129 Ų | 129 | 92% | 0.916 | 68% | 0.676 | S | S | * | * | trans | -122.7 | 147.8 | 154.6 | -112.5 | 170.7 | 175.6 | 0 | 0 | 110.2 | ||||
| 80 | A | 43.8 | Very low | 47.4 | Very low | 77 Ų | 77 | 130.7 Ų | 130.7 | 64% | 0.636 | 67% | 0.673 | S | S | * | * | trans | -65.1 | 139.2 | -148 | 0 | 0 | 0 | 0 | 0 | 116.1 | T82 | A80-T82 PolarHBondContact O-N 3.01Š| ||
| 81 | Q | 43.8 | Very low | 49.7 | Very low | 144 Ų | 144 | 125.8 Ų | 125.8 | 67% | 0.673 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.4 | 12.9 | 174.8 | -168.4 | 79.1 | 15.2 | 0 | 0 | 117 | ||
| 82 | T | 51.3 | Low | 52.2 | Low | 106 Ų | 106 | 125 Ų | 125 | 65% | 0.65 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -87.4 | -27.5 | -177.1 | 56.4 | 0 | 0 | 0 | 0 | 113.7 | A80 N85 H86 | A80-T82 PolarHBondContact O-N 3.01Å; T82-N85 PolarHBondContact O-N 2.91Å; T82-H86 PolarHBondContact O-N 3.43Å |
| 83 | D | 52 | Low | 54.1 | Low | 116 Ų | 116 | 124.4 Ų | 124.4 | 62% | 0.62 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -64.7 | -46.4 | -179.4 | -161.3 | 9 | 0 | 0 | 0 | 110.7 | N85 H86 T87 | D83-N85 VanDerWaalsContact C-N 3.27Å; D83-N85 PolarHBondContact O-N 3.28Å; D83-H86 PolarHBondContact O-N 3.03Å; D83-H86 VanDerWaalsContact O-N 3.09Å; D83-T87 PolarHBondContact O-N 3.43Å; D83-T87 PolarHBondContact O-OG1 3.24Å |
| 84 | N | 57.5 | Low | 56.1 | Low | 92 Ų | 92 | 119.8 Ų | 119.8 | 49% | 0.492 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -58.2 | -36 | 176.6 | -71.9 | -4.5 | 0 | 0 | 0 | 113 | I88 | N84-I88 VanDerWaalsContact O-CB 3.27Å; N84-I88 WeakPolarHBondContact O-CB 3.49Å; N84-I88 VanDerWaalsContact O-CD1 3.3Å; N84-I88 WeakPolarHBondContact O-CD1 3.35Å; N84-I88 WeakPolarHBondContact O-CG1 3.2Å; N84-I88 PolarHBondContact O-N 3.09Å |
| 85 | N | 61 | Low | 58.8 | Low | 93 Ų | 93 | 113.7 Ų | 113.7 | 50% | 0.497 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -68.5 | -37.8 | 179.4 | -77.6 | -4.6 | 0 | 0 | 0 | 111.8 | T82 D83 I89 | T82-N85 PolarHBondContact O-N 2.91Å; D83-N85 VanDerWaalsContact C-N 3.27Å; D83-N85 PolarHBondContact O-N 3.28Å; N85-I89 VanDerWaalsContact O-CG1 3.27Å; N85-I89 WeakPolarHBondContact O-CG1 3.48Å; N85-I89 PolarHBondContact O-N 3.4Å |
| 86 | H | 67.1 | Low | 61.5 | Low | 116 Ų | 116 | 107.4 Ų | 107.4 | 54% | 0.537 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -72.2 | -39.7 | 177.6 | -148.7 | 60.9 | 0 | 0 | 0 | 111.4 | T82 D83 I89 F90 | T82-H86 PolarHBondContact O-N 3.43Å; D83-H86 PolarHBondContact O-N 3.03Å; D83-H86 VanDerWaalsContact O-N 3.09Å; H86-I89 PolarHBondContact O-N 3.1Å; H86-F90 AromaticContact CD2-CD2 3.92Å; H86-F90 AromaticContact CD2-CE2 3.64Å; H86-F90 AromaticContact NE2-CE2 3.46Å; H86-F90 WeakPolarHBondContact NE2-CE2 3.34Å; H86-F90 WeakPolarHBondContact O-CD2 3.46Å; H86-F90 PolarHBondContact O-N 2.94Å |
| 87 | T | 71.6 | Confident | 64 | Low | 64 Ų | 64 | 109.7 Ų | 109.7 | 39% | 0.393 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.3 | -40.2 | 173.2 | -41.1 | 0 | 0 | 0 | 0 | 112.1 | D83 F90 N91 | D83-T87 PolarHBondContact O-N 3.43Å; D83-T87 PolarHBondContact O-OG1 3.24Å; T87-F90 PolarHBondContact O-N 3.43Å; T87-N91 WeakPolarHBondContact O-CB 3.26Å; T87-N91 PolarHBondContact O-N 2.95Å; T87-N91 PolarHBondContact O-ND2 3.03Å |
| 88 | I | 75.8 | Confident | 66.2 | Low | 88 Ų | 88 | 105 Ų | 105 | 45% | 0.451 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.2 | -42.4 | 176.5 | -71.9 | 164.5 | 0 | 0 | 0 | 110.4 | N84 N91 I92 | N84-I88 VanDerWaalsContact O-CB 3.27Å; N84-I88 WeakPolarHBondContact O-CB 3.49Å; N84-I88 VanDerWaalsContact O-CD1 3.3Å; N84-I88 WeakPolarHBondContact O-CD1 3.35Å; N84-I88 WeakPolarHBondContact O-CG1 3.2Å; N84-I88 PolarHBondContact O-N 3.09Å; I88-N91 PolarHBondContact O-N 3.22Å; I88-I92 HydrophobicContact CG2-CD1 3.59Å; I88-I92 HydrophobicContact CG2-CG1 4.3Å; I88-I92 WeakPolarHBondContact O-CB 3.27Å; I88-I92 WeakPolarHBondContact O-CD1 3.48Å; I88-I92 WeakPolarHBondContact O-CG1 3.42Å; I88-I92 PolarHBondContact O-N 2.8Å |
| 89 | I | 77.1 | Confident | 68.4 | Low | 100 Ų | 100 | 101.1 Ų | 101.1 | 51% | 0.513 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.2 | -46.2 | 177.3 | -68.8 | 167.8 | 0 | 0 | 0 | 110.9 | N85 H86 N91 I92 E93 | N85-I89 VanDerWaalsContact O-CG1 3.27Å; N85-I89 WeakPolarHBondContact O-CG1 3.48Å; N85-I89 PolarHBondContact O-N 3.4Å; H86-I89 PolarHBondContact O-N 3.1Å; I89-N91 PolarHBondContact O-N 3.43Å; I89-I92 PolarHBondContact O-N 3.14Å; I89-E93 WeakPolarHBondContact O-CB 3.28Å; I89-E93 PolarHBondContact O-N 3.09Å |
| 90 | F | 77.3 | Confident | 70.5 | Confident | 117 Ų | 117 | 99 Ų | 99 | 51% | 0.513 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.2 | -44.5 | 176.1 | -92.7 | -73.8 | 0 | 0 | 0 | 112.5 | H86 T87 I92 E93 D94 | H86-F90 AromaticContact CD2-CD2 3.92Å; H86-F90 AromaticContact CD2-CE2 3.64Å; H86-F90 AromaticContact NE2-CE2 3.46Å; H86-F90 WeakPolarHBondContact NE2-CE2 3.34Å; H86-F90 WeakPolarHBondContact O-CD2 3.46Å; H86-F90 PolarHBondContact O-N 2.94Å; T87-F90 PolarHBondContact O-N 3.43Å; F90-I92 VanDerWaalsContact C-N 3.32Å; F90-I92 PolarHBondContact O-N 3.45Å; F90-E93 WeakPolarHBondContact O-CB 3.47Å; F90-E93 PolarHBondContact O-N 2.9Å; F90-D94 WeakPolarHBondContact O-CB 3.47Å; F90-D94 PolarHBondContact O-N 3.11Å |
| 91 | N | 77 | Confident | 71.9 | Confident | 85 Ų | 85 | 99.9 Ų | 99.9 | 46% | 0.455 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.4 | -37.9 | 178 | -70.6 | -11.4 | 0 | 0 | 0 | 111.7 | T87 I88 I89 I95 | T87-N91 WeakPolarHBondContact O-CB 3.26Å; T87-N91 PolarHBondContact O-N 2.95Å; T87-N91 PolarHBondContact O-ND2 3.03Å; I88-N91 PolarHBondContact O-N 3.22Å; I89-N91 PolarHBondContact O-N 3.43Å; N91-I95 WeakPolarHBondContact O-CB 3.39Å; N91-I95 WeakPolarHBondContact O-CD1 3.45Å; N91-I95 WeakPolarHBondContact O-CG1 3.47Å; N91-I95 PolarHBondContact O-N 3.44Å |
| 92 | I | 79.8 | Confident | 73.3 | Confident | 87 Ų | 87 | 98.7 Ų | 98.7 | 45% | 0.446 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.6 | -43.6 | 174.4 | -69.4 | 166.8 | 0 | 0 | 0 | 110.4 | I88 I89 F90 D94 I95 I96 | I88-I92 HydrophobicContact CG2-CD1 3.59Å; I88-I92 HydrophobicContact CG2-CG1 4.3Å; I88-I92 WeakPolarHBondContact O-CB 3.27Å; I88-I92 WeakPolarHBondContact O-CD1 3.48Å; I88-I92 WeakPolarHBondContact O-CG1 3.42Å; I88-I92 PolarHBondContact O-N 2.8Å; I89-I92 PolarHBondContact O-N 3.14Å; F90-I92 VanDerWaalsContact C-N 3.32Å; F90-I92 PolarHBondContact O-N 3.45Å; I92-D94 VanDerWaalsContact C-N 3.34Å; I92-D94 PolarHBondContact O-N 3Å; I92-I95 PolarHBondContact O-N 2.86Å; I92-I96 HydrophobicContact CG2-CD1 3.68Å; I92-I96 HydrophobicContact CG2-CG1 4.31Å; I92-I96 WeakPolarHBondContact O-CB 3.26Å; I92-I96 WeakPolarHBondContact O-CG1 3.45Å; I92-I96 PolarHBondContact O-N 3.37Å |
| 93 | E | 80.9 | Confident | 74.3 | Confident | 101 Ų | 101 | 96.2 Ų | 96.2 | 47% | 0.472 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.6 | -42.7 | 177 | -166.7 | 90.5 | -151.9 | 0 | 0 | 111.3 | I89 F90 I96 R97 | I89-E93 WeakPolarHBondContact O-CB 3.28Å; I89-E93 PolarHBondContact O-N 3.09Å; F90-E93 WeakPolarHBondContact O-CB 3.47Å; F90-E93 PolarHBondContact O-N 2.9Å; E93-I96 PolarHBondContact O-N 3.4Å; E93-R97 VanDerWaalsContact O-CB 3.27Å; E93-R97 WeakPolarHBondContact O-CB 3.44Å; E93-R97 PolarHBondContact O-N 2.87Å |
| 94 | D | 78.7 | Confident | 74.8 | Confident | 80 Ų | 80 | 93.5 Ų | 93.5 | 43% | 0.428 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -69.9 | -38.6 | 177.2 | -78.4 | -19 | 0 | 0 | 0 | 112.2 | F90 I92 R97 A98 | F90-D94 WeakPolarHBondContact O-CB 3.47Å; F90-D94 PolarHBondContact O-N 3.11Å; I92-D94 VanDerWaalsContact C-N 3.34Å; I92-D94 PolarHBondContact O-N 3Å; D94-R97 PolarHBondContact O-N 3.33Å; D94-A98 VanDerWaalsContact O-CB 3.25Å; D94-A98 WeakPolarHBondContact O-CB 3.36Å; D94-A98 PolarHBondContact O-N 2.86Å |
| 95 | I | 83.1 | Confident | 74.6 | Confident | 94 Ų | 94 | 93.4 Ų | 93.4 | 48% | 0.482 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.8 | -44.1 | 172.1 | -70.8 | 163.6 | 0 | 0 | 0 | 110.3 | N91 I92 R97 A98 Q99 | N91-I95 WeakPolarHBondContact O-CB 3.39Å; N91-I95 WeakPolarHBondContact O-CD1 3.45Å; N91-I95 WeakPolarHBondContact O-CG1 3.47Å; N91-I95 PolarHBondContact O-N 3.44Å; I92-I95 PolarHBondContact O-N 2.86Å; I95-R97 VanDerWaalsContact C-N 3.33Å; I95-R97 PolarHBondContact O-N 3.26Å; I95-A98 PolarHBondContact O-N 3.04Å; I95-Q99 HydrophobicContact CG2-CG 4.35Å; I95-Q99 WeakPolarHBondContact O-CB 3.46Å; I95-Q99 VanDerWaalsContact O-CG 3.25Å; I95-Q99 WeakPolarHBondContact O-CG 3.29Å; I95-Q99 PolarHBondContact O-N 3.41Å |
| 96 | I | 84.5 | Confident | 73.9 | Confident | 70 Ų | 70 | 93.6 Ų | 93.6 | 36% | 0.359 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.4 | -39.7 | 176.8 | -69.9 | 168.6 | 0 | 0 | 0 | 110.4 | I92 E93 Q99 R100 | I92-I96 HydrophobicContact CG2-CD1 3.68Å; I92-I96 HydrophobicContact CG2-CG1 4.31Å; I92-I96 WeakPolarHBondContact O-CB 3.26Å; I92-I96 WeakPolarHBondContact O-CG1 3.45Å; I92-I96 PolarHBondContact O-N 3.37Å; E93-I96 PolarHBondContact O-N 3.4Å; I96-Q99 PolarHBondContact O-N 2.87Å; I96-R100 VanDerWaalsContact O-CB 3.3Å; I96-R100 WeakPolarHBondContact O-CB 3.39Å; I96-R100 PolarHBondContact O-N 2.93Å |
| 97 | R | 81.4 | Confident | 73 | Confident | 130 Ų | 130 | 95.9 Ų | 95.9 | 49% | 0.491 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.9 | -43.9 | 176.2 | -169.9 | 179 | -59 | 176.5 | 4.7 | 111.4 | E93 D94 I95 R100 N101 | E93-R97 VanDerWaalsContact O-CB 3.27Å; E93-R97 WeakPolarHBondContact O-CB 3.44Å; E93-R97 PolarHBondContact O-N 2.87Å; D94-R97 PolarHBondContact O-N 3.33Å; I95-R97 VanDerWaalsContact C-N 3.33Å; I95-R97 PolarHBondContact O-N 3.26Å; R97-R100 PolarHBondContact O-N 3.47Å; R97-N101 WeakPolarHBondContact O-CB 3.2Å; R97-N101 PolarHBondContact O-N 3.35Å; R97-N101 PolarHBondContact O-ND2 3.23Å; R97-N101 PolarHBondContact O-OD1 3.17Å |
| 98 | A | 76.3 | Confident | 71.8 | Confident | 47 Ų | 47 | 99 Ų | 99 | 39% | 0.388 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.1 | -44.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | D94 I95 N101 L102 | D94-A98 VanDerWaalsContact O-CB 3.25Å; D94-A98 WeakPolarHBondContact O-CB 3.36Å; D94-A98 PolarHBondContact O-N 2.86Å; I95-A98 PolarHBondContact O-N 3.04Å; A98-N101 PolarHBondContact O-N 3.45Å; A98-L102 WeakPolarHBondContact O-CB 3.35Å; A98-L102 WeakPolarHBondContact O-CD1 3.48Å; A98-L102 PolarHBondContact O-N 2.98Å |
| 99 | Q | 81.3 | Confident | 70 | Confident | 121 Ų | 121 | 97.5 Ų | 97.5 | 57% | 0.565 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.2 | -40 | 175.6 | -75.7 | 178.3 | -5.2 | 0 | 0 | 112.1 | I95 I96 L102 A103 | I95-Q99 HydrophobicContact CG2-CG 4.35Å; I95-Q99 WeakPolarHBondContact O-CB 3.46Å; I95-Q99 VanDerWaalsContact O-CG 3.25Å; I95-Q99 WeakPolarHBondContact O-CG 3.29Å; I95-Q99 PolarHBondContact O-N 3.41Å; I96-Q99 PolarHBondContact O-N 2.87Å; Q99-L102 PolarHBondContact O-N 3.32Å; Q99-A103 VanDerWaalsContact O-CB 3.27Å; Q99-A103 WeakPolarHBondContact O-CB 3.49Å; Q99-A103 PolarHBondContact O-N 2.91Å |
| 100 | R | 78.6 | Confident | 68.2 | Low | 151 Ų | 151 | 99.4 Ų | 99.4 | 57% | 0.57 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -67.9 | -38.4 | 176 | -167.4 | -179.2 | -66.6 | 120.9 | -1.7 | 111.6 | I96 R97 A103 S104 | I96-R100 VanDerWaalsContact O-CB 3.3Å; I96-R100 WeakPolarHBondContact O-CB 3.39Å; I96-R100 PolarHBondContact O-N 2.93Å; R97-R100 PolarHBondContact O-N 3.47Å; R100-A103 PolarHBondContact O-N 3.12Å; R100-S104 VanDerWaalsContact O-CB 3.3Å; R100-S104 WeakPolarHBondContact O-CB 3.32Å; R100-S104 PolarHBondContact O-N 3.25Å; R100-S104 PolarHBondContact O-OG 3.44Å |
| 101 | N | 74.5 | Confident | 66.2 | Low | 95 Ų | 95 | 101.8 Ų | 101.8 | 51% | 0.508 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.3 | -44.7 | 173.9 | -70.9 | -13.2 | 0 | 0 | 0 | 110.6 | R97 A98 S104 T105 | R97-N101 WeakPolarHBondContact O-CB 3.2Å; R97-N101 PolarHBondContact O-N 3.35Å; R97-N101 PolarHBondContact O-ND2 3.23Å; R97-N101 PolarHBondContact O-OD1 3.17Å; A98-N101 PolarHBondContact O-N 3.45Å; N101-S104 PolarHBondContact O-N 2.71Å; N101-T105 VanDerWaalsContact O-CB 3.27Å; N101-T105 WeakPolarHBondContact O-CB 3.34Å; N101-T105 PolarHBondContact O-N 2.94Å; N101-T105 PolarHBondContact O-OG1 3.23Å |
| 102 | L | 71.9 | Confident | 64.5 | Low | 120 Ų | 120 | 104.5 Ų | 104.5 | 63% | 0.628 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -61.3 | -44.2 | 174.1 | -86.6 | 151.8 | 0 | 0 | 0 | 111.7 | A98 Q99 T105 N106 | A98-L102 WeakPolarHBondContact O-CB 3.35Å; A98-L102 WeakPolarHBondContact O-CD1 3.48Å; A98-L102 PolarHBondContact O-N 2.98Å; Q99-L102 PolarHBondContact O-N 3.32Å; L102-T105 CarbonylContact O-C 3.56Å; L102-T105 PolarHBondContact O-N 3.27Å; L102-N106 WeakPolarHBondContact O-CB 3.36Å; L102-N106 PolarHBondContact O-N 2.95Å |
| 103 | A | 72.2 | Confident | 62.7 | Low | 54 Ų | 54 | 104.3 Ų | 104.3 | 45% | 0.446 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66.3 | -39.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q99 R100 N106 Q107 | Q99-A103 VanDerWaalsContact O-CB 3.27Å; Q99-A103 WeakPolarHBondContact O-CB 3.49Å; Q99-A103 PolarHBondContact O-N 2.91Å; R100-A103 PolarHBondContact O-N 3.12Å; A103-N106 PolarHBondContact O-N 3.13Å; A103-Q107 WeakPolarHBondContact O-CB 3.06Å; A103-Q107 VanDerWaalsContact O-CG 3.24Å; A103-Q107 WeakPolarHBondContact O-CG 3.38Å; A103-Q107 PolarHBondContact O-N 2.94Å |
| 104 | S | 62.3 | Low | 61 | Low | 59 Ų | 59 | 104.3 Ų | 104.3 | 41% | 0.413 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -67.2 | -41.1 | 174.3 | -54.5 | 0 | 0 | 0 | 0 | 111.1 | R100 N101 N108 | R100-S104 VanDerWaalsContact O-CB 3.3Å; R100-S104 WeakPolarHBondContact O-CB 3.32Å; R100-S104 PolarHBondContact O-N 3.25Å; R100-S104 PolarHBondContact O-OG 3.44Å; N101-S104 PolarHBondContact O-N 2.71Å; S104-N108 VanDerWaalsContact O-CB 3.31Å; S104-N108 WeakPolarHBondContact O-CB 3.36Å; S104-N108 PolarHBondContact O-N 3.12Å; S104-N108 PolarHBondContact O-ND2 3.22Å |
| 105 | T | 53.8 | Low | 59.7 | Low | 90 Ų | 90 | 104 Ų | 104 | 55% | 0.552 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -67.2 | -35.8 | 173.7 | -60.8 | 0 | 0 | 0 | 0 | 111.1 | N101 L102 N108 S109 | N101-T105 VanDerWaalsContact O-CB 3.27Å; N101-T105 WeakPolarHBondContact O-CB 3.34Å; N101-T105 PolarHBondContact O-N 2.94Å; N101-T105 PolarHBondContact O-OG1 3.23Å; L102-T105 CarbonylContact O-C 3.56Å; L102-T105 PolarHBondContact O-N 3.27Å; T105-N108 CarbonylContact O-C 3.23Å; T105-N108 PolarHBondContact O-N 3.03Å; T105-S109 WeakPolarHBondContact O-CA 3.4Å; T105-S109 WeakPolarHBondContact O-CB 3.28Å; T105-S109 PolarHBondContact O-N 3.09Å |
| 106 | N | 46.3 | Very low | 58.3 | Low | 97 Ų | 97 | 104.9 Ų | 104.9 | 52% | 0.519 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -77.5 | -35.9 | -177.6 | -156.5 | 22.9 | 0 | 0 | 0 | 111.9 | L102 A103 N108 S109 L110 | L102-N106 WeakPolarHBondContact O-CB 3.36Å; L102-N106 PolarHBondContact O-N 2.95Å; A103-N106 PolarHBondContact O-N 3.13Å; N106-N108 VanDerWaalsContact C-N 3.32Å; N106-S109 PolarHBondContact O-N 3.48Å; N106-L110 WeakPolarHBondContact O-CB 3.39Å; N106-L110 WeakPolarHBondContact O-CD1 3.45Å; N106-L110 PolarHBondContact O-N 2.96Å; N106-L110 WeakPolarHBondContact OD1-CD1 3.41Å |
| 107 | Q | 48.4 | Very low | 57.1 | Low | 163 Ų | 163 | 103.4 Ų | 103.4 | 76% | 0.762 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.5 | -35.5 | 169.9 | -70.2 | -91.7 | -24.1 | 0 | 0 | 111.3 | A103 | A103-Q107 WeakPolarHBondContact O-CB 3.06Å; A103-Q107 VanDerWaalsContact O-CG 3.24Å; A103-Q107 WeakPolarHBondContact O-CG 3.38Å; A103-Q107 PolarHBondContact O-N 2.94Å |
| 108 | N | 46 | Very low | 56.5 | Low | 129 Ų | 129 | 103.8 Ų | 103.8 | 69% | 0.69 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -81.7 | -22.7 | 175.7 | -67.2 | -12.1 | 0 | 0 | 0 | 113.4 | S104 T105 N106 | S104-N108 VanDerWaalsContact O-CB 3.31Å; S104-N108 WeakPolarHBondContact O-CB 3.36Å; S104-N108 PolarHBondContact O-N 3.12Å; S104-N108 PolarHBondContact O-ND2 3.22Å; T105-N108 CarbonylContact O-C 3.23Å; T105-N108 PolarHBondContact O-N 3.03Å; N106-N108 VanDerWaalsContact C-N 3.32Å |
| 109 | S | 38.9 | Very low | 56.6 | Low | 57 Ų | 57 | 104.9 Ų | 104.9 | 40% | 0.399 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -95.7 | -15 | -176.4 | -173.4 | 0 | 0 | 0 | 0 | 113.8 | T105 N106 H111 | T105-S109 WeakPolarHBondContact O-CA 3.4Å; T105-S109 WeakPolarHBondContact O-CB 3.28Å; T105-S109 PolarHBondContact O-N 3.09Å; N106-S109 PolarHBondContact O-N 3.48Å; S109-H111 VanDerWaalsContact C-N 3.31Å; S109-H111 PolarHBondContact O-N 3.49Å |
| 110 | L | 39.6 | Very low | 56.5 | Low | 140 Ų | 140 | 103.5 Ų | 103.5 | 73% | 0.733 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -78.2 | -11.3 | 178.4 | -112.7 | 111.5 | 0 | 0 | 0 | 114.5 | N106 | N106-L110 WeakPolarHBondContact O-CB 3.39Å; N106-L110 WeakPolarHBondContact O-CD1 3.45Å; N106-L110 PolarHBondContact O-N 2.96Å; N106-L110 WeakPolarHBondContact OD1-CD1 3.41Å |
| 111 | H | 34.4 | Very low | 56.7 | Low | 167 Ų | 167 | 101.1 Ų | 101.1 | 77% | 0.773 | 57% | 0.57 | S | S | * | * | S | Bend | trans | -109.1 | -12 | -176.9 | -161.1 | -94.8 | 0 | 0 | 0 | 114.9 | S109 | S109-H111 VanDerWaalsContact C-N 3.31Å; S109-H111 PolarHBondContact O-N 3.49Å |
| 112 | L | 41.5 | Very low | 57.2 | Low | 143 Ų | 143 | 102.8 Ų | 102.8 | 75% | 0.749 | 57% | 0.573 | S | S | * | * | S | Bend | trans | -131.7 | 12.1 | -166.2 | -117.8 | 84.9 | 0 | 0 | 0 | 118.9 | ||
| 113 | S | 41.4 | Very low | 57.9 | Low | 82 Ų | 82 | 101.7 Ų | 101.7 | 57% | 0.573 | 56% | 0.564 | S | S | * | * | S | Bend | trans | -129.5 | 7.1 | -177.5 | 62.2 | 0 | 0 | 0 | 0 | 118 | ||
| 114 | S | 46 | Very low | 58.7 | Low | 102 Ų | 102 | 102 Ų | 102 | 71% | 0.713 | 56% | 0.563 | S | S | * | * | S | Bend | trans | -94.3 | -11.1 | 174.2 | 65.1 | 0 | 0 | 0 | 0 | 115 | ||
| 115 | S | 50.7 | Low | 59.9 | Low | 72 Ų | 72 | 105.1 Ų | 105.1 | 50% | 0.503 | 58% | 0.575 | S | S | . | * | S | Bend | trans | -90.4 | -40.9 | -179.7 | -157.4 | 0 | 0 | 0 | 0 | 112.4 | G117 K118 D119 | S115-G117 PolarHBondContact O-N 2.82Å; S115-K118 PolarHBondContact O-N 3.05Å; S115-K118 VanDerWaalsContact O-N 3.08Å; S115-D119 PolarHBondContact O-N 3Å; S115-D119 VanDerWaalsContact O-N 3.14Å; S115-D119 PolarHBondContact OG-OD2 3.46Å |
| 116 | D | 55.4 | Low | 61.7 | Low | 114 Ų | 114 | 106.3 Ų | 106.3 | 61% | 0.61 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -59.9 | -48.9 | -168.5 | -137.5 | 22.1 | 0 | 0 | 0 | 112.5 | K118 D119 D120 | D116-K118 VanDerWaalsContact C-N 3.28Å; D116-K118 PolarHBondContact O-N 2.78Å; D116-D119 PolarHBondContact O-N 3.39Å; D116-D119 VanDerWaalsContact O-N 3.11Å; D116-D120 PolarHBondContact O-N 2.97Å |
| 117 | G | 57.5 | Low | 63.8 | Low | 38 Ų | 38 | 107.2 Ų | 107.2 | 39% | 0.392 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -64.9 | -28.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | S115 D121 | S115-G117 PolarHBondContact O-N 2.82Å; G117-D121 WeakPolarHBondContact O-CB 3.34Å; G117-D121 PolarHBondContact O-N 3.24Å; G117-D121 VanDerWaalsContact O-N 3.07Å |
| 118 | K | 70.5 | Confident | 65.9 | Low | 138 Ų | 138 | 104.8 Ų | 104.8 | 60% | 0.6 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -75.2 | -30.5 | 176.1 | -73.6 | -176 | 177.4 | 171 | 0 | 112.1 | S115 D116 K122 | S115-K118 PolarHBondContact O-N 3.05Å; S115-K118 VanDerWaalsContact O-N 3.08Å; D116-K118 VanDerWaalsContact C-N 3.28Å; D116-K118 PolarHBondContact O-N 2.78Å; K118-K122 WeakPolarHBondContact O-CB 3.41Å; K118-K122 VanDerWaalsContact O-CG 3.24Å; K118-K122 WeakPolarHBondContact O-CG 3.45Å; K118-K122 PolarHBondContact O-N 2.85Å |
| 119 | D | 77.2 | Confident | 68.1 | Low | 71 Ų | 71 | 103.5 Ų | 103.5 | 38% | 0.38 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -78.9 | -37.4 | 179.7 | -67.3 | -30.6 | 0 | 0 | 0 | 110.2 | S115 D116 K122 E123 | S115-D119 PolarHBondContact O-N 3Å; S115-D119 VanDerWaalsContact O-N 3.14Å; S115-D119 PolarHBondContact OG-OD2 3.46Å; D116-D119 PolarHBondContact O-N 3.39Å; D116-D119 VanDerWaalsContact O-N 3.11Å; D119-K122 PolarHBondContact O-N 3.05Å; D119-K122 IonicContact OD1-NZ 3.06Å; D119-E123 WeakPolarHBondContact O-CB 3.43Å; D119-E123 PolarHBondContact O-N 3.28Å |
| 120 | D | 79.1 | Confident | 70.6 | Confident | 92 Ų | 92 | 105.7 Ų | 105.7 | 49% | 0.492 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -59.8 | -45 | 168.2 | -71.2 | -27.6 | 0 | 0 | 0 | 112.3 | D116 E123 S124 | D116-D120 PolarHBondContact O-N 2.97Å; D120-E123 PolarHBondContact O-N 3.18Å; D120-S124 WeakPolarHBondContact O-CB 3.42Å; D120-S124 PolarHBondContact O-N 3.38Å; D120-S124 PolarHBondContact O-OG 2.91Å; D120-S124 VanDerWaalsContact O-OG 3.05Å |
| 121 | D | 83.6 | Confident | 73 | Confident | 101 Ų | 101 | 103.1 Ų | 103.1 | 54% | 0.54 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.4 | -42.1 | 176.9 | -74.9 | -17.5 | 0 | 0 | 0 | 111.5 | G117 S124 L125 | G117-D121 WeakPolarHBondContact O-CB 3.34Å; G117-D121 PolarHBondContact O-N 3.24Å; G117-D121 VanDerWaalsContact O-N 3.07Å; D121-S124 WeakPolarHBondContact CA-OG 3.47Å; D121-S124 PolarHBondContact O-OG 3.2Å; D121-L125 WeakPolarHBondContact O-CB 3.34Å; D121-L125 VanDerWaalsContact O-CG 3.23Å; D121-L125 WeakPolarHBondContact O-CG 3.49Å; D121-L125 PolarHBondContact O-N 3.35Å |
| 122 | K | 85.5 | Confident | 75.8 | Confident | 130 Ų | 130 | 99.5 Ų | 99.5 | 57% | 0.565 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -65.7 | -42.7 | 175.5 | -78.9 | 173.6 | -171.2 | 164.5 | 0 | 111.9 | K118 D119 S124 L125 Q126 | K118-K122 WeakPolarHBondContact O-CB 3.41Å; K118-K122 VanDerWaalsContact O-CG 3.24Å; K118-K122 WeakPolarHBondContact O-CG 3.45Å; K118-K122 PolarHBondContact O-N 2.85Å; D119-K122 PolarHBondContact O-N 3.05Å; D119-K122 IonicContact OD1-NZ 3.06Å; K122-S124 VanDerWaalsContact C-N 3.35Å; K122-L125 PolarHBondContact O-N 3.15Å; K122-Q126 WeakPolarHBondContact O-CB 3.37Å; K122-Q126 PolarHBondContact O-N 2.92Å |
| 123 | E | 86.3 | Confident | 78.2 | Confident | 96 Ų | 96 | 97.8 Ų | 97.8 | 45% | 0.449 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.7 | -41.9 | 179.7 | -168.3 | -173.6 | 159.1 | 0 | 0 | 110.7 | D119 D120 Q126 K127 | D119-E123 WeakPolarHBondContact O-CB 3.43Å; D119-E123 PolarHBondContact O-N 3.28Å; D120-E123 PolarHBondContact O-N 3.18Å; E123-Q126 PolarHBondContact O-N 2.86Å; E123-K127 HydrophobicContact CG-CD 4.45Å; E123-K127 VanDerWaalsContact O-CG 3.29Å; E123-K127 WeakPolarHBondContact O-CG 3.33Å; E123-K127 PolarHBondContact O-N 3.05Å; E123-K127 WeakPolarHBondContact OE1-CE 3.42Å; E123-K127 IonicContact OE1-NZ 3.65Å; E123-K127 PolarHBondContact OE1-NZ 3.41Å |
| 124 | S | 87.5 | Confident | 80.6 | Confident | 61 Ų | 61 | 101.4 Ų | 101.4 | 43% | 0.427 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.4 | -42.3 | 175.6 | 61.1 | 0 | 0 | 0 | 0 | 112.5 | D120 D121 K122 Q126 K127 E128 | D120-S124 WeakPolarHBondContact O-CB 3.42Å; D120-S124 PolarHBondContact O-N 3.38Å; D120-S124 PolarHBondContact O-OG 2.91Å; D120-S124 VanDerWaalsContact O-OG 3.05Å; D121-S124 WeakPolarHBondContact CA-OG 3.47Å; D121-S124 PolarHBondContact O-OG 3.2Å; K122-S124 VanDerWaalsContact C-N 3.35Å; S124-Q126 PolarHBondContact O-N 3.09Å; S124-K127 PolarHBondContact O-N 2.62Å; S124-E128 PolarHBondContact O-N 3.22Å |
| 125 | L | 88.6 | Confident | 82.7 | Confident | 125 Ų | 125 | 100.1 Ų | 100.1 | 65% | 0.654 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65 | -37.7 | 174.5 | -73.4 | 172.6 | 0 | 0 | 0 | 112.8 | D121 K122 E128 L129 | D121-L125 WeakPolarHBondContact O-CB 3.34Å; D121-L125 VanDerWaalsContact O-CG 3.23Å; D121-L125 WeakPolarHBondContact O-CG 3.49Å; D121-L125 PolarHBondContact O-N 3.35Å; K122-L125 PolarHBondContact O-N 3.15Å; L125-E128 PolarHBondContact O-N 2.98Å; L125-L129 PolarHBondContact O-N 3.46Å |
| 126 | Q | 91.1 | Very high | 84.8 | Confident | 115 Ų | 115 | 100 Ų | 100 | 54% | 0.537 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.4 | -45.2 | 175.8 | -177.8 | 176.4 | -15.9 | 0 | 0 | 111 | K122 E123 S124 E128 L129 E130 | K122-Q126 WeakPolarHBondContact O-CB 3.37Å; K122-Q126 PolarHBondContact O-N 2.92Å; E123-Q126 PolarHBondContact O-N 2.86Å; S124-Q126 PolarHBondContact O-N 3.09Å; Q126-E128 VanDerWaalsContact C-N 3.3Å; Q126-E128 PolarHBondContact O-N 2.88Å; Q126-L129 PolarHBondContact O-N 3.23Å; Q126-E130 PolarHBondContact NE2-OE1 2.97Å; Q126-E130 WeakPolarHBondContact O-CG 3.28Å; Q126-E130 PolarHBondContact O-N 2.87Å |
| 127 | K | 90.5 | Very high | 86.4 | Confident | 116 Ų | 116 | 97.6 Ų | 97.6 | 50% | 0.504 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -57.7 | -42.9 | 174.3 | -74.4 | 169 | -177.1 | 163.9 | 0 | 111.6 | E123 S124 E130 L131 | E123-K127 HydrophobicContact CG-CD 4.45Å; E123-K127 VanDerWaalsContact O-CG 3.29Å; E123-K127 WeakPolarHBondContact O-CG 3.33Å; E123-K127 PolarHBondContact O-N 3.05Å; E123-K127 WeakPolarHBondContact OE1-CE 3.42Å; E123-K127 IonicContact OE1-NZ 3.65Å; E123-K127 PolarHBondContact OE1-NZ 3.41Å; S124-K127 PolarHBondContact O-N 2.62Å; K127-E130 PolarHBondContact O-N 3.03Å; K127-L131 WeakPolarHBondContact O-CB 3.3Å; K127-L131 PolarHBondContact O-N 2.72Å |
| 128 | E | 91.6 | Very high | 87.8 | Confident | 112 Ų | 112 | 98.5 Ų | 98.5 | 52% | 0.523 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.8 | -40.7 | 177.5 | -170.4 | 59.8 | -151.9 | 0 | 0 | 111.9 | S124 L125 Q126 L131 Q132 | S124-E128 PolarHBondContact O-N 3.22Å; L125-E128 PolarHBondContact O-N 2.98Å; Q126-E128 VanDerWaalsContact C-N 3.3Å; Q126-E128 PolarHBondContact O-N 2.88Å; E128-L131 PolarHBondContact O-N 3.37Å; E128-Q132 WeakPolarHBondContact O-CB 3.43Å; E128-Q132 PolarHBondContact O-N 2.98Å |
| 129 | L | 93.3 | Very high | 88.6 | Confident | 101 Ų | 101 | 95.6 Ų | 95.6 | 53% | 0.529 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -65.4 | -43.7 | 175.8 | -179.4 | 64 | 0 | 0 | 0 | 112.2 | L125 Q126 L131 Q132 Q133 | L125-L129 PolarHBondContact O-N 3.46Å; Q126-L129 PolarHBondContact O-N 3.23Å; L129-L131 VanDerWaalsContact C-N 3.33Å; L129-Q132 PolarHBondContact O-N 3.34Å; L129-Q133 WeakPolarHBondContact O-CG 3.39Å; L129-Q133 PolarHBondContact O-N 3.41Å |
| 130 | E | 91.4 | Very high | 89.2 | Confident | 104 Ų | 104 | 98.7 Ų | 98.7 | 49% | 0.486 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.2 | -41.9 | 176.7 | -73.8 | 176 | -168.7 | 0 | 0 | 111.3 | Q126 K127 Q133 R134 | Q126-E130 PolarHBondContact NE2-OE1 2.97Å; Q126-E130 WeakPolarHBondContact O-CG 3.28Å; Q126-E130 PolarHBondContact O-N 2.87Å; K127-E130 PolarHBondContact O-N 3.03Å; E130-Q133 PolarHBondContact O-N 3.45Å; E130-R134 WeakPolarHBondContact O-CB 3.44Å; E130-R134 PolarHBondContact O-N 3.38Å |
| 131 | L | 90.6 | Very high | 89.4 | Confident | 85 Ų | 85 | 98.7 Ų | 98.7 | 45% | 0.445 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.3 | -46.4 | 173.2 | -177.7 | 152.8 | 0 | 0 | 0 | 111 | K127 E128 L129 Q133 R134 I135 | K127-L131 WeakPolarHBondContact O-CB 3.3Å; K127-L131 PolarHBondContact O-N 2.72Å; E128-L131 PolarHBondContact O-N 3.37Å; L129-L131 VanDerWaalsContact C-N 3.33Å; L131-Q133 VanDerWaalsContact C-N 3.32Å; L131-Q133 PolarHBondContact O-N 2.86Å; L131-R134 WeakPolarHBondContact O-CB 3.31Å; L131-R134 PolarHBondContact O-N 3.13Å; L131-R134 VanDerWaalsContact O-N 3.12Å; L131-I135 HydrophobicContact CD2-CD1 3.4Å; L131-I135 HydrophobicContact CD2-CG1 4.13Å; L131-I135 HydrophobicContact CG-CD1 4.41Å; L131-I135 WeakPolarHBondContact O-CG1 3.43Å; L131-I135 PolarHBondContact O-N 3Å |
| 132 | Q | 92.7 | Very high | 89.2 | Confident | 91 Ų | 91 | 95.5 Ų | 95.5 | 43% | 0.425 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -63 | -38.6 | 177.7 | -174.2 | 63.7 | 4.2 | 0 | 0 | 112 | E128 L129 N136 | E128-Q132 WeakPolarHBondContact O-CB 3.43Å; E128-Q132 PolarHBondContact O-N 2.98Å; L129-Q132 PolarHBondContact O-N 3.34Å; Q132-N136 WeakPolarHBondContact O-CB 3.24Å; Q132-N136 PolarHBondContact O-N 3.45Å; Q132-N136 PolarHBondContact O-ND2 3Å |
| 133 | Q | 92.1 | Very high | 89.1 | Confident | 108 Ų | 108 | 94.6 Ų | 94.6 | 51% | 0.505 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -63.3 | -42.8 | 172.9 | -73.7 | 176.8 | 10.6 | 0 | 0 | 111.1 | L129 E130 L131 N136 T137 | L129-Q133 WeakPolarHBondContact O-CG 3.39Å; L129-Q133 PolarHBondContact O-N 3.41Å; E130-Q133 PolarHBondContact O-N 3.45Å; L131-Q133 VanDerWaalsContact C-N 3.32Å; L131-Q133 PolarHBondContact O-N 2.86Å; Q133-N136 WeakPolarHBondContact O-CB 3.42Å; Q133-N136 PolarHBondContact O-N 2.96Å; Q133-T137 WeakPolarHBondContact O-CG2 3.21Å; Q133-T137 PolarHBondContact O-N 3.42Å; Q133-T137 PolarHBondContact O-OG1 3.5Å |
| 134 | R | 90.7 | Very high | 89 | Confident | 158 Ų | 158 | 94.1 Ų | 94.1 | 60% | 0.596 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -64.1 | -44 | 177.7 | -178.5 | 58.7 | -177.6 | -94.4 | 0.4 | 112.7 | E130 L131 N136 T137 D138 | E130-R134 WeakPolarHBondContact O-CB 3.44Å; E130-R134 PolarHBondContact O-N 3.38Å; L131-R134 WeakPolarHBondContact O-CB 3.31Å; L131-R134 PolarHBondContact O-N 3.13Å; L131-R134 VanDerWaalsContact O-N 3.12Å; R134-N136 VanDerWaalsContact C-N 3.3Å; R134-N136 PolarHBondContact O-N 3.32Å; R134-T137 WeakPolarHBondContact CA-OG1 3.46Å; R134-T137 PolarHBondContact O-N 3.23Å; R134-T137 PolarHBondContact O-OG1 2.99Å; R134-D138 IonicContact NE-OD1 3.59Å; R134-D138 PolarHBondContact NE-OD1 3.38Å; R134-D138 IonicContact NE-OD2 2.64Å; R134-D138 PolarHBondContact NE-OD2 3.16Å; R134-D138 WeakPolarHBondContact O-CB 3.26Å; R134-D138 VanDerWaalsContact O-CG 3.29Å; R134-D138 PolarHBondContact O-N 3.08Å |
| 135 | I | 91.8 | Very high | 88.5 | Confident | 75 Ų | 75 | 92.4 Ų | 92.4 | 39% | 0.385 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -59.1 | -45.1 | 173.5 | -68.6 | 177.5 | 0 | 0 | 0 | 109.8 | L131 T137 D138 L139 | L131-I135 HydrophobicContact CD2-CD1 3.4Å; L131-I135 HydrophobicContact CD2-CG1 4.13Å; L131-I135 HydrophobicContact CG-CD1 4.41Å; L131-I135 WeakPolarHBondContact O-CG1 3.43Å; L131-I135 PolarHBondContact O-N 3Å; I135-T137 VanDerWaalsContact C-N 3.35Å; I135-T137 PolarHBondContact O-N 3.04Å; I135-D138 PolarHBondContact O-N 3.49Å; I135-L139 HydrophobicContact CG2-CD1 3.8Å; I135-L139 HydrophobicContact CG2-CG 4.14Å; I135-L139 WeakPolarHBondContact O-CB 3.48Å; I135-L139 VanDerWaalsContact O-CG 3.27Å; I135-L139 WeakPolarHBondContact O-CG 3.47Å; I135-L139 PolarHBondContact O-N 3.05Å |
| 136 | N | 93.7 | Very high | 87.8 | Confident | 69 Ų | 69 | 89.2 Ų | 89.2 | 37% | 0.369 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.9 | -38.3 | 177.8 | -80.2 | -50.6 | 0 | 0 | 0 | 113 | Q132 Q133 R134 K140 | Q132-N136 WeakPolarHBondContact O-CB 3.24Å; Q132-N136 PolarHBondContact O-N 3.45Å; Q132-N136 PolarHBondContact O-ND2 3Å; Q133-N136 WeakPolarHBondContact O-CB 3.42Å; Q133-N136 PolarHBondContact O-N 2.96Å; R134-N136 VanDerWaalsContact C-N 3.3Å; R134-N136 PolarHBondContact O-N 3.32Å; N136-K140 WeakPolarHBondContact O-CB 3.41Å; N136-K140 WeakPolarHBondContact O-CD 3.35Å; N136-K140 WeakPolarHBondContact O-CG 3.34Å; N136-K140 PolarHBondContact O-N 3.36Å; N136-K140 VanDerWaalsContact O-N 3.09Å |
| 137 | T | 89.6 | Confident | 87.1 | Confident | 64 Ų | 64 | 90.9 Ų | 90.9 | 39% | 0.393 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -67.3 | -41.2 | 174.8 | 53.2 | 0 | 0 | 0 | 0 | 111.7 | Q133 R134 I135 K140 N141 | Q133-T137 WeakPolarHBondContact O-CG2 3.21Å; Q133-T137 PolarHBondContact O-N 3.42Å; Q133-T137 PolarHBondContact O-OG1 3.5Å; R134-T137 WeakPolarHBondContact CA-OG1 3.46Å; R134-T137 PolarHBondContact O-N 3.23Å; R134-T137 PolarHBondContact O-OG1 2.99Å; I135-T137 VanDerWaalsContact C-N 3.35Å; I135-T137 PolarHBondContact O-N 3.04Å; T137-K140 PolarHBondContact O-N 2.93Å; T137-N141 VanDerWaalsContact O-CG 3.24Å; T137-N141 PolarHBondContact O-N 3.2Å; T137-N141 PolarHBondContact O-ND2 3.05Å |
| 138 | D | 85.9 | Confident | 86.6 | Confident | 56 Ų | 56 | 89 Ų | 89 | 30% | 0.299 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -70.3 | -40.3 | -178.3 | -68.9 | -8.9 | 0 | 0 | 0 | 111.3 | R134 I135 N141 L142 | R134-D138 IonicContact NE-OD1 3.59Å; R134-D138 PolarHBondContact NE-OD1 3.38Å; R134-D138 IonicContact NE-OD2 2.64Å; R134-D138 PolarHBondContact NE-OD2 3.16Å; R134-D138 WeakPolarHBondContact O-CB 3.26Å; R134-D138 VanDerWaalsContact O-CG 3.29Å; R134-D138 PolarHBondContact O-N 3.08Å; I135-D138 PolarHBondContact O-N 3.49Å; D138-N141 PolarHBondContact O-N 3.24Å; D138-L142 WeakPolarHBondContact O-CB 3.45Å; D138-L142 PolarHBondContact O-N 3.31Å |
| 139 | L | 87.1 | Confident | 85.7 | Confident | 77 Ų | 77 | 86.5 Ų | 86.5 | 40% | 0.403 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -61.5 | -42.9 | 172.2 | -72.7 | 176.2 | 0 | 0 | 0 | 112 | I135 L142 L143 | I135-L139 HydrophobicContact CG2-CD1 3.8Å; I135-L139 HydrophobicContact CG2-CG 4.14Å; I135-L139 WeakPolarHBondContact O-CB 3.48Å; I135-L139 VanDerWaalsContact O-CG 3.27Å; I135-L139 WeakPolarHBondContact O-CG 3.47Å; I135-L139 PolarHBondContact O-N 3.05Å; L139-L142 PolarHBondContact O-N 3.36Å; L139-L143 WeakPolarHBondContact O-CG 3.48Å; L139-L143 PolarHBondContact O-N 3.3Å |
| 140 | K | 90.3 | Very high | 84.9 | Confident | 136 Ų | 136 | 86 Ų | 86 | 59% | 0.591 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -61.1 | -45.2 | 174.8 | -76.8 | 171.2 | -176.1 | 177 | 0 | 111.3 | N136 T137 L142 L143 V144 | N136-K140 WeakPolarHBondContact O-CB 3.41Å; N136-K140 WeakPolarHBondContact O-CD 3.35Å; N136-K140 WeakPolarHBondContact O-CG 3.34Å; N136-K140 PolarHBondContact O-N 3.36Å; N136-K140 VanDerWaalsContact O-N 3.09Å; T137-K140 PolarHBondContact O-N 2.93Å; K140-L142 VanDerWaalsContact C-N 3.34Å; K140-L142 PolarHBondContact O-N 3.37Å; K140-L143 PolarHBondContact O-N 3.15Å; K140-V144 VanDerWaalsContact O-CG2 3.32Å; K140-V144 WeakPolarHBondContact O-CG2 3.46Å; K140-V144 PolarHBondContact O-N 3.23Å |
| 141 | N | 82.5 | Confident | 84.3 | Confident | 93 Ų | 93 | 87.3 Ų | 87.3 | 50% | 0.497 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.1 | -40.5 | 178.4 | -72.1 | -18.9 | 0 | 0 | 0 | 112.3 | T137 D138 V144 S145 | T137-N141 VanDerWaalsContact O-CG 3.24Å; T137-N141 PolarHBondContact O-N 3.2Å; T137-N141 PolarHBondContact O-ND2 3.05Å; D138-N141 PolarHBondContact O-N 3.24Å; N141-V144 PolarHBondContact O-N 3.37Å; N141-S145 WeakPolarHBondContact O-CB 3.33Å; N141-S145 PolarHBondContact O-N 2.8Å; N141-S145 PolarHBondContact O-OG 3.47Å; N141-S145 VanDerWaalsContact O-OG 3.13Å |
| 142 | L | 80.8 | Confident | 84 | Confident | 33 Ų | 33 | 90 Ų | 90 | 17% | 0.173 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -61.9 | -47.4 | 174.7 | -178.2 | 64.3 | 0 | 0 | 0 | 111.2 | D138 L139 K140 V144 S145 A146 A154 L157 I158 | D138-L142 WeakPolarHBondContact O-CB 3.45Å; D138-L142 PolarHBondContact O-N 3.31Å; L139-L142 PolarHBondContact O-N 3.36Å; K140-L142 VanDerWaalsContact C-N 3.34Å; K140-L142 PolarHBondContact O-N 3.37Å; L142-V144 PolarHBondContact O-N 2.91Å; L142-S145 PolarHBondContact O-N 3.33Å; L142-A146 WeakPolarHBondContact O-CB 3.44Å; L142-A146 PolarHBondContact O-N 3.41Å; L142-A154 HydrophobicContact CD1-CB 4.02Å; L142-L157 HydrophobicContact CD1-CB 4.02Å; L142-L157 HydrophobicContact CD1-CD1 4.29Å; L142-I158 HydrophobicContact CD1-CD1 4.48Å; L142-I158 HydrophobicContact CD1-CG1 4.11Å; L142-I158 HydrophobicContact CD2-CG1 4.22Å |
| 143 | L | 82 | Confident | 83.6 | Confident | 111 Ų | 111 | 88.6 Ų | 88.6 | 58% | 0.581 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -59.3 | -45.8 | 176.3 | -75.3 | 170.8 | 0 | 0 | 0 | 111.7 | L139 K140 S145 A146 L147 | L139-L143 WeakPolarHBondContact O-CG 3.48Å; L139-L143 PolarHBondContact O-N 3.3Å; K140-L143 PolarHBondContact O-N 3.15Å; L143-S145 VanDerWaalsContact C-N 3.34Å; L143-S145 PolarHBondContact O-N 2.92Å; L143-A146 PolarHBondContact O-N 3.46Å; L143-L147 WeakPolarHBondContact O-CB 3.24Å; L143-L147 WeakPolarHBondContact O-CD1 3.45Å; L143-L147 VanDerWaalsContact O-CG 3.28Å; L143-L147 WeakPolarHBondContact O-CG 3.49Å; L143-L147 PolarHBondContact O-N 2.8Å |
| 144 | V | 84.2 | Confident | 83.1 | Confident | 86 Ų | 86 | 83.8 Ų | 83.8 | 52% | 0.521 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.1 | -41.9 | 178 | 170.2 | 0 | 0 | 0 | 0 | 111.3 | K140 N141 L142 L147 S148 | K140-V144 VanDerWaalsContact O-CG2 3.32Å; K140-V144 WeakPolarHBondContact O-CG2 3.46Å; K140-V144 PolarHBondContact O-N 3.23Å; N141-V144 PolarHBondContact O-N 3.37Å; L142-V144 PolarHBondContact O-N 2.91Å; V144-L147 PolarHBondContact O-N 3.21Å; V144-S148 VanDerWaalsContact O-CB 3.3Å; V144-S148 WeakPolarHBondContact O-CB 3.44Å; V144-S148 PolarHBondContact O-N 2.96Å; V144-S148 PolarHBondContact O-OG 3.03Å |
| 145 | S | 78.1 | Confident | 82.9 | Confident | 25 Ų | 25 | 80.7 Ų | 80.7 | 18% | 0.175 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -67.9 | -40.5 | 178.3 | -69.7 | 0 | 0 | 0 | 0 | 112.6 | N141 L142 L143 S148 N150 | N141-S145 WeakPolarHBondContact O-CB 3.33Å; N141-S145 PolarHBondContact O-N 2.8Å; N141-S145 PolarHBondContact O-OG 3.47Å; N141-S145 VanDerWaalsContact O-OG 3.13Å; L142-S145 PolarHBondContact O-N 3.33Å; L143-S145 VanDerWaalsContact C-N 3.34Å; L143-S145 PolarHBondContact O-N 2.92Å; S145-S148 PolarHBondContact O-N 3.48Å; S145-N150 PolarHBondContact O-N 2.86Å |
| 146 | A | 74.1 | Confident | 82.8 | Confident | 58 Ų | 58 | 83.6 Ų | 83.6 | 48% | 0.479 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -63.6 | -43.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | L142 L143 S148 G149 | L142-A146 WeakPolarHBondContact O-CB 3.44Å; L142-A146 PolarHBondContact O-N 3.41Å; L143-A146 PolarHBondContact O-N 3.46Å; A146-S148 VanDerWaalsContact C-N 3.3Å; A146-S148 PolarHBondContact O-N 3.37Å; A146-G149 PolarHBondContact O-N 2.83Å |
| 147 | L | 77.2 | Confident | 82.5 | Confident | 151 Ų | 151 | 83.2 Ų | 83.2 | 79% | 0.791 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -66.4 | -30.5 | 174.8 | -74.2 | 165.5 | 0 | 0 | 0 | 112.8 | L143 V144 G149 | L143-L147 WeakPolarHBondContact O-CB 3.24Å; L143-L147 WeakPolarHBondContact O-CD1 3.45Å; L143-L147 VanDerWaalsContact O-CG 3.28Å; L143-L147 WeakPolarHBondContact O-CG 3.49Å; L143-L147 PolarHBondContact O-N 2.8Å; V144-L147 PolarHBondContact O-N 3.21Å; L147-G149 PolarHBondContact O-N 3.42Å |
| 148 | S | 79 | Confident | 82.5 | Confident | 75 Ų | 75 | 83.9 Ų | 83.9 | 52% | 0.524 | 47% | 0.467 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.4 | 3.5 | 178.7 | -57 | 0 | 0 | 0 | 0 | 113.6 | V144 S145 A146 N150 | V144-S148 VanDerWaalsContact O-CB 3.3Å; V144-S148 WeakPolarHBondContact O-CB 3.44Å; V144-S148 PolarHBondContact O-N 2.96Å; V144-S148 PolarHBondContact O-OG 3.03Å; S145-S148 PolarHBondContact O-N 3.48Å; A146-S148 VanDerWaalsContact C-N 3.3Å; A146-S148 PolarHBondContact O-N 3.37Å; S148-N150 PolarHBondContact O-N 3.18Å |
| 149 | G | 71.8 | Confident | 82.8 | Confident | 61 Ų | 61 | 85.2 Ų | 85.2 | 63% | 0.629 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.1 | 6.2 | 178 | 0 | 0 | 0 | 0 | 0 | 115.1 | A146 L147 L151 | A146-G149 PolarHBondContact O-N 2.83Å; L147-G149 PolarHBondContact O-N 3.42Å; G149-L151 PolarHBondContact O-N 3.33Å |
| 150 | N | 78.5 | Confident | 83 | Confident | 91 Ų | 91 | 87 Ų | 87 | 49% | 0.487 | 48% | 0.484 | S | S | . | . | trans | -85.4 | 62.6 | 177.5 | -70.8 | -37.8 | 0 | 0 | 0 | 110.9 | S145 S148 N152 V153 A154 | S145-N150 PolarHBondContact O-N 2.86Å; S148-N150 PolarHBondContact O-N 3.18Å; N150-N152 PolarHBondContact O-N 3.28Å; N150-N152 VanDerWaalsContact O-N 3.13Å; N150-V153 HydrophobicContact CB-CB 4.14Å; N150-V153 HydrophobicContact CB-CG2 4.09Å; N150-V153 PolarHBondContact O-N 3.38Å; N150-A154 PolarHBondContact O-N 3.19Å; N150-A154 VanDerWaalsContact O-N 3.09Å | ||
| 151 | L | 78.4 | Confident | 83.1 | Confident | 130 Ų | 130 | 84.5 Ų | 84.5 | 68% | 0.681 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -52.3 | -37.1 | -177.7 | -177.6 | 62.2 | 0 | 0 | 0 | 112.5 | G149 V153 A154 Q155 | G149-L151 PolarHBondContact O-N 3.33Å; L151-V153 PolarHBondContact O-N 3.38Å; L151-A154 PolarHBondContact O-N 3.04Å; L151-Q155 WeakPolarHBondContact O-CB 3.36Å; L151-Q155 PolarHBondContact O-N 3.48Å |
| 152 | N | 84.1 | Confident | 83.6 | Confident | 141 Ų | 141 | 83.3 Ų | 83.3 | 75% | 0.754 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -62.8 | -41.1 | 177.7 | -64.3 | -19.2 | 0 | 0 | 0 | 112.8 | N150 Q156 | N150-N152 PolarHBondContact O-N 3.28Å; N150-N152 VanDerWaalsContact O-N 3.13Å; N152-Q156 WeakPolarHBondContact O-CB 3.44Å; N152-Q156 PolarHBondContact O-N 3.24Å |
| 153 | V | 83.3 | Confident | 84.3 | Confident | 63 Ų | 63 | 84.5 Ų | 84.5 | 38% | 0.382 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -71.1 | -41 | 178.3 | 178.6 | 0 | 0 | 0 | 0 | 110.1 | N150 L151 Q155 Q156 L157 | N150-V153 HydrophobicContact CB-CB 4.14Å; N150-V153 HydrophobicContact CB-CG2 4.09Å; N150-V153 PolarHBondContact O-N 3.38Å; L151-V153 PolarHBondContact O-N 3.38Å; V153-Q155 PolarHBondContact O-N 3.37Å; V153-Q156 PolarHBondContact O-N 2.92Å; V153-L157 HydrophobicContact CG1-CD1 4.22Å; V153-L157 HydrophobicContact CG1-CG 4.48Å; V153-L157 WeakPolarHBondContact O-CB 3.41Å; V153-L157 WeakPolarHBondContact O-CG 3.34Å; V153-L157 PolarHBondContact O-N 2.89Å |
| 154 | A | 82 | Confident | 84.8 | Confident | 6 Ų | 6 | 83.9 Ų | 83.9 | 5% | 0.05 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -61.2 | -43.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | L142 N150 L151 L157 I158 | L142-A154 HydrophobicContact CD1-CB 4.02Å; N150-A154 PolarHBondContact O-N 3.19Å; N150-A154 VanDerWaalsContact O-N 3.09Å; L151-A154 PolarHBondContact O-N 3.04Å; A154-L157 PolarHBondContact O-N 3.39Å; A154-I158 WeakPolarHBondContact O-CG1 3.44Å; A154-I158 PolarHBondContact O-N 3.21Å |
| 155 | Q | 86.8 | Confident | 85.2 | Confident | 93 Ų | 93 | 82.9 Ų | 82.9 | 44% | 0.435 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.6 | -46 | 175.3 | -173.1 | 62.1 | 41 | 0 | 0 | 111.5 | L151 V153 L157 I158 D159 | L151-Q155 WeakPolarHBondContact O-CB 3.36Å; L151-Q155 PolarHBondContact O-N 3.48Å; V153-Q155 PolarHBondContact O-N 3.37Å; Q155-L157 VanDerWaalsContact C-N 3.28Å; Q155-L157 PolarHBondContact O-N 3.45Å; Q155-I158 PolarHBondContact O-N 2.93Å; Q155-I158 VanDerWaalsContact O-N 3.12Å; Q155-D159 PolarHBondContact NE2-OD1 3.16Å; Q155-D159 VanDerWaalsContact O-CG 3.27Å; Q155-D159 PolarHBondContact O-N 3.11Å |
| 156 | Q | 89 | Confident | 86.1 | Confident | 137 Ų | 137 | 88.8 Ų | 88.8 | 64% | 0.64 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.1 | -37.9 | 176.8 | -173.1 | 179.2 | 9.5 | 0 | 0 | 112.2 | N152 V153 L160 | N152-Q156 WeakPolarHBondContact O-CB 3.44Å; N152-Q156 PolarHBondContact O-N 3.24Å; V153-Q156 PolarHBondContact O-N 2.92Å; Q156-L160 VanDerWaalsContact O-CB 3.23Å; Q156-L160 WeakPolarHBondContact O-CB 3.38Å; Q156-L160 PolarHBondContact O-N 3.42Å |
| 157 | L | 87.9 | Confident | 87.1 | Confident | 61 Ų | 61 | 90.6 Ų | 90.6 | 32% | 0.319 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.9 | -40.1 | 174.6 | -74.9 | 172.4 | 0 | 0 | 0 | 112.2 | L142 V153 A154 Q155 L160 M161 | L142-L157 HydrophobicContact CD1-CB 4.02Å; L142-L157 HydrophobicContact CD1-CD1 4.29Å; V153-L157 HydrophobicContact CG1-CD1 4.22Å; V153-L157 HydrophobicContact CG1-CG 4.48Å; V153-L157 WeakPolarHBondContact O-CB 3.41Å; V153-L157 WeakPolarHBondContact O-CG 3.34Å; V153-L157 PolarHBondContact O-N 2.89Å; A154-L157 PolarHBondContact O-N 3.39Å; Q155-L157 VanDerWaalsContact C-N 3.28Å; Q155-L157 PolarHBondContact O-N 3.45Å; L157-L160 PolarHBondContact O-N 3.38Å; L157-M161 VanDerWaalsContact O-CB 3.23Å; L157-M161 WeakPolarHBondContact O-CB 3.3Å; L157-M161 PolarHBondContact O-N 2.97Å |
| 158 | I | 88.9 | Confident | 88 | Confident | 78 Ų | 78 | 86.2 Ų | 86.2 | 40% | 0.4 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.8 | -45.3 | 175.6 | -68.5 | 164.4 | 0 | 0 | 0 | 110.8 | L142 A154 Q155 L160 M161 S162 | L142-I158 HydrophobicContact CD1-CD1 4.48Å; L142-I158 HydrophobicContact CD1-CG1 4.11Å; L142-I158 HydrophobicContact CD2-CG1 4.22Å; A154-I158 WeakPolarHBondContact O-CG1 3.44Å; A154-I158 PolarHBondContact O-N 3.21Å; Q155-I158 PolarHBondContact O-N 2.93Å; Q155-I158 VanDerWaalsContact O-N 3.12Å; I158-L160 VanDerWaalsContact C-N 3.32Å; I158-L160 PolarHBondContact O-N 2.96Å; I158-M161 PolarHBondContact O-N 3.22Å; I158-S162 WeakPolarHBondContact O-CB 3.4Å; I158-S162 PolarHBondContact O-N 3.22Å; I158-S162 PolarHBondContact O-OG 3.11Å; I158-S162 VanDerWaalsContact O-OG 3.06Å |
| 159 | D | 92.3 | Very high | 88.8 | Confident | 84 Ų | 84 | 84.4 Ų | 84.4 | 45% | 0.449 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.6 | -41.1 | 177.3 | -65.9 | -15.7 | 0 | 0 | 0 | 110.7 | Q155 S162 S163 | Q155-D159 PolarHBondContact NE2-OD1 3.16Å; Q155-D159 VanDerWaalsContact O-CG 3.27Å; Q155-D159 PolarHBondContact O-N 3.11Å; D159-S162 WeakPolarHBondContact CA-OG 3.41Å; D159-S162 PolarHBondContact O-OG 3.34Å; D159-S163 VanDerWaalsContact O-CB 3.25Å; D159-S163 WeakPolarHBondContact O-CB 3.27Å; D159-S163 PolarHBondContact O-N 3.15Å |
| 160 | L | 92.8 | Very high | 90 | Very high | 114 Ų | 114 | 85.5 Ų | 85.5 | 60% | 0.597 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -66.9 | -41.7 | 175 | -173.8 | 63.5 | 0 | 0 | 0 | 112 | Q156 L157 I158 S163 N164 | Q156-L160 VanDerWaalsContact O-CB 3.23Å; Q156-L160 WeakPolarHBondContact O-CB 3.38Å; Q156-L160 PolarHBondContact O-N 3.42Å; L157-L160 PolarHBondContact O-N 3.38Å; I158-L160 VanDerWaalsContact C-N 3.32Å; I158-L160 PolarHBondContact O-N 2.96Å; L160-S163 PolarHBondContact O-N 3.5Å; L160-N164 VanDerWaalsContact O-CB 3.23Å; L160-N164 WeakPolarHBondContact O-CB 3.38Å; L160-N164 PolarHBondContact O-N 3.36Å |
| 161 | M | 90.9 | Very high | 90.8 | Very high | 83 Ų | 83 | 84.8 Ų | 84.8 | 41% | 0.409 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -66.1 | -41.9 | 178.8 | -170.9 | -177.9 | -61.7 | 0 | 0 | 111.7 | L157 I158 N164 A165 | L157-M161 VanDerWaalsContact O-CB 3.23Å; L157-M161 WeakPolarHBondContact O-CB 3.3Å; L157-M161 PolarHBondContact O-N 2.97Å; I158-M161 PolarHBondContact O-N 3.22Å; M161-N164 PolarHBondContact O-N 3.37Å; M161-A165 WeakPolarHBondContact O-CB 3.17Å; M161-A165 PolarHBondContact O-N 3.38Å |
| 162 | S | 93.6 | Very high | 91.7 | Very high | 68 Ų | 68 | 84.4 Ų | 84.4 | 48% | 0.476 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -67.7 | -41.5 | 176 | 61.7 | 0 | 0 | 0 | 0 | 112.2 | I158 D159 A165 Y166 | I158-S162 WeakPolarHBondContact O-CB 3.4Å; I158-S162 PolarHBondContact O-N 3.22Å; I158-S162 PolarHBondContact O-OG 3.11Å; I158-S162 VanDerWaalsContact O-OG 3.06Å; D159-S162 WeakPolarHBondContact CA-OG 3.41Å; D159-S162 PolarHBondContact O-OG 3.34Å; S162-A165 PolarHBondContact O-N 2.77Å; S162-Y166 WeakPolarHBondContact O-CB 3.4Å; S162-Y166 PolarHBondContact O-N 3.01Å |
| 163 | S | 95.1 | Very high | 92.3 | Very high | 58 Ų | 58 | 79 Ų | 79 | 41% | 0.406 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62 | -43.7 | 172.4 | -176.4 | 0 | 0 | 0 | 0 | 111.7 | D159 L160 Y166 L167 | D159-S163 VanDerWaalsContact O-CB 3.25Å; D159-S163 WeakPolarHBondContact O-CB 3.27Å; D159-S163 PolarHBondContact O-N 3.15Å; L160-S163 PolarHBondContact O-N 3.5Å; S163-Y166 WeakPolarHBondContact O-CB 3.4Å; S163-Y166 PolarHBondContact O-N 3.34Å; S163-L167 WeakPolarHBondContact O-CB 3.46Å; S163-L167 VanDerWaalsContact O-CG 3.31Å; S163-L167 WeakPolarHBondContact O-CG 3.46Å; S163-L167 PolarHBondContact O-N 2.83Å |
| 164 | N | 93.5 | Very high | 93 | Very high | 98 Ų | 98 | 81.3 Ų | 81.3 | 52% | 0.524 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.9 | -45.7 | 177.2 | -165.6 | 18.4 | 0 | 0 | 0 | 111.5 | L160 M161 Y166 L167 C168 | L160-N164 VanDerWaalsContact O-CB 3.23Å; L160-N164 WeakPolarHBondContact O-CB 3.38Å; L160-N164 PolarHBondContact O-N 3.36Å; M161-N164 PolarHBondContact O-N 3.37Å; N164-Y166 VanDerWaalsContact C-N 3.31Å; N164-Y166 PolarHBondContact O-N 3.09Å; N164-L167 PolarHBondContact O-N 3.48Å; N164-C168 WeakPolarHBondContact O-CB 3.41Å; N164-C168 PolarHBondContact O-N 3.28Å; N164-C168 PolarHBondContact O-SG 3.15Å |
| 165 | A | 92.3 | Very high | 93.7 | Very high | 65 Ų | 65 | 83.8 Ų | 83.8 | 54% | 0.537 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -59.2 | -41 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | M161 S162 C168 G169 | M161-A165 WeakPolarHBondContact O-CB 3.17Å; M161-A165 PolarHBondContact O-N 3.38Å; S162-A165 PolarHBondContact O-N 2.77Å; A165-C168 PolarHBondContact O-N 2.82Å; A165-G169 PolarHBondContact O-N 3.42Å |
| 166 | Y | 96.2 | Very high | 94.2 | Very high | 149 Ų | 149 | 87.5 Ų | 87.5 | 58% | 0.584 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -63.6 | -44.4 | 174.7 | 174.1 | -108.1 | 0 | 0 | 0 | 112.5 | S162 S163 N164 G169 Q170 | S162-Y166 WeakPolarHBondContact O-CB 3.4Å; S162-Y166 PolarHBondContact O-N 3.01Å; S163-Y166 WeakPolarHBondContact O-CB 3.4Å; S163-Y166 PolarHBondContact O-N 3.34Å; N164-Y166 VanDerWaalsContact C-N 3.31Å; N164-Y166 PolarHBondContact O-N 3.09Å; Y166-G169 PolarHBondContact O-N 3.13Å; Y166-Q170 HydrophobicContact CE1-CG 4.46Å; Y166-Q170 HydrophobicContact CE2-CG 4.31Å; Y166-Q170 VanDerWaalsContact CZ-NE2 3.27Å; Y166-Q170 PolarHBondContact O-N 3.16Å; Y166-Q170 PolarHBondContact OH-NE2 3.23Å |
| 167 | L | 96.2 | Very high | 94.6 | Very high | 96 Ų | 96 | 86.4 Ų | 86.4 | 50% | 0.503 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66.3 | -39.2 | 176.5 | -70.1 | 174.7 | 0 | 0 | 0 | 112.2 | S163 N164 Q170 S171 | S163-L167 WeakPolarHBondContact O-CB 3.46Å; S163-L167 VanDerWaalsContact O-CG 3.31Å; S163-L167 WeakPolarHBondContact O-CG 3.46Å; S163-L167 PolarHBondContact O-N 2.83Å; N164-L167 PolarHBondContact O-N 3.48Å; L167-Q170 PolarHBondContact O-N 3.04Å; L167-S171 WeakPolarHBondContact O-CB 3.49Å; L167-S171 PolarHBondContact O-N 2.98Å |
| 168 | C | 95.2 | Very high | 95.1 | Very high | 60 Ų | 60 | 90.8 Ų | 90.8 | 41% | 0.405 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.7 | -49.3 | 172.9 | -73.1 | 0 | 0 | 0 | 0 | 111.2 | N164 A165 Q170 S171 E172 | N164-C168 WeakPolarHBondContact O-CB 3.41Å; N164-C168 PolarHBondContact O-N 3.28Å; N164-C168 PolarHBondContact O-SG 3.15Å; A165-C168 PolarHBondContact O-N 2.82Å; C168-Q170 VanDerWaalsContact C-N 3.33Å; C168-Q170 PolarHBondContact O-N 2.93Å; C168-S171 WeakPolarHBondContact O-CB 3.45Å; C168-S171 PolarHBondContact O-N 3.47Å; C168-S171 VanDerWaalsContact O-N 3.13Å; C168-E172 WeakPolarHBondContact O-CG 3.49Å; C168-E172 PolarHBondContact O-N 2.94Å |
| 169 | G | 95.4 | Very high | 95.5 | Very high | 36 Ų | 36 | 90.7 Ų | 90.7 | 37% | 0.371 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62 | -38.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | A165 Y166 G173 | A165-G169 PolarHBondContact O-N 3.42Å; Y166-G169 PolarHBondContact O-N 3.13Å; G169-G173 PolarHBondContact O-N 3.31Å |
| 170 | Q | 97.4 | Very high | 95.8 | Very high | 85 Ų | 85 | 92.1 Ų | 92.1 | 40% | 0.397 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.8 | -42.6 | 172.3 | -76 | -169 | 95.6 | 0 | 0 | 112.3 | Y166 L167 C168 E172 G173 L174 | Y166-Q170 HydrophobicContact CE1-CG 4.46Å; Y166-Q170 HydrophobicContact CE2-CG 4.31Å; Y166-Q170 VanDerWaalsContact CZ-NE2 3.27Å; Y166-Q170 PolarHBondContact O-N 3.16Å; Y166-Q170 PolarHBondContact OH-NE2 3.23Å; L167-Q170 PolarHBondContact O-N 3.04Å; C168-Q170 VanDerWaalsContact C-N 3.33Å; C168-Q170 PolarHBondContact O-N 2.93Å; Q170-E172 PolarHBondContact O-N 2.77Å; Q170-G173 PolarHBondContact O-N 3.49Å; Q170-L174 WeakPolarHBondContact O-CG 3.07Å; Q170-L174 PolarHBondContact O-N 2.82Å |
| 171 | S | 96.5 | Very high | 96 | Very high | 76 Ų | 76 | 91.9 Ų | 91.9 | 53% | 0.531 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.7 | -45.5 | 176.8 | -174 | 0 | 0 | 0 | 0 | 111.5 | L167 C168 G173 L174 A175 | L167-S171 WeakPolarHBondContact O-CB 3.49Å; L167-S171 PolarHBondContact O-N 2.98Å; C168-S171 WeakPolarHBondContact O-CB 3.45Å; C168-S171 PolarHBondContact O-N 3.47Å; C168-S171 VanDerWaalsContact O-N 3.13Å; S171-G173 PolarHBondContact O-N 3.13Å; S171-L174 PolarHBondContact O-N 2.88Å; S171-A175 WeakPolarHBondContact O-CB 3.48Å; S171-A175 PolarHBondContact O-N 3.12Å |
| 172 | E | 95.6 | Very high | 96.4 | Very high | 122 Ų | 122 | 92.9 Ų | 92.9 | 57% | 0.57 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.4 | -38.3 | 174.8 | -71 | 172.6 | -168.6 | 0 | 0 | 112.7 | C168 Q170 A175 R176 | C168-E172 WeakPolarHBondContact O-CG 3.49Å; C168-E172 PolarHBondContact O-N 2.94Å; Q170-E172 PolarHBondContact O-N 2.77Å; E172-A175 PolarHBondContact O-N 3.37Å; E172-R176 WeakPolarHBondContact O-CG 3.36Å; E172-R176 PolarHBondContact O-N 3.05Å |
| 173 | G | 97.1 | Very high | 96.6 | Very high | 27 Ų | 27 | 95.2 Ų | 95.2 | 28% | 0.278 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.2 | -47.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | G169 Q170 S171 R176 Q177 | G169-G173 PolarHBondContact O-N 3.31Å; Q170-G173 PolarHBondContact O-N 3.49Å; S171-G173 PolarHBondContact O-N 3.13Å; G173-R176 PolarHBondContact O-N 3.06Å; G173-Q177 PolarHBondContact O-N 2.91Å |
| 174 | L | 97.8 | Very high | 96.7 | Very high | 111 Ų | 111 | 95 Ų | 95 | 58% | 0.581 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.6 | -38.1 | 176.6 | -69.7 | 174.2 | 0 | 0 | 0 | 111.9 | Q170 S171 Q177 K178 | Q170-L174 WeakPolarHBondContact O-CG 3.07Å; Q170-L174 PolarHBondContact O-N 2.82Å; S171-L174 PolarHBondContact O-N 2.88Å; L174-Q177 PolarHBondContact O-N 3.48Å; L174-K178 WeakPolarHBondContact O-CB 3.3Å; L174-K178 PolarHBondContact O-N 3.36Å |
| 175 | A | 96.8 | Very high | 97 | Very high | 59 Ų | 59 | 92.6 Ų | 92.6 | 49% | 0.488 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63 | -44.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | S171 E172 K178 S179 | S171-A175 WeakPolarHBondContact O-CB 3.48Å; S171-A175 PolarHBondContact O-N 3.12Å; E172-A175 PolarHBondContact O-N 3.37Å; A175-K178 PolarHBondContact O-N 3.4Å; A175-S179 PolarHBondContact O-N 3.35Å |
| 176 | R | 97.3 | Very high | 97.2 | Very high | 171 Ų | 171 | 92.9 Ų | 92.9 | 65% | 0.645 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62 | -45 | 173.9 | -76.1 | -175.8 | -71.1 | 154.5 | -6.6 | 112.1 | E172 G173 K178 S179 L180 | E172-R176 WeakPolarHBondContact O-CG 3.36Å; E172-R176 PolarHBondContact O-N 3.05Å; G173-R176 PolarHBondContact O-N 3.06Å; R176-K178 VanDerWaalsContact C-N 3.33Å; R176-K178 PolarHBondContact O-N 3.05Å; R176-S179 PolarHBondContact O-N 3.4Å; R176-L180 WeakPolarHBondContact O-CG 3.19Å; R176-L180 PolarHBondContact O-N 2.93Å |
| 177 | Q | 98.1 | Very high | 97.3 | Very high | 113 Ų | 113 | 89.3 Ų | 89.3 | 53% | 0.528 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62 | -41.8 | 176.9 | -174 | -179.7 | 11.3 | 0 | 0 | 111.9 | G173 L174 L180 L181 | G173-Q177 PolarHBondContact O-N 2.91Å; L174-Q177 PolarHBondContact O-N 3.48Å; Q177-L180 PolarHBondContact O-N 3.38Å; Q177-L181 HydrophobicContact CG-CD1 4.2Å; Q177-L181 WeakPolarHBondContact O-CB 3.42Å; Q177-L181 WeakPolarHBondContact O-CG 3.43Å; Q177-L181 PolarHBondContact O-N 2.94Å |
| 178 | K | 97.9 | Very high | 97.4 | Very high | 154 Ų | 154 | 87.5 Ų | 87.5 | 67% | 0.67 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -61.5 | -43.3 | 175.6 | -176.4 | -177.5 | 176.8 | -173.6 | 0 | 111.4 | L174 A175 R176 L181 Q182 | L174-K178 WeakPolarHBondContact O-CB 3.3Å; L174-K178 PolarHBondContact O-N 3.36Å; A175-K178 PolarHBondContact O-N 3.4Å; R176-K178 VanDerWaalsContact C-N 3.33Å; R176-K178 PolarHBondContact O-N 3.05Å; K178-L181 PolarHBondContact O-N 3.21Å; K178-Q182 WeakPolarHBondContact O-CB 3.42Å; K178-Q182 PolarHBondContact O-N 2.93Å |
| 179 | S | 97.8 | Very high | 97.6 | Very high | 76 Ų | 76 | 90.5 Ų | 90.5 | 53% | 0.531 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.1 | -45.1 | 176.6 | 170.8 | 0 | 0 | 0 | 0 | 112.1 | A175 R176 Q182 E183 | A175-S179 PolarHBondContact O-N 3.35Å; R176-S179 PolarHBondContact O-N 3.4Å; S179-Q182 WeakPolarHBondContact O-CB 3.27Å; S179-Q182 PolarHBondContact O-N 3.29Å; S179-E183 PolarHBondContact O-N 3.06Å |
| 180 | L | 98 | Very high | 97.7 | Very high | 114 Ų | 114 | 94 Ų | 94 | 60% | 0.597 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.9 | -39.9 | 176.5 | -68.7 | 175 | 0 | 0 | 0 | 112.7 | R176 Q177 Q182 E183 A184 | R176-L180 WeakPolarHBondContact O-CG 3.19Å; R176-L180 PolarHBondContact O-N 2.93Å; Q177-L180 PolarHBondContact O-N 3.38Å; L180-Q182 VanDerWaalsContact C-N 3.31Å; L180-E183 PolarHBondContact O-N 3.09Å; L180-A184 WeakPolarHBondContact O-CB 3.5Å; L180-A184 PolarHBondContact O-N 3.31Å |
| 181 | L | 98 | Very high | 97.7 | Very high | 109 Ų | 109 | 93.8 Ų | 93.8 | 57% | 0.571 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -67.8 | -32.5 | 175.7 | -73.8 | 174.4 | 0 | 0 | 0 | 112.2 | Q177 K178 A185 | Q177-L181 HydrophobicContact CG-CD1 4.2Å; Q177-L181 WeakPolarHBondContact O-CB 3.42Å; Q177-L181 WeakPolarHBondContact O-CG 3.43Å; Q177-L181 PolarHBondContact O-N 2.94Å; K178-L181 PolarHBondContact O-N 3.21Å; L181-A185 WeakPolarHBondContact O-CB 3.43Å; L181-A185 PolarHBondContact O-N 3.07Å |
| 182 | Q | 98.4 | Very high | 97.8 | Very high | 103 Ų | 103 | 92.8 Ų | 92.8 | 48% | 0.481 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.2 | -48 | 174.3 | -173.6 | 62.1 | 45.6 | 0 | 0 | 110.8 | K178 S179 L180 A184 A185 D186 | K178-Q182 WeakPolarHBondContact O-CB 3.42Å; K178-Q182 PolarHBondContact O-N 2.93Å; S179-Q182 WeakPolarHBondContact O-CB 3.27Å; S179-Q182 PolarHBondContact O-N 3.29Å; L180-Q182 VanDerWaalsContact C-N 3.31Å; Q182-A184 VanDerWaalsContact C-N 3.31Å; Q182-A184 PolarHBondContact O-N 2.89Å; Q182-A185 WeakPolarHBondContact O-CA 3.05Å; Q182-A185 WeakPolarHBondContact O-CB 3.22Å; Q182-A185 PolarHBondContact O-N 2.98Å; Q182-D186 PolarHBondContact NE2-OD1 3.41Å; Q182-D186 PolarHBondContact O-N 2.97Å |
| 183 | E | 97.7 | Very high | 97.9 | Very high | 118 Ų | 118 | 91 Ų | 91 | 55% | 0.551 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.5 | -41 | 175.9 | -173.7 | -176.1 | 174.3 | 0 | 0 | 111.9 | S179 L180 A185 D186 T187 | S179-E183 PolarHBondContact O-N 3.06Å; L180-E183 PolarHBondContact O-N 3.09Å; E183-A185 VanDerWaalsContact C-N 3.29Å; E183-A185 PolarHBondContact O-N 2.84Å; E183-D186 PolarHBondContact O-N 3.23Å; E183-T187 WeakPolarHBondContact O-CG2 3.27Å; E183-T187 PolarHBondContact O-N 2.86Å; E183-T187 PolarHBondContact O-OG1 3.19Å |
| 184 | A | 98.1 | Very high | 97.9 | Very high | 53 Ų | 53 | 93.7 Ų | 93.7 | 44% | 0.438 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.4 | -32.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L180 Q182 T187 A188 | L180-A184 WeakPolarHBondContact O-CB 3.5Å; L180-A184 PolarHBondContact O-N 3.31Å; Q182-A184 VanDerWaalsContact C-N 3.31Å; Q182-A184 PolarHBondContact O-N 2.89Å; A184-T187 WeakPolarHBondContact CA-OG1 3.33Å; A184-T187 PolarHBondContact O-OG1 2.97Å; A184-T187 VanDerWaalsContact O-OG1 3.05Å; A184-A188 VanDerWaalsContact O-CB 3.3Å; A184-A188 WeakPolarHBondContact O-CB 3.41Å; A184-A188 PolarHBondContact O-N 2.88Å; A184-A188 VanDerWaalsContact O-N 3.14Å |
| 185 | A | 98.3 | Very high | 97.9 | Very high | 48 Ų | 48 | 96.8 Ų | 96.8 | 40% | 0.397 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -70.6 | -45.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | L181 Q182 E183 T187 A188 E189 | L181-A185 WeakPolarHBondContact O-CB 3.43Å; L181-A185 PolarHBondContact O-N 3.07Å; Q182-A185 WeakPolarHBondContact O-CA 3.05Å; Q182-A185 WeakPolarHBondContact O-CB 3.22Å; Q182-A185 PolarHBondContact O-N 2.98Å; E183-A185 VanDerWaalsContact C-N 3.29Å; E183-A185 PolarHBondContact O-N 2.84Å; A185-T187 PolarHBondContact O-N 3.01Å; A185-A188 PolarHBondContact O-N 3.22Å; A185-E189 PolarHBondContact O-N 3.49Å |
| 186 | D | 98.2 | Very high | 98 | Very high | 70 Ų | 70 | 99.7 Ų | 99.7 | 37% | 0.374 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.1 | -43 | 179.4 | -59.2 | -16.2 | 0 | 0 | 0 | 110.9 | Q182 E183 A188 E189 I190 | Q182-D186 PolarHBondContact NE2-OD1 3.41Å; Q182-D186 PolarHBondContact O-N 2.97Å; E183-D186 PolarHBondContact O-N 3.23Å; D186-A188 PolarHBondContact O-N 3.29Å; D186-E189 PolarHBondContact O-N 2.9Å; D186-I190 WeakPolarHBondContact O-CG1 3.41Å; D186-I190 PolarHBondContact O-N 3.01Å; D186-I190 VanDerWaalsContact O-N 3.09Å |
| 187 | T | 98.1 | Very high | 98 | Very high | 75 Ų | 75 | 95.8 Ų | 95.8 | 46% | 0.46 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.5 | -37.1 | 175.5 | 52.6 | 0 | 0 | 0 | 0 | 112.6 | E183 A184 A185 V191 | E183-T187 WeakPolarHBondContact O-CG2 3.27Å; E183-T187 PolarHBondContact O-N 2.86Å; E183-T187 PolarHBondContact O-OG1 3.19Å; A184-T187 WeakPolarHBondContact CA-OG1 3.33Å; A184-T187 PolarHBondContact O-OG1 2.97Å; A184-T187 VanDerWaalsContact O-OG1 3.05Å; A185-T187 PolarHBondContact O-N 3.01Å; T187-V191 WeakPolarHBondContact O-CG2 3.45Å; T187-V191 PolarHBondContact O-N 3.09Å; T187-V191 VanDerWaalsContact O-N 3.12Å |
| 188 | A | 98 | Very high | 97.9 | Very high | 58 Ų | 58 | 97.1 Ų | 97.1 | 48% | 0.479 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.8 | -35.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | A184 A185 D186 V191 A192 | A184-A188 VanDerWaalsContact O-CB 3.3Å; A184-A188 WeakPolarHBondContact O-CB 3.41Å; A184-A188 PolarHBondContact O-N 2.88Å; A184-A188 VanDerWaalsContact O-N 3.14Å; A185-A188 PolarHBondContact O-N 3.22Å; D186-A188 PolarHBondContact O-N 3.29Å; A188-V191 PolarHBondContact O-N 3.44Å; A188-A192 WeakPolarHBondContact O-CB 3.1Å; A188-A192 PolarHBondContact O-N 3.44Å |
| 189 | E | 98.3 | Very high | 97.8 | Very high | 122 Ų | 122 | 92.7 Ų | 92.7 | 57% | 0.57 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.6 | -49.3 | 174.6 | -176.3 | 172.3 | -170.6 | 0 | 0 | 111.2 | A185 D186 V191 A192 D193 | A185-E189 PolarHBondContact O-N 3.49Å; D186-E189 PolarHBondContact O-N 2.9Å; E189-V191 VanDerWaalsContact C-N 3.3Å; E189-V191 PolarHBondContact O-N 2.82Å; E189-A192 WeakPolarHBondContact O-CB 3.36Å; E189-A192 PolarHBondContact O-N 3.35Å; E189-A192 VanDerWaalsContact O-N 3.07Å; E189-D193 PolarHBondContact O-N 3.07Å |
| 190 | I | 98.1 | Very high | 97.8 | Very high | 110 Ų | 110 | 94.1 Ų | 94.1 | 56% | 0.564 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -57.2 | -45.1 | 176 | -64.7 | 165.3 | 0 | 0 | 0 | 110.9 | D186 A192 D193 V194 | D186-I190 WeakPolarHBondContact O-CG1 3.41Å; D186-I190 PolarHBondContact O-N 3.01Å; D186-I190 VanDerWaalsContact O-N 3.09Å; I190-A192 VanDerWaalsContact C-N 3.33Å; I190-A192 PolarHBondContact O-N 3.26Å; I190-D193 PolarHBondContact O-N 3.44Å; I190-V194 WeakPolarHBondContact O-CG2 3.33Å; I190-V194 PolarHBondContact O-N 2.91Å |
| 191 | V | 97.9 | Very high | 97.6 | Very high | 81 Ų | 81 | 91.3 Ų | 91.3 | 49% | 0.491 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.3 | -39.2 | 178.3 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | T187 A188 E189 V194 W195 | T187-V191 WeakPolarHBondContact O-CG2 3.45Å; T187-V191 PolarHBondContact O-N 3.09Å; T187-V191 VanDerWaalsContact O-N 3.12Å; A188-V191 PolarHBondContact O-N 3.44Å; E189-V191 VanDerWaalsContact C-N 3.3Å; E189-V191 PolarHBondContact O-N 2.82Å; V191-V194 PolarHBondContact O-N 3.4Å; V191-W195 WeakPolarHBondContact O-CB 3.41Å; V191-W195 VanDerWaalsContact O-CD1 3.29Å; V191-W195 PolarHBondContact O-N 3.47Å |
| 192 | A | 98.1 | Very high | 97.4 | Very high | 54 Ų | 54 | 89.4 Ų | 89.4 | 45% | 0.446 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.5 | -43 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | A188 E189 I190 W195 Q196 | A188-A192 WeakPolarHBondContact O-CB 3.1Å; A188-A192 PolarHBondContact O-N 3.44Å; E189-A192 WeakPolarHBondContact O-CB 3.36Å; E189-A192 PolarHBondContact O-N 3.35Å; E189-A192 VanDerWaalsContact O-N 3.07Å; I190-A192 VanDerWaalsContact C-N 3.33Å; I190-A192 PolarHBondContact O-N 3.26Å; A192-W195 PolarHBondContact O-N 3Å; A192-Q196 WeakPolarHBondContact O-CB 3.33Å; A192-Q196 PolarHBondContact O-N 3.23Å |
| 193 | D | 98.2 | Very high | 97.4 | Very high | 85 Ų | 85 | 93.3 Ų | 93.3 | 46% | 0.455 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.8 | -42.3 | 177 | -76.7 | -10.6 | 0 | 0 | 0 | 112.3 | E189 I190 W195 Q196 T197 | E189-D193 PolarHBondContact O-N 3.07Å; I190-D193 PolarHBondContact O-N 3.44Å; D193-W195 VanDerWaalsContact C-N 3.31Å; D193-W195 PolarHBondContact O-N 3.26Å; D193-Q196 PolarHBondContact O-N 3.27Å; D193-T197 WeakPolarHBondContact O-CG2 3.43Å; D193-T197 PolarHBondContact O-N 3.4Å; D193-T197 PolarHBondContact O-OG1 2.91Å |
| 194 | V | 97.7 | Very high | 97.2 | Very high | 84 Ų | 84 | 90.9 Ų | 90.9 | 51% | 0.509 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.4 | -41 | 173.6 | 171.9 | 0 | 0 | 0 | 0 | 111 | I190 V191 T197 K198 | I190-V194 WeakPolarHBondContact O-CG2 3.33Å; I190-V194 PolarHBondContact O-N 2.91Å; V191-V194 PolarHBondContact O-N 3.4Å; V194-T197 WeakPolarHBondContact CA-OG1 3.48Å; V194-T197 PolarHBondContact O-OG1 2.84Å; V194-K198 VanDerWaalsContact O-CB 3.28Å; V194-K198 WeakPolarHBondContact O-CB 3.27Å; V194-K198 PolarHBondContact O-N 2.99Å |
| 195 | W | 97.3 | Very high | 96.9 | Very high | 176 Ų | 176 | 91.5 Ų | 91.5 | 67% | 0.667 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.4 | -40.9 | 175.8 | -92.7 | 98.7 | 0 | 0 | 0 | 112.7 | V191 A192 D193 K198 C199 | V191-W195 WeakPolarHBondContact O-CB 3.41Å; V191-W195 VanDerWaalsContact O-CD1 3.29Å; V191-W195 PolarHBondContact O-N 3.47Å; A192-W195 PolarHBondContact O-N 3Å; D193-W195 VanDerWaalsContact C-N 3.31Å; D193-W195 PolarHBondContact O-N 3.26Å; W195-K198 PolarHBondContact O-N 2.75Å; W195-C199 WeakPolarHBondContact O-CB 3.3Å; W195-C199 PolarHBondContact O-N 2.75Å |
| 196 | Q | 98.5 | Very high | 96.6 | Very high | 119 Ų | 119 | 92 Ų | 92 | 56% | 0.556 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.6 | -48.8 | 176.9 | 177.6 | 173 | -25.6 | 0 | 0 | 110.9 | A192 D193 C199 I200 | A192-Q196 WeakPolarHBondContact O-CB 3.33Å; A192-Q196 PolarHBondContact O-N 3.23Å; D193-Q196 PolarHBondContact O-N 3.27Å; Q196-C199 PolarHBondContact O-N 3.39Å; Q196-I200 HydrophobicContact CG-CD1 3.92Å; Q196-I200 VanDerWaalsContact O-CG1 3.31Å; Q196-I200 WeakPolarHBondContact O-CG1 3.34Å; Q196-I200 PolarHBondContact O-N 2.83Å |
| 197 | T | 97.9 | Very high | 96.3 | Very high | 89 Ų | 89 | 90.6 Ų | 90.6 | 55% | 0.546 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63 | -44.7 | 178.4 | 51.7 | 0 | 0 | 0 | 0 | 111.8 | D193 V194 C199 I200 A201 | D193-T197 WeakPolarHBondContact O-CG2 3.43Å; D193-T197 PolarHBondContact O-N 3.4Å; D193-T197 PolarHBondContact O-OG1 2.91Å; V194-T197 WeakPolarHBondContact CA-OG1 3.48Å; V194-T197 PolarHBondContact O-OG1 2.84Å; T197-C199 VanDerWaalsContact C-N 3.33Å; T197-C199 PolarHBondContact O-N 3.34Å; T197-I200 PolarHBondContact O-N 3.4Å; T197-A201 WeakPolarHBondContact O-CB 3.33Å; T197-A201 PolarHBondContact O-N 2.88Å |
| 198 | K | 94.9 | Very high | 95.9 | Very high | 141 Ų | 141 | 89.6 Ų | 89.6 | 61% | 0.613 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.3 | -37.4 | 175.4 | -171.5 | 172.1 | -175.2 | 173.3 | 0 | 112.9 | V194 W195 S202 | V194-K198 VanDerWaalsContact O-CB 3.28Å; V194-K198 WeakPolarHBondContact O-CB 3.27Å; V194-K198 PolarHBondContact O-N 2.99Å; W195-K198 PolarHBondContact O-N 2.75Å; K198-S202 WeakPolarHBondContact O-CB 3.3Å; K198-S202 PolarHBondContact O-N 2.9Å; K198-S202 PolarHBondContact O-OG 2.76Å |
| 199 | C | 96.3 | Very high | 95.5 | Very high | 62 Ų | 62 | 89.4 Ų | 89.4 | 42% | 0.419 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -68.6 | -40.8 | 176.7 | -172.4 | 0 | 0 | 0 | 0 | 112.1 | W195 Q196 T197 S202 R203 | W195-C199 WeakPolarHBondContact O-CB 3.3Å; W195-C199 PolarHBondContact O-N 2.75Å; Q196-C199 PolarHBondContact O-N 3.39Å; T197-C199 VanDerWaalsContact C-N 3.33Å; T197-C199 PolarHBondContact O-N 3.34Å; C199-S202 PolarHBondContact O-OG 2.75Å; C199-R203 WeakPolarHBondContact O-CB 3.44Å; C199-R203 PolarHBondContact O-N 2.85Å |
| 200 | I | 97.5 | Very high | 95.2 | Very high | 105 Ų | 105 | 86.1 Ų | 86.1 | 54% | 0.538 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.9 | -44.4 | 175.8 | -68.5 | 167.1 | 0 | 0 | 0 | 110.5 | Q196 T197 R203 A204 | Q196-I200 HydrophobicContact CG-CD1 3.92Å; Q196-I200 VanDerWaalsContact O-CG1 3.31Å; Q196-I200 WeakPolarHBondContact O-CG1 3.34Å; Q196-I200 PolarHBondContact O-N 2.83Å; T197-I200 PolarHBondContact O-N 3.4Å; I200-R203 PolarHBondContact O-N 3.33Å; I200-A204 PolarHBondContact O-N 2.83Å |
| 201 | A | 94.4 | Very high | 94.8 | Very high | 56 Ų | 56 | 86.6 Ų | 86.6 | 46% | 0.463 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62 | -47.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | T197 R203 A204 V205 | T197-A201 WeakPolarHBondContact O-CB 3.33Å; T197-A201 PolarHBondContact O-N 2.88Å; A201-R203 VanDerWaalsContact C-N 3.29Å; A201-R203 PolarHBondContact O-N 3.47Å; A201-A204 WeakPolarHBondContact O-CB 3.25Å; A201-A204 PolarHBondContact O-N 3.42Å; A201-A204 VanDerWaalsContact O-N 3.15Å; A201-V205 WeakPolarHBondContact O-CG2 3.4Å; A201-V205 PolarHBondContact O-N 2.78Å |
| 202 | S | 94.6 | Very high | 94.3 | Very high | 69 Ų | 69 | 84.3 Ų | 84.3 | 48% | 0.483 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.9 | -36.9 | 177.8 | 71 | 0 | 0 | 0 | 0 | 112.2 | K198 C199 V205 A206 | K198-S202 WeakPolarHBondContact O-CB 3.3Å; K198-S202 PolarHBondContact O-N 2.9Å; K198-S202 PolarHBondContact O-OG 2.76Å; C199-S202 PolarHBondContact O-OG 2.75Å; S202-V205 PolarHBondContact O-N 3.45Å; S202-A206 WeakPolarHBondContact O-CB 3.37Å; S202-A206 PolarHBondContact O-N 2.79Å |
| 203 | R | 96.6 | Very high | 93.9 | Very high | 184 Ų | 184 | 84.4 Ų | 84.4 | 69% | 0.694 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -65.5 | -40.8 | 173.1 | -177 | 177 | -65.9 | 178.1 | 0.8 | 112.4 | C199 I200 A201 A206 G207 | C199-R203 WeakPolarHBondContact O-CB 3.44Å; C199-R203 PolarHBondContact O-N 2.85Å; I200-R203 PolarHBondContact O-N 3.33Å; A201-R203 VanDerWaalsContact C-N 3.29Å; A201-R203 PolarHBondContact O-N 3.47Å; R203-A206 PolarHBondContact O-N 3.48Å; R203-G207 PolarHBondContact O-N 3.42Å |
| 204 | A | 93.7 | Very high | 93.5 | Very high | 67 Ų | 67 | 84.9 Ų | 84.9 | 55% | 0.554 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.2 | -44.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | I200 A201 G207 E208 | I200-A204 PolarHBondContact O-N 2.83Å; A201-A204 WeakPolarHBondContact O-CB 3.25Å; A201-A204 PolarHBondContact O-N 3.42Å; A201-A204 VanDerWaalsContact O-N 3.15Å; A204-G207 PolarHBondContact O-N 3.35Å; A204-E208 PolarHBondContact O-N 3.42Å |
| 205 | V | 92 | Very high | 93.2 | Very high | 66 Ų | 66 | 84.7 Ų | 84.7 | 40% | 0.4 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.1 | -45.9 | 175.3 | 174.8 | 0 | 0 | 0 | 0 | 111.3 | A201 S202 G207 E208 A209 L325 | A201-V205 WeakPolarHBondContact O-CG2 3.4Å; A201-V205 PolarHBondContact O-N 2.78Å; S202-V205 PolarHBondContact O-N 3.45Å; V205-G207 VanDerWaalsContact C-N 3.29Å; V205-G207 PolarHBondContact O-N 2.81Å; V205-E208 PolarHBondContact O-N 3.36Å; V205-A209 WeakPolarHBondContact O-CB 3.34Å; V205-A209 PolarHBondContact O-N 2.71Å; V205-L325 HydrophobicContact CG1-CD1 4.31Å; V205-L325 HydrophobicContact CG1-CD2 4.38Å; V205-L325 HydrophobicContact CG2-CD2 4.09Å |
| 206 | A | 91.8 | Very high | 92.7 | Very high | 58 Ų | 58 | 79.4 Ų | 79.4 | 48% | 0.479 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62 | -37.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | S202 R203 A210 | S202-A206 WeakPolarHBondContact O-CB 3.37Å; S202-A206 PolarHBondContact O-N 2.79Å; R203-A206 PolarHBondContact O-N 3.48Å; A206-A210 WeakPolarHBondContact O-CB 3.35Å; A206-A210 PolarHBondContact O-N 3.34Å |
| 207 | G | 92.6 | Very high | 92.4 | Very high | 42 Ų | 42 | 77.6 Ų | 77.6 | 43% | 0.433 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -63.1 | -46.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | R203 A204 V205 A210 K211 | R203-G207 PolarHBondContact O-N 3.42Å; A204-G207 PolarHBondContact O-N 3.35Å; V205-G207 VanDerWaalsContact C-N 3.29Å; V205-G207 PolarHBondContact O-N 2.81Å; G207-A210 PolarHBondContact O-N 2.86Å; G207-K211 WeakPolarHBondContact O-CB 3.25Å; G207-K211 PolarHBondContact O-N 2.87Å |
| 208 | E | 90.1 | Very high | 92.2 | Very high | 53 Ų | 53 | 78.3 Ų | 78.3 | 25% | 0.248 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -68.1 | -40.4 | 177.1 | -166.9 | 58.5 | -140.1 | 0 | 0 | 111.2 | A204 V205 A210 K211 H212 | A204-E208 PolarHBondContact O-N 3.42Å; V205-E208 PolarHBondContact O-N 3.36Å; E208-A210 VanDerWaalsContact C-N 3.34Å; E208-A210 PolarHBondContact O-N 3.5Å; E208-K211 WeakPolarHBondContact O-CB 3.49Å; E208-K211 PolarHBondContact O-N 3.35Å; E208-K211 IonicContact OE1-NZ 3.09Å; E208-K211 PolarHBondContact OE1-NZ 3.37Å; E208-K211 IonicContact OE2-NZ 3.5Å; E208-K211 PolarHBondContact OE2-NZ 3.15Å; E208-K211 VanDerWaalsContact OE2-NZ 3.09Å; E208-H212 PolarHBondContact O-CD2 3.4Å; E208-H212 PolarHBondContact O-N 2.93Å; E208-H212 IonicContact OE1-CD2 3.25Å; E208-H212 IonicContact OE1-CE1 3.71Å; E208-H212 PolarHBondContact OE1-CE1 3.02Å; E208-H212 IonicContact OE1-NE2 2.77Å; E208-H212 PolarHBondContact OE1-NE2 3.02Å |
| 209 | A | 88.3 | Confident | 91.9 | Very high | 54 Ų | 54 | 72.6 Ų | 72.6 | 45% | 0.446 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -59.3 | -42.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | V205 H212 A213 | V205-A209 WeakPolarHBondContact O-CB 3.34Å; V205-A209 PolarHBondContact O-N 2.71Å; A209-H212 PolarHBondContact O-N 3.34Å; A209-A213 WeakPolarHBondContact O-CB 3.24Å; A209-A213 PolarHBondContact O-N 3.21Å |
| 210 | A | 92.2 | Very high | 91.7 | Very high | 54 Ų | 54 | 72.3 Ų | 72.3 | 45% | 0.446 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -64.7 | -41.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A206 G207 E208 H212 A213 T214 | A206-A210 WeakPolarHBondContact O-CB 3.35Å; A206-A210 PolarHBondContact O-N 3.34Å; G207-A210 PolarHBondContact O-N 2.86Å; E208-A210 VanDerWaalsContact C-N 3.34Å; E208-A210 PolarHBondContact O-N 3.5Å; A210-H212 VanDerWaalsContact C-N 3.35Å; A210-H212 PolarHBondContact O-N 3.29Å; A210-A213 PolarHBondContact O-N 3.06Å; A210-T214 WeakPolarHBondContact O-CG2 3.48Å; A210-T214 PolarHBondContact O-N 3.47Å; A210-T214 PolarHBondContact O-OG1 2.79Å |
| 211 | K | 90.7 | Very high | 91.5 | Very high | 120 Ų | 120 | 72.3 Ų | 72.3 | 52% | 0.522 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -60.8 | -41.6 | 174.1 | 176.2 | 171.7 | 153.3 | -118.9 | 0 | 112 | G207 E208 T214 M215 | G207-K211 WeakPolarHBondContact O-CB 3.25Å; G207-K211 PolarHBondContact O-N 2.87Å; E208-K211 WeakPolarHBondContact O-CB 3.49Å; E208-K211 PolarHBondContact O-N 3.35Å; E208-K211 IonicContact OE1-NZ 3.09Å; E208-K211 PolarHBondContact OE1-NZ 3.37Å; E208-K211 IonicContact OE2-NZ 3.5Å; E208-K211 PolarHBondContact OE2-NZ 3.15Å; E208-K211 VanDerWaalsContact OE2-NZ 3.09Å; K211-T214 PolarHBondContact O-OG1 3.41Å; K211-M215 WeakPolarHBondContact O-CB 3.45Å; K211-M215 PolarHBondContact O-N 2.95Å |
| 212 | H | 86.1 | Confident | 91.4 | Very high | 32 Ų | 32 | 71.9 Ų | 71.9 | 15% | 0.148 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -67.3 | -40.8 | 174.1 | -72.4 | -61.5 | 0 | 0 | 0 | 113.2 | E208 A209 A210 T214 M215 S216 F317 | E208-H212 PolarHBondContact O-CD2 3.4Å; E208-H212 PolarHBondContact O-N 2.93Å; E208-H212 IonicContact OE1-CD2 3.25Å; E208-H212 IonicContact OE1-CE1 3.71Å; E208-H212 PolarHBondContact OE1-CE1 3.02Å; E208-H212 IonicContact OE1-NE2 2.77Å; E208-H212 PolarHBondContact OE1-NE2 3.02Å; A209-H212 PolarHBondContact O-N 3.34Å; A210-H212 VanDerWaalsContact C-N 3.35Å; A210-H212 PolarHBondContact O-N 3.29Å; H212-T214 VanDerWaalsContact C-N 3.34Å; H212-T214 PolarHBondContact O-N 2.96Å; H212-M215 PolarHBondContact O-N 3.34Å; H212-S216 WeakPolarHBondContact O-CB 3.47Å; H212-S216 PolarHBondContact O-N 3.35Å; H212-F317 AromaticContact CE1-CD1 3.34Å; H212-F317 WeakPolarHBondContact CE1-CD1 3.34Å; H212-F317 AromaticContact CE1-CE1 3.4Å; H212-F317 WeakPolarHBondContact CE1-CE1 3.33Å; H212-F317 AromaticContact NE2-CD1 3.41Å; H212-F317 WeakPolarHBondContact NE2-CD1 3.48Å; H212-F317 AromaticContact NE2-CE1 3.07Å; H212-F317 WeakPolarHBondContact NE2-CE1 3.41Å |
| 213 | A | 89.6 | Confident | 91.3 | Very high | 57 Ų | 57 | 70 Ų | 70 | 47% | 0.471 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -59.3 | -46.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111 | A209 A210 M215 S216 V217 | A209-A213 WeakPolarHBondContact O-CB 3.24Å; A209-A213 PolarHBondContact O-N 3.21Å; A210-A213 PolarHBondContact O-N 3.06Å; A213-M215 PolarHBondContact O-N 2.9Å; A213-S216 PolarHBondContact O-N 2.71Å; A213-V217 VanDerWaalsContact O-CG2 3.3Å; A213-V217 WeakPolarHBondContact O-CG2 3.39Å; A213-V217 PolarHBondContact O-N 2.88Å |
| 214 | T | 91.1 | Very high | 91.2 | Very high | 94 Ų | 94 | 69 Ų | 69 | 58% | 0.577 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -62.7 | -41.3 | 176.3 | 55.9 | 0 | 0 | 0 | 0 | 112.7 | A210 K211 H212 V217 H218 | A210-T214 WeakPolarHBondContact O-CG2 3.48Å; A210-T214 PolarHBondContact O-N 3.47Å; A210-T214 PolarHBondContact O-OG1 2.79Å; K211-T214 PolarHBondContact O-OG1 3.41Å; H212-T214 VanDerWaalsContact C-N 3.34Å; H212-T214 PolarHBondContact O-N 2.96Å; T214-V217 PolarHBondContact O-N 2.71Å; T214-H218 WeakPolarHBondContact O-CB 2.92Å; T214-H218 PolarHBondContact O-N 3.36Å |
| 215 | M | 90.3 | Very high | 91.2 | Very high | 81 Ų | 81 | 70.1 Ų | 70.1 | 40% | 0.399 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -64.6 | -42 | 175.7 | -174.2 | 162.8 | 73.4 | 0 | 0 | 112.5 | K211 H212 A213 H218 Q219 L314 | K211-M215 WeakPolarHBondContact O-CB 3.45Å; K211-M215 PolarHBondContact O-N 2.95Å; H212-M215 PolarHBondContact O-N 3.34Å; A213-M215 PolarHBondContact O-N 2.9Å; M215-H218 PolarHBondContact O-N 3.04Å; M215-Q219 PolarHBondContact O-N 3.42Å; M215-L314 HydrophobicContact CE-CD1 4.41Å; M215-L314 HydrophobicContact CE-CD2 3.36Å; M215-L314 HydrophobicContact CE-CG 3.92Å |
| 216 | S | 88.3 | Confident | 91.3 | Very high | 65 Ų | 65 | 67.1 Ų | 67.1 | 46% | 0.455 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -64.6 | -41.6 | 176.5 | -177.4 | 0 | 0 | 0 | 0 | 111.8 | H212 A213 Q219 A220 | H212-S216 WeakPolarHBondContact O-CB 3.47Å; H212-S216 PolarHBondContact O-N 3.35Å; A213-S216 PolarHBondContact O-N 2.71Å; S216-Q219 PolarHBondContact O-N 2.9Å; S216-A220 WeakPolarHBondContact O-CB 3.11Å; S216-A220 PolarHBondContact O-N 2.93Å |
| 217 | V | 92.1 | Very high | 91.5 | Very high | 80 Ų | 80 | 69.3 Ų | 69.3 | 49% | 0.485 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.9 | -44.7 | 175.6 | 168.8 | 0 | 0 | 0 | 0 | 110.5 | A213 T214 Q219 A220 H221 | A213-V217 VanDerWaalsContact O-CG2 3.3Å; A213-V217 WeakPolarHBondContact O-CG2 3.39Å; A213-V217 PolarHBondContact O-N 2.88Å; T214-V217 PolarHBondContact O-N 2.71Å; V217-Q219 VanDerWaalsContact C-N 3.35Å; V217-Q219 PolarHBondContact O-N 3.06Å; V217-A220 PolarHBondContact O-N 2.92Å; V217-H221 PolarHBondContact O-CD2 3.41Å; V217-H221 PolarHBondContact O-N 2.99Å |
| 218 | H | 91.8 | Very high | 91.7 | Very high | 104 Ų | 104 | 69.9 Ų | 69.9 | 48% | 0.481 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.1 | -45.2 | 175.3 | -179.9 | 68.1 | 0 | 0 | 0 | 111.9 | T214 M215 A220 H221 L222 | T214-H218 WeakPolarHBondContact O-CB 2.92Å; T214-H218 PolarHBondContact O-N 3.36Å; M215-H218 PolarHBondContact O-N 3.04Å; H218-A220 PolarHBondContact O-N 2.91Å; H218-H221 WeakPolarHBondContact O-CB 3.38Å; H218-H221 PolarHBondContact O-N 2.77Å; H218-L222 WeakPolarHBondContact O-CG 3.27Å; H218-L222 PolarHBondContact O-N 3.29Å |
| 219 | Q | 89.4 | Confident | 92 | Very high | 21 Ų | 21 | 70.1 Ų | 70.1 | 10% | 0.098 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -64.1 | -40.1 | 176.4 | -170.9 | -179.8 | 13.3 | 0 | 0 | 112.3 | M215 S216 V217 H221 L222 A223 V307 | M215-Q219 PolarHBondContact O-N 3.42Å; S216-Q219 PolarHBondContact O-N 2.9Å; V217-Q219 VanDerWaalsContact C-N 3.35Å; V217-Q219 PolarHBondContact O-N 3.06Å; Q219-H221 VanDerWaalsContact C-N 3.27Å; Q219-H221 PolarHBondContact O-N 3.35Å; Q219-L222 PolarHBondContact O-N 3.3Å; Q219-A223 WeakPolarHBondContact O-CB 3.31Å; Q219-A223 PolarHBondContact O-N 3.29Å; Q219-V307 HydrophobicContact CG-CG1 4.37Å; Q219-V307 PolarHBondContact NE2-O 3.12Å |
| 220 | A | 91.3 | Very high | 92.3 | Very high | 57 Ų | 57 | 70.1 Ų | 70.1 | 47% | 0.471 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.5 | -37.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | S216 V217 H218 A223 R224 | S216-A220 WeakPolarHBondContact O-CB 3.11Å; S216-A220 PolarHBondContact O-N 2.93Å; V217-A220 PolarHBondContact O-N 2.92Å; H218-A220 PolarHBondContact O-N 2.91Å; A220-A223 PolarHBondContact O-N 3.49Å; A220-R224 WeakPolarHBondContact O-CB 3.36Å; A220-R224 PolarHBondContact O-N 2.95Å |
| 221 | H | 94.8 | Very high | 92.5 | Very high | 105 Ų | 105 | 72.7 Ų | 72.7 | 49% | 0.486 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.3 | -43.8 | 172.9 | -73.5 | -53 | 0 | 0 | 0 | 112.7 | V217 H218 Q219 R224 H225 | V217-H221 PolarHBondContact O-CD2 3.41Å; V217-H221 PolarHBondContact O-N 2.99Å; H218-H221 WeakPolarHBondContact O-CB 3.38Å; H218-H221 PolarHBondContact O-N 2.77Å; Q219-H221 VanDerWaalsContact C-N 3.27Å; Q219-H221 PolarHBondContact O-N 3.35Å; H221-R224 PolarHBondContact O-N 3.44Å; H221-H225 WeakPolarHBondContact O-CB 3.21Å; H221-H225 PolarHBondContact O-N 3.24Å |
| 222 | L | 91.5 | Very high | 92.7 | Very high | 47 Ų | 47 | 69 Ų | 69 | 25% | 0.246 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -63 | -43.5 | 175.7 | -66.2 | 176.3 | 0 | 0 | 0 | 111.6 | H218 Q219 R224 H225 A226 Y306 V307 | H218-L222 WeakPolarHBondContact O-CG 3.27Å; H218-L222 PolarHBondContact O-N 3.29Å; Q219-L222 PolarHBondContact O-N 3.3Å; L222-R224 PolarHBondContact O-N 2.91Å; L222-H225 PolarHBondContact O-N 3.43Å; L222-A226 PolarHBondContact O-N 3Å; L222-Y306 HydrophobicContact CD1-CE1 4.07Å; L222-V307 HydrophobicContact CB-CG2 3.68Å |
| 223 | A | 91.9 | Very high | 93.1 | Very high | 30 Ų | 30 | 70 Ų | 70 | 25% | 0.248 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -59.4 | -46 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q219 A220 H225 A226 L227 V307 | Q219-A223 WeakPolarHBondContact O-CB 3.31Å; Q219-A223 PolarHBondContact O-N 3.29Å; A220-A223 PolarHBondContact O-N 3.49Å; A223-H225 VanDerWaalsContact C-N 3.3Å; A223-H225 PolarHBondContact O-N 2.83Å; A223-A226 PolarHBondContact O-N 3.05Å; A223-L227 WeakPolarHBondContact O-CB 3.28Å; A223-L227 WeakPolarHBondContact O-CG 3.41Å; A223-L227 PolarHBondContact O-N 3.47Å; A223-V307 HydrophobicContact CB-CG1 3.72Å |
| 224 | R | 95 | Very high | 93.4 | Very high | 163 Ų | 163 | 72.5 Ų | 72.5 | 62% | 0.615 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -62 | -39 | 177.1 | -170.5 | -175.3 | 66.7 | 77.9 | 0.5 | 111.8 | A220 H221 L222 A228 | A220-R224 WeakPolarHBondContact O-CB 3.36Å; A220-R224 PolarHBondContact O-N 2.95Å; H221-R224 PolarHBondContact O-N 3.44Å; L222-R224 PolarHBondContact O-N 2.91Å; R224-A228 WeakPolarHBondContact O-CB 3.43Å; R224-A228 PolarHBondContact O-N 2.92Å |
| 225 | H | 94.6 | Very high | 93.5 | Very high | 89 Ų | 89 | 70.3 Ų | 70.3 | 41% | 0.412 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -66.5 | -46.5 | 176.7 | -174.8 | -99.8 | 0 | 0 | 0 | 111.5 | H221 L222 A223 L227 A228 H229 | H221-H225 WeakPolarHBondContact O-CB 3.21Å; H221-H225 PolarHBondContact O-N 3.24Å; L222-H225 PolarHBondContact O-N 3.43Å; A223-H225 VanDerWaalsContact C-N 3.3Å; A223-H225 PolarHBondContact O-N 2.83Å; H225-L227 PolarHBondContact O-N 3.47Å; H225-A228 WeakPolarHBondContact O-CB 3.49Å; H225-A228 PolarHBondContact O-N 3.07Å; H225-H229 AromaticContact CE1-CD2 3.37Å; H225-H229 PolarHBondContact CE1-CD2 3.14Å; H225-H229 AromaticContact CE1-NE2 3.05Å; H225-H229 PolarHBondContact CE1-NE2 3.21Å; H225-H229 AromaticContact ND1-CD2 3.64Å; H225-H229 AromaticContact ND1-NE2 3.8Å; H225-H229 AromaticContact NE2-CD2 3.74Å; H225-H229 AromaticContact NE2-NE2 3.2Å; H225-H229 PolarHBondContact NE2-NE2 3.12Å; H225-H229 VanDerWaalsContact NE2-NE2 3.2Å; H225-H229 PolarHBondContact O-CD2 3.48Å; H225-H229 VanDerWaalsContact O-CD2 3.3Å; H225-H229 PolarHBondContact O-N 3.05Å; H225-H229 VanDerWaalsContact O-N 3.15Å |
| 226 | A | 94.1 | Very high | 93.8 | Very high | 3 Ų | 3 | 70.3 Ų | 70.3 | 3% | 0.025 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -58.6 | -46.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | L222 A223 A228 H229 L230 L303 A304 | L222-A226 PolarHBondContact O-N 3Å; A223-A226 PolarHBondContact O-N 3.05Å; A226-A228 VanDerWaalsContact C-N 3.3Å; A226-A228 PolarHBondContact O-N 3.34Å; A226-H229 PolarHBondContact O-N 2.96Å; A226-L230 WeakPolarHBondContact O-CG 3.34Å; A226-L230 PolarHBondContact O-N 3.3Å; A226-L303 HydrophobicContact CB-CB 3.81Å; A226-A304 HydrophobicContact CB-CB 4.24Å |
| 227 | L | 95.4 | Very high | 94.1 | Very high | 104 Ų | 104 | 71.6 Ų | 71.6 | 55% | 0.545 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -61.1 | -37 | 176.2 | -72.8 | 173.4 | 0 | 0 | 0 | 112.6 | A223 H225 L230 L231 | A223-L227 WeakPolarHBondContact O-CB 3.28Å; A223-L227 WeakPolarHBondContact O-CG 3.41Å; A223-L227 PolarHBondContact O-N 3.47Å; H225-L227 PolarHBondContact O-N 3.47Å; L227-L230 PolarHBondContact O-N 3.44Å; L227-L231 WeakPolarHBondContact O-CB 3.47Å; L227-L231 VanDerWaalsContact O-CG 3.24Å; L227-L231 WeakPolarHBondContact O-CG 3.31Å; L227-L231 PolarHBondContact O-N 3.32Å |
| 228 | A | 96 | Very high | 94.1 | Very high | 54 Ų | 54 | 72.1 Ų | 72.1 | 45% | 0.446 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -63.9 | -42.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | R224 H225 A226 G232 | R224-A228 WeakPolarHBondContact O-CB 3.43Å; R224-A228 PolarHBondContact O-N 2.92Å; H225-A228 WeakPolarHBondContact O-CB 3.49Å; H225-A228 PolarHBondContact O-N 3.07Å; A226-A228 VanDerWaalsContact C-N 3.3Å; A226-A228 PolarHBondContact O-N 3.34Å; A228-G232 PolarHBondContact O-N 2.82Å |
| 229 | H | 96.3 | Very high | 94.3 | Very high | 59 Ų | 59 | 74.3 Ų | 74.3 | 27% | 0.273 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.8 | -50.3 | 174.3 | -79.7 | -76 | 0 | 0 | 0 | 111.7 | H225 A226 L231 G232 E233 | H225-H229 AromaticContact CE1-CD2 3.37Å; H225-H229 PolarHBondContact CE1-CD2 3.14Å; H225-H229 AromaticContact CE1-NE2 3.05Å; H225-H229 PolarHBondContact CE1-NE2 3.21Å; H225-H229 AromaticContact ND1-CD2 3.64Å; H225-H229 AromaticContact ND1-NE2 3.8Å; H225-H229 AromaticContact NE2-CD2 3.74Å; H225-H229 AromaticContact NE2-NE2 3.2Å; H225-H229 PolarHBondContact NE2-NE2 3.12Å; H225-H229 VanDerWaalsContact NE2-NE2 3.2Å; H225-H229 PolarHBondContact O-CD2 3.48Å; H225-H229 VanDerWaalsContact O-CD2 3.3Å; H225-H229 PolarHBondContact O-N 3.05Å; H225-H229 VanDerWaalsContact O-N 3.15Å; A226-H229 PolarHBondContact O-N 2.96Å; H229-L231 VanDerWaalsContact C-N 3.32Å; H229-L231 PolarHBondContact O-N 3.24Å; H229-G232 WeakPolarHBondContact O-CA 3.21Å; H229-G232 PolarHBondContact O-N 3.09Å; H229-E233 WeakPolarHBondContact O-CG 3.37Å; H229-E233 PolarHBondContact O-N 3.14Å |
| 230 | L | 95.7 | Very high | 94.5 | Very high | 53 Ų | 53 | 80 Ų | 80 | 28% | 0.277 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -59.3 | -39.6 | 178.6 | -71.5 | 175.5 | 0 | 0 | 0 | 113 | A226 L227 R234 E301 A304 | A226-L230 WeakPolarHBondContact O-CG 3.34Å; A226-L230 PolarHBondContact O-N 3.3Å; L227-L230 PolarHBondContact O-N 3.44Å; L230-R234 WeakPolarHBondContact O-CB 3.32Å; L230-R234 PolarHBondContact O-N 3.39Å; L230-E301 HydrophobicContact CD2-CG 3.98Å; L230-A304 HydrophobicContact CD1-CB 3.83Å |
| 231 | L | 95.7 | Very high | 94.6 | Very high | 109 Ų | 109 | 78.6 Ų | 78.6 | 57% | 0.571 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -68 | -36.4 | 175.8 | -73.5 | 173.7 | 0 | 0 | 0 | 112.1 | L227 H229 A235 | L227-L231 WeakPolarHBondContact O-CB 3.47Å; L227-L231 VanDerWaalsContact O-CG 3.24Å; L227-L231 WeakPolarHBondContact O-CG 3.31Å; L227-L231 PolarHBondContact O-N 3.32Å; H229-L231 VanDerWaalsContact C-N 3.32Å; H229-L231 PolarHBondContact O-N 3.24Å; L231-A235 WeakPolarHBondContact O-CB 3.41Å; L231-A235 PolarHBondContact O-N 2.96Å |
| 232 | G | 95.6 | Very high | 94.4 | Very high | 42 Ų | 42 | 76.4 Ų | 76.4 | 43% | 0.433 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -64.3 | -49.7 | 174 | 0 | 0 | 0 | 0 | 0 | 112.3 | A228 H229 R234 A235 Q236 | A228-G232 PolarHBondContact O-N 2.82Å; H229-G232 WeakPolarHBondContact O-CA 3.21Å; H229-G232 PolarHBondContact O-N 3.09Å; G232-R234 PolarHBondContact O-N 3.25Å; G232-A235 WeakPolarHBondContact O-CB 3.4Å; G232-A235 PolarHBondContact O-N 3.05Å; G232-A235 VanDerWaalsContact O-N 3.15Å; G232-Q236 PolarHBondContact O-N 2.91Å |
| 233 | E | 94.5 | Very high | 94.4 | Very high | 52 Ų | 52 | 79.4 Ų | 79.4 | 24% | 0.243 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -59.6 | -45.2 | 175.9 | -69.6 | 171.4 | -177.4 | 0 | 0 | 111.2 | H229 A235 Q236 I237 T298 G300 | H229-E233 WeakPolarHBondContact O-CG 3.37Å; H229-E233 PolarHBondContact O-N 3.14Å; E233-A235 VanDerWaalsContact C-N 3.3Å; E233-A235 PolarHBondContact O-N 2.97Å; E233-Q236 WeakPolarHBondContact O-CB 3.35Å; E233-Q236 PolarHBondContact O-N 3.11Å; E233-Q236 VanDerWaalsContact O-N 3.09Å; E233-I237 WeakPolarHBondContact O-CG1 3.47Å; E233-I237 PolarHBondContact O-N 3.08Å; E233-T298 VanDerWaalsContact CD-OG1 3.25Å; E233-T298 VanDerWaalsContact OE1-CB 3.3Å; E233-T298 WeakPolarHBondContact OE1-CB 3.47Å; E233-T298 PolarHBondContact OE1-OG1 2.85Å; E233-T298 VanDerWaalsContact OE2-CB 3.28Å; E233-T298 WeakPolarHBondContact OE2-CB 3.37Å; E233-T298 PolarHBondContact OE2-OG1 2.88Å; E233-G300 PolarHBondContact OE1-N 3.42Å |
| 234 | R | 95 | Very high | 94.4 | Very high | 110 Ų | 110 | 79.4 Ų | 79.4 | 42% | 0.415 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -59.9 | -39.3 | 174.7 | 180 | -179.7 | 173.8 | -91.3 | 10.4 | 112.6 | L230 G232 Q236 R238 T269 | L230-R234 WeakPolarHBondContact O-CB 3.32Å; L230-R234 PolarHBondContact O-N 3.39Å; G232-R234 PolarHBondContact O-N 3.25Å; R234-Q236 VanDerWaalsContact C-N 3.31Å; R234-R238 WeakPolarHBondContact O-CB 3.47Å; R234-R238 PolarHBondContact O-N 3.47Å; R234-T269 HydrophobicContact CG-CG2 4.41Å; R234-T269 VanDerWaalsContact CZ-OG1 3.31Å; R234-T269 PolarHBondContact NE-OG1 3.01Å; R234-T269 PolarHBondContact NH2-OG1 3.41Å |
| 235 | A | 94.7 | Very high | 94.2 | Very high | 49 Ų | 49 | 72.6 Ų | 72.6 | 41% | 0.405 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -65.3 | -38.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111 | L231 G232 E233 R238 R239 | L231-A235 WeakPolarHBondContact O-CB 3.41Å; L231-A235 PolarHBondContact O-N 2.96Å; G232-A235 WeakPolarHBondContact O-CB 3.4Å; G232-A235 PolarHBondContact O-N 3.05Å; G232-A235 VanDerWaalsContact O-N 3.15Å; E233-A235 VanDerWaalsContact C-N 3.3Å; E233-A235 PolarHBondContact O-N 2.97Å; A235-R238 PolarHBondContact O-N 3.03Å; A235-R239 WeakPolarHBondContact O-CG 3.39Å; A235-R239 PolarHBondContact O-N 3.02Å |
| 236 | Q | 95.4 | Very high | 94 | Very high | 81 Ų | 81 | 72 Ų | 72 | 38% | 0.379 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -65.4 | -45.9 | 175.7 | -170.5 | 64.7 | 8.5 | 0 | 0 | 112.1 | G232 E233 R234 R238 R239 Y240 | G232-Q236 PolarHBondContact O-N 2.91Å; E233-Q236 WeakPolarHBondContact O-CB 3.35Å; E233-Q236 PolarHBondContact O-N 3.11Å; E233-Q236 VanDerWaalsContact O-N 3.09Å; R234-Q236 VanDerWaalsContact C-N 3.31Å; Q236-R238 VanDerWaalsContact C-N 3.29Å; Q236-R238 PolarHBondContact O-N 2.9Å; Q236-R239 WeakPolarHBondContact O-CB 3.37Å; Q236-R239 PolarHBondContact O-N 3.48Å; Q236-R239 VanDerWaalsContact O-N 3.09Å; Q236-Y240 HydrophobicContact CG-CD2 4.1Å; Q236-Y240 HydrophobicContact CG-CE2 3.51Å; Q236-Y240 PolarHBondContact NE2-OH 2.93Å; Q236-Y240 WeakPolarHBondContact O-CD2 3.42Å; Q236-Y240 PolarHBondContact O-N 3.37Å |
| 237 | I | 94.1 | Very high | 93.8 | Very high | 92 Ų | 92 | 77.6 Ų | 77.6 | 47% | 0.472 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -57.1 | -45.4 | 174.3 | -67.6 | 164.9 | 0 | 0 | 0 | 110.5 | E233 R239 Y240 L241 T269 | E233-I237 WeakPolarHBondContact O-CG1 3.47Å; E233-I237 PolarHBondContact O-N 3.08Å; I237-R239 VanDerWaalsContact C-N 3.29Å; I237-R239 PolarHBondContact O-N 3.39Å; I237-Y240 PolarHBondContact O-N 3.42Å; I237-L241 HydrophobicContact CG2-CD1 3.85Å; I237-L241 HydrophobicContact CG2-CG 4.33Å; I237-L241 WeakPolarHBondContact O-CG 3.36Å; I237-L241 PolarHBondContact O-N 2.99Å; I237-T269 HydrophobicContact CG2-CG2 4.43Å |
| 238 | R | 93.9 | Very high | 93.5 | Very high | 90 Ų | 90 | 74.7 Ų | 74.7 | 34% | 0.34 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -59.1 | -40.3 | 177.1 | -178.1 | 180 | -69.9 | -166.4 | -10.6 | 111.9 | R234 A235 Q236 S242 T269 L272 | R234-R238 WeakPolarHBondContact O-CB 3.47Å; R234-R238 PolarHBondContact O-N 3.47Å; A235-R238 PolarHBondContact O-N 3.03Å; Q236-R238 VanDerWaalsContact C-N 3.29Å; Q236-R238 PolarHBondContact O-N 2.9Å; R238-S242 WeakPolarHBondContact O-CB 3.3Å; R238-S242 PolarHBondContact O-N 3.07Å; R238-S242 PolarHBondContact O-OG 2.85Å; R238-T269 HydrophobicContact CB-CG2 4.41Å; R238-T269 PolarHBondContact NE-OG1 3.45Å; R238-T269 PolarHBondContact NH2-OG1 2.91Å; R238-L272 HydrophobicContact CG-CD1 3.82Å |
| 239 | R | 94.8 | Very high | 93.2 | Very high | 150 Ų | 150 | 73.3 Ų | 73.3 | 57% | 0.566 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -63 | -48.1 | 176 | -72.3 | 178.6 | 68.3 | 152.8 | 2.8 | 111.4 | A235 Q236 I237 L241 S242 Q243 | A235-R239 WeakPolarHBondContact O-CG 3.39Å; A235-R239 PolarHBondContact O-N 3.02Å; Q236-R239 WeakPolarHBondContact O-CB 3.37Å; Q236-R239 PolarHBondContact O-N 3.48Å; Q236-R239 VanDerWaalsContact O-N 3.09Å; I237-R239 VanDerWaalsContact C-N 3.29Å; I237-R239 PolarHBondContact O-N 3.39Å; R239-L241 PolarHBondContact O-N 3.02Å; R239-S242 WeakPolarHBondContact CA-OG 3.24Å; R239-S242 PolarHBondContact O-N 3.03Å; R239-S242 PolarHBondContact O-OG 3.36Å; R239-Q243 WeakPolarHBondContact O-CG 3.36Å; R239-Q243 PolarHBondContact O-N 3.32Å; R239-Q243 VanDerWaalsContact O-N 3.12Å |
| 240 | Y | 94.9 | Very high | 92.8 | Very high | 142 Ų | 142 | 74 Ų | 74 | 56% | 0.557 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -60 | -45.5 | 177.5 | -68.3 | -50.2 | 0 | 0 | 0 | 112.3 | Q236 I237 S242 Q243 A244 | Q236-Y240 HydrophobicContact CG-CD2 4.1Å; Q236-Y240 HydrophobicContact CG-CE2 3.51Å; Q236-Y240 PolarHBondContact NE2-OH 2.93Å; Q236-Y240 WeakPolarHBondContact O-CD2 3.42Å; Q236-Y240 PolarHBondContact O-N 3.37Å; I237-Y240 PolarHBondContact O-N 3.42Å; Y240-S242 PolarHBondContact O-N 3.07Å; Y240-Q243 PolarHBondContact O-N 3.05Å; Y240-Q243 VanDerWaalsContact O-N 3.17Å; Y240-A244 WeakPolarHBondContact O-CB 3.42Å; Y240-A244 PolarHBondContact O-N 2.64Å |
| 241 | L | 92.5 | Very high | 92.6 | Very high | 26 Ų | 26 | 76.6 Ų | 76.6 | 14% | 0.136 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -61.8 | -42.9 | 176.6 | -69.6 | 171.5 | 0 | 0 | 0 | 112.1 | I237 R239 Q243 A244 I245 T269 L272 A273 C276 | I237-L241 HydrophobicContact CG2-CD1 3.85Å; I237-L241 HydrophobicContact CG2-CG 4.33Å; I237-L241 WeakPolarHBondContact O-CG 3.36Å; I237-L241 PolarHBondContact O-N 2.99Å; R239-L241 PolarHBondContact O-N 3.02Å; L241-Q243 PolarHBondContact O-N 2.88Å; L241-A244 PolarHBondContact O-N 3.24Å; L241-I245 WeakPolarHBondContact O-CD1 3.14Å; L241-I245 VanDerWaalsContact O-CG1 3.28Å; L241-I245 WeakPolarHBondContact O-CG1 3.41Å; L241-I245 PolarHBondContact O-N 2.96Å; L241-T269 HydrophobicContact CD1-CG2 4.41Å; L241-L272 HydrophobicContact CB-CB 4.19Å; L241-L272 HydrophobicContact CD1-CB 4.09Å; L241-A273 HydrophobicContact CD1-CB 4Å; L241-C276 HydrophobicContact CD2-CB 3.89Å |
| 242 | S | 91 | Very high | 92.2 | Very high | 60 Ų | 60 | 71.4 Ų | 71.4 | 42% | 0.42 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.3 | -23.3 | 178.2 | 69.3 | 0 | 0 | 0 | 0 | 113.7 | R238 R239 Y240 P246 | R238-S242 WeakPolarHBondContact O-CB 3.3Å; R238-S242 PolarHBondContact O-N 3.07Å; R238-S242 PolarHBondContact O-OG 2.85Å; R239-S242 WeakPolarHBondContact CA-OG 3.24Å; R239-S242 PolarHBondContact O-N 3.03Å; R239-S242 PolarHBondContact O-OG 3.36Å; Y240-S242 PolarHBondContact O-N 3.07Å; S242-P246 WeakPolarHBondContact O-CD 3.34Å; S242-P246 WeakPolarHBondContact O-CG 3.4Å |
| 243 | Q | 92.1 | Very high | 91.8 | Very high | 110 Ų | 110 | 74.1 Ų | 74.1 | 51% | 0.514 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -89.9 | -35.9 | 174.9 | -67.9 | 175.3 | 20.2 | 0 | 0 | 111.9 | R239 Y240 L241 P246 L247 | R239-Q243 WeakPolarHBondContact O-CG 3.36Å; R239-Q243 PolarHBondContact O-N 3.32Å; R239-Q243 VanDerWaalsContact O-N 3.12Å; Y240-Q243 PolarHBondContact O-N 3.05Å; Y240-Q243 VanDerWaalsContact O-N 3.17Å; L241-Q243 PolarHBondContact O-N 2.88Å; Q243-P246 WeakPolarHBondContact O-CD 3.44Å; Q243-L247 WeakPolarHBondContact O-CG 3.23Å |
| 244 | A | 91.6 | Very high | 91.5 | Very high | 30 Ų | 30 | 78.5 Ų | 78.5 | 25% | 0.248 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -68.6 | -42.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y240 L241 L247 L248 | Y240-A244 WeakPolarHBondContact O-CB 3.42Å; Y240-A244 PolarHBondContact O-N 2.64Å; L241-A244 PolarHBondContact O-N 3.24Å; A244-L247 WeakPolarHBondContact O-CB 3.35Å; A244-L247 PolarHBondContact O-N 2.88Å; A244-L247 VanDerWaalsContact O-N 3.09Å; A244-L248 HydrophobicContact CB-CD1 4.43Å; A244-L248 WeakPolarHBondContact O-CD1 3.39Å; A244-L248 PolarHBondContact O-N 3.36Å |
| 245 | I | 90.3 | Very high | 91.2 | Very high | 20 Ų | 20 | 78.5 Ų | 78.5 | 10% | 0.103 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -57.5 | -49.3 | -176.5 | -72.7 | 161.4 | 0 | 0 | 0 | 112.6 | L241 L247 L248 S249 L272 L275 C276 L279 | L241-I245 WeakPolarHBondContact O-CD1 3.14Å; L241-I245 VanDerWaalsContact O-CG1 3.28Å; L241-I245 WeakPolarHBondContact O-CG1 3.41Å; L241-I245 PolarHBondContact O-N 2.96Å; I245-L247 VanDerWaalsContact C-N 3.31Å; I245-L247 PolarHBondContact O-N 3.39Å; I245-L248 PolarHBondContact O-N 3.02Å; I245-S249 VanDerWaalsContact O-CB 3.29Å; I245-S249 WeakPolarHBondContact O-CB 3.34Å; I245-S249 PolarHBondContact O-N 3.26Å; I245-L272 HydrophobicContact CD1-CB 4.15Å; I245-L272 HydrophobicContact CD1-CD2 3.5Å; I245-L272 VanDerWaalsContact CD1-CD2 3.5Å; I245-L272 HydrophobicContact CD1-CG 4.43Å; I245-L275 HydrophobicContact CB-CD2 4.3Å; I245-L275 HydrophobicContact CD1-CD2 3.76Å; I245-L275 HydrophobicContact CG1-CD2 3.94Å; I245-L275 HydrophobicContact CG2-CD2 3.4Å; I245-C276 HydrophobicContact CD1-CB 4.46Å; I245-C276 HydrophobicContact CG1-CB 4Å; I245-L279 HydrophobicContact CG2-CD1 4.05Å |
| 246 | P | 89.8 | Confident | 90.6 | Very high | 76 Ų | 76 | 83.3 Ų | 83.3 | 49% | 0.494 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -61 | -36.6 | 175.1 | -25.6 | 34.7 | 0 | 0 | 0 | 113.6 | S242 Q243 S249 D250 | S242-P246 WeakPolarHBondContact O-CD 3.34Å; S242-P246 WeakPolarHBondContact O-CG 3.4Å; Q243-P246 WeakPolarHBondContact O-CD 3.44Å; P246-S249 PolarHBondContact O-N 2.95Å; P246-D250 WeakPolarHBondContact O-CB 3.29Å; P246-D250 PolarHBondContact O-N 3.4Å |
| 247 | L | 90.7 | Very high | 89.9 | Confident | 120 Ų | 120 | 81.3 Ų | 81.3 | 63% | 0.628 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -67.1 | -43 | 177.9 | -65.4 | 172.5 | 0 | 0 | 0 | 111.7 | Q243 A244 I245 Y251 | Q243-L247 WeakPolarHBondContact O-CG 3.23Å; A244-L247 WeakPolarHBondContact O-CB 3.35Å; A244-L247 PolarHBondContact O-N 2.88Å; A244-L247 VanDerWaalsContact O-N 3.09Å; I245-L247 VanDerWaalsContact C-N 3.31Å; I245-L247 PolarHBondContact O-N 3.39Å; L247-Y251 PolarHBondContact O-N 3.33Å |
| 248 | L | 89.6 | Confident | 89.1 | Confident | 44 Ų | 44 | 85 Ų | 85 | 23% | 0.23 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -66.8 | -40.6 | 174.8 | -88.7 | 73.8 | 0 | 0 | 0 | 111.2 | A244 I245 Y251 C252 L279 A280 I283 | A244-L248 HydrophobicContact CB-CD1 4.43Å; A244-L248 WeakPolarHBondContact O-CD1 3.39Å; A244-L248 PolarHBondContact O-N 3.36Å; I245-L248 PolarHBondContact O-N 3.02Å; L248-Y251 WeakPolarHBondContact O-CB 3.47Å; L248-Y251 PolarHBondContact O-N 2.87Å; L248-C252 PolarHBondContact O-N 3.41Å; L248-C252 PolarHBondContact O-SG 2.89Å; L248-L279 HydrophobicContact CB-CB 4.25Å; L248-L279 HydrophobicContact CB-CD1 4.18Å; L248-L279 HydrophobicContact CD2-CB 3.95Å; L248-A280 HydrophobicContact CD2-CB 4.28Å; L248-I283 HydrophobicContact CB-CD1 4.26Å; L248-I283 HydrophobicContact CD2-CD1 4.14Å; L248-I283 HydrophobicContact CG-CD1 3.98Å |
| 249 | S | 87.9 | Confident | 88 | Confident | 25 Ų | 25 | 83 Ų | 83 | 18% | 0.175 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -62.2 | -45.1 | 176 | -177.7 | 0 | 0 | 0 | 0 | 111.8 | I245 P246 Y251 C252 N253 | I245-S249 VanDerWaalsContact O-CB 3.29Å; I245-S249 WeakPolarHBondContact O-CB 3.34Å; I245-S249 PolarHBondContact O-N 3.26Å; P246-S249 PolarHBondContact O-N 2.95Å; S249-Y251 VanDerWaalsContact C-N 3.32Å; S249-Y251 PolarHBondContact O-N 3.35Å; S249-C252 PolarHBondContact O-N 2.98Å; S249-N253 WeakPolarHBondContact O-CB 3.37Å; S249-N253 PolarHBondContact O-N 2.99Å; S249-N253 PolarHBondContact O-ND2 3Å |
| 250 | D | 89.3 | Confident | 86.6 | Confident | 74 Ų | 74 | 82.8 Ų | 82.8 | 40% | 0.396 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -60 | -41.5 | 174 | -179.6 | 59.3 | 0 | 0 | 0 | 111.8 | P246 N253 K254 | P246-D250 WeakPolarHBondContact O-CB 3.29Å; P246-D250 PolarHBondContact O-N 3.4Å; D250-N253 PolarHBondContact O-N 3.38Å; D250-K254 WeakPolarHBondContact O-CG 3.48Å; D250-K254 PolarHBondContact O-N 2.97Å; D250-K254 WeakPolarHBondContact OD1-CE 3.33Å; D250-K254 IonicContact OD1-NZ 3.36Å; D250-K254 VanDerWaalsContact OD2-CE 3.27Å; D250-K254 WeakPolarHBondContact OD2-CE 3.32Å; D250-K254 IonicContact OD2-NZ 2.67Å; D250-K254 PolarHBondContact OD2-NZ 2.98Å |
| 251 | Y | 90.3 | Very high | 85.2 | Confident | 107 Ų | 107 | 84.4 Ų | 84.4 | 42% | 0.42 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61 | -49.1 | 173.2 | -179.4 | -88.2 | 0 | 0 | 0 | 112.1 | L247 L248 S249 N253 K254 H255 I257 I283 | L247-Y251 PolarHBondContact O-N 3.33Å; L248-Y251 WeakPolarHBondContact O-CB 3.47Å; L248-Y251 PolarHBondContact O-N 2.87Å; S249-Y251 VanDerWaalsContact C-N 3.32Å; S249-Y251 PolarHBondContact O-N 3.35Å; Y251-N253 VanDerWaalsContact C-N 3.31Å; Y251-N253 PolarHBondContact O-N 3.4Å; Y251-K254 PolarHBondContact O-N 3.5Å; Y251-H255 AromaticContact CD1-CD2 3.9Å; Y251-H255 AromaticContact CD2-CD2 3.67Å; Y251-H255 AromaticContact CD2-NE2 3.8Å; Y251-H255 AromaticContact CE1-CD2 3.57Å; Y251-H255 AromaticContact CE2-CD2 3.34Å; Y251-H255 WeakPolarHBondContact CE2-CD2 3.38Å; Y251-H255 AromaticContact CE2-NE2 3.2Å; Y251-H255 WeakPolarHBondContact CE2-NE2 3.35Å; Y251-H255 AromaticContact CG-CD2 3.94Å; Y251-H255 AromaticContact CZ-CD2 3.28Å; Y251-H255 AromaticContact CZ-NE2 3.44Å; Y251-H255 PolarHBondContact O-CD2 3.45Å; Y251-H255 VanDerWaalsContact O-CD2 3.27Å; Y251-H255 PolarHBondContact O-N 3.39Å; Y251-H255 VanDerWaalsContact O-N 3.13Å; Y251-I257 HydrophobicContact CE1-CD1 4.45Å; Y251-I283 HydrophobicContact CD1-CD1 3.75Å; Y251-I283 HydrophobicContact CD1-CG1 3.84Å; Y251-I283 HydrophobicContact CD1-CG2 4.22Å; Y251-I283 HydrophobicContact CE1-CB 4.43Å; Y251-I283 HydrophobicContact CE1-CD1 4.28Å; Y251-I283 HydrophobicContact CE1-CG1 4.03Å; Y251-I283 HydrophobicContact CE1-CG2 3.62Å |
| 252 | C | 88.4 | Confident | 83.7 | Confident | 0 Ų | 0 | 87.5 Ų | 87.5 | 0% | 0 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -58.6 | -42.4 | 177.5 | -69.4 | 0 | 0 | 0 | 0 | 112.2 | L248 S249 H255 D256 I257 L259 I283 | L248-C252 PolarHBondContact O-N 3.41Å; L248-C252 PolarHBondContact O-SG 2.89Å; S249-C252 PolarHBondContact O-N 2.98Å; C252-H255 CarbonylContact O-C 3.54Å; C252-H255 PolarHBondContact O-N 3.35Å; C252-D256 PolarHBondContact O-N 2.84Å; C252-I257 HydrophobicContact CB-CB 4.02Å; C252-I257 PolarHBondContact O-N 2.97Å; C252-L259 HydrophobicContact CB-CD1 4Å; C252-L259 HydrophobicContact CB-CD2 4.01Å; C252-L259 HydrophobicContact CB-CG 4.11Å; C252-I283 WeakPolarHBondContact SG-CG1 3.23Å |
| 253 | N | 86.8 | Confident | 82.2 | Confident | 99 Ų | 99 | 88.5 Ų | 88.5 | 53% | 0.529 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -65 | -39.8 | 178 | -68.3 | -34.8 | 0 | 0 | 0 | 112 | S249 D250 Y251 H255 D256 | S249-N253 WeakPolarHBondContact O-CB 3.37Å; S249-N253 PolarHBondContact O-N 2.99Å; S249-N253 PolarHBondContact O-ND2 3Å; D250-N253 PolarHBondContact O-N 3.38Å; Y251-N253 VanDerWaalsContact C-N 3.31Å; Y251-N253 PolarHBondContact O-N 3.4Å; N253-H255 VanDerWaalsContact C-N 3.27Å; N253-H255 PolarHBondContact O-N 2.99Å; N253-D256 PolarHBondContact O-N 2.86Å |
| 254 | K | 89 | Confident | 80.5 | Confident | 144 Ų | 144 | 90.8 Ų | 90.8 | 63% | 0.626 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -67.2 | -26.4 | 176.8 | -76.6 | 170.1 | 177.8 | 165.5 | 0 | 113.7 | D250 Y251 | D250-K254 WeakPolarHBondContact O-CG 3.48Å; D250-K254 PolarHBondContact O-N 2.97Å; D250-K254 WeakPolarHBondContact OD1-CE 3.33Å; D250-K254 IonicContact OD1-NZ 3.36Å; D250-K254 VanDerWaalsContact OD2-CE 3.27Å; D250-K254 WeakPolarHBondContact OD2-CE 3.32Å; D250-K254 IonicContact OD2-NZ 2.67Å; D250-K254 PolarHBondContact OD2-NZ 2.98Å; Y251-K254 PolarHBondContact O-N 3.5Å |
| 255 | H | 87.4 | Confident | 79 | Confident | 109 Ų | 109 | 96.5 Ų | 96.5 | 51% | 0.505 | 48% | 0.484 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.4 | 14.6 | -179.3 | -71.2 | -71.6 | 0 | 0 | 0 | 113.4 | Y251 C252 N253 I257 | Y251-H255 AromaticContact CD1-CD2 3.9Å; Y251-H255 AromaticContact CD2-CD2 3.67Å; Y251-H255 AromaticContact CD2-NE2 3.8Å; Y251-H255 AromaticContact CE1-CD2 3.57Å; Y251-H255 AromaticContact CE2-CD2 3.34Å; Y251-H255 WeakPolarHBondContact CE2-CD2 3.38Å; Y251-H255 AromaticContact CE2-NE2 3.2Å; Y251-H255 WeakPolarHBondContact CE2-NE2 3.35Å; Y251-H255 AromaticContact CG-CD2 3.94Å; Y251-H255 AromaticContact CZ-CD2 3.28Å; Y251-H255 AromaticContact CZ-NE2 3.44Å; Y251-H255 PolarHBondContact O-CD2 3.45Å; Y251-H255 VanDerWaalsContact O-CD2 3.27Å; Y251-H255 PolarHBondContact O-N 3.39Å; Y251-H255 VanDerWaalsContact O-N 3.13Å; C252-H255 CarbonylContact O-C 3.54Å; C252-H255 PolarHBondContact O-N 3.35Å; N253-H255 VanDerWaalsContact C-N 3.27Å; N253-H255 PolarHBondContact O-N 2.99Å; H255-I257 HydrophobicContact CB-CD1 4.17Å; H255-I257 HydrophobicContact CB-CG1 4Å; H255-I257 PolarHBondContact O-N 3.38Å; H255-I257 VanDerWaalsContact O-N 3.17Å |
| 256 | D | 82.3 | Confident | 77.4 | Confident | 150 Ų | 150 | 102.2 Ų | 102.2 | 80% | 0.802 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.5 | 32.1 | -179.4 | -69.8 | -44.3 | 0 | 0 | 0 | 114.3 | C252 N253 K258 | C252-D256 PolarHBondContact O-N 2.84Å; N253-D256 PolarHBondContact O-N 2.86Å; D256-K258 PolarHBondContact O-N 3.42Å |
| 257 | I | 81.8 | Confident | 76.5 | Confident | 39 Ų | 39 | 101.2 Ų | 101.2 | 20% | 0.2 | 51% | 0.514 | C | S | . | . | trans | -77.4 | 119.7 | 178 | -54.8 | -179.4 | 0 | 0 | 0 | 108.9 | Y251 C252 H255 L259 E282 I283 | Y251-I257 HydrophobicContact CE1-CD1 4.45Å; C252-I257 HydrophobicContact CB-CB 4.02Å; C252-I257 PolarHBondContact O-N 2.97Å; H255-I257 HydrophobicContact CB-CD1 4.17Å; H255-I257 HydrophobicContact CB-CG1 4Å; H255-I257 PolarHBondContact O-N 3.38Å; H255-I257 VanDerWaalsContact O-N 3.17Å; I257-L259 PolarHBondContact O-N 3.41Å; I257-E282 HydrophobicContact CG2-CB 4Å; I257-I283 HydrophobicContact CD1-CG1 4.14Å | ||
| 258 | K | 77.6 | Confident | 76.3 | Confident | 169 Ų | 169 | 98 Ų | 98 | 74% | 0.735 | 50% | 0.502 | S | S | * | . | trans | -70.6 | 98.9 | -176.1 | -68.8 | -177.9 | -179 | 177.5 | 0 | 112 | D256 N260 | D256-K258 PolarHBondContact O-N 3.42Å; K258-N260 PolarHBondContact O-N 2.86Å; K258-N260 VanDerWaalsContact O-N 3.09Å | ||
| 259 | L | 69.8 | Low | 76.3 | Confident | 49 Ų | 49 | 96.8 Ų | 96.8 | 26% | 0.257 | 50% | 0.496 | S | S | . | . | trans | -77.8 | 89.6 | 173.3 | -61.4 | -179.2 | 0 | 0 | 0 | 111.1 | C252 I257 K261 L279 | C252-L259 HydrophobicContact CB-CD1 4Å; C252-L259 HydrophobicContact CB-CD2 4.01Å; C252-L259 HydrophobicContact CB-CG 4.11Å; I257-L259 PolarHBondContact O-N 3.41Å; L259-K261 PolarHBondContact O-N 2.92Å; L259-L279 HydrophobicContact CD1-CD2 4.03Å; L259-L279 HydrophobicContact CD2-CD2 3.4Å; L259-L279 HydrophobicContact CG-CD2 4.35Å | ||
| 260 | N | 65.1 | Low | 76.4 | Confident | 146 Ų | 146 | 102.3 Ų | 102.3 | 78% | 0.781 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71 | -10.6 | -175.8 | -74.7 | -28.2 | 0 | 0 | 0 | 114.8 | K258 | K258-N260 PolarHBondContact O-N 2.86Å; K258-N260 VanDerWaalsContact O-N 3.09Å |
| 261 | K | 65.7 | Low | 76.5 | Confident | 175 Ų | 175 | 101.1 Ų | 101.1 | 76% | 0.761 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -152.4 | 53.9 | -166.3 | -145.5 | 179 | -175.4 | -176.3 | 0 | 115 | L259 T263 | L259-K261 PolarHBondContact O-N 2.92Å; K261-T263 VanDerWaalsContact C-N 3.35Å; K261-T263 HydrophobicContact CG-CG2 4.41Å; K261-T263 PolarHBondContact O-N 3.28Å |
| 262 | L | 60.2 | Low | 76.4 | Confident | 91 Ų | 91 | 97.2 Ų | 97.2 | 48% | 0.476 | 51% | 0.507 | S | S | . | . | trans | -76.9 | 91 | 164 | -169.8 | 64.4 | 0 | 0 | 0 | 108.9 | N264 L275 | L262-N264 PolarHBondContact O-N 3.21Å; L262-N264 VanDerWaalsContact O-N 3.13Å; L262-L275 HydrophobicContact CD1-CD1 3.86Å; L262-L275 HydrophobicContact CD1-CD2 4.07Å | ||
| 263 | T | 59.9 | Low | 76.5 | Confident | 82 Ų | 82 | 99 Ų | 99 | 50% | 0.503 | 52% | 0.522 | S | S | . | . | trans | -69.8 | 109.6 | 169.3 | 55.7 | 0 | 0 | 0 | 0 | 108.1 | K261 Q265 | K261-T263 VanDerWaalsContact C-N 3.35Å; K261-T263 HydrophobicContact CG-CG2 4.41Å; K261-T263 PolarHBondContact O-N 3.28Å; T263-Q265 PolarHBondContact O-N 2.9Å | ||
| 264 | N | 57.3 | Low | 76.7 | Confident | 157 Ų | 157 | 97 Ų | 97 | 84% | 0.84 | 52% | 0.515 | S | S | * | . | trans | -66.1 | 25.2 | 171.2 | -67.6 | -29.5 | 0 | 0 | 0 | 113.1 | L262 | L262-N264 PolarHBondContact O-N 3.21Å; L262-N264 VanDerWaalsContact O-N 3.13Å | ||
| 265 | Q | 59.3 | Low | 76.7 | Confident | 150 Ų | 150 | 91.2 Ų | 91.2 | 70% | 0.701 | 49% | 0.491 | S | S | * | . | S | Bend | trans | -104.2 | 135 | -167.8 | -153 | 165.1 | 13.2 | 0 | 0 | 111.2 | T263 C267 | T263-Q265 PolarHBondContact O-N 2.9Å; Q265-C267 PolarHBondContact O-N 3.44Å |
| 266 | T | 58.2 | Low | 76.8 | Confident | 141 Ų | 141 | 87.1 Ų | 87.1 | 87% | 0.865 | 48% | 0.475 | S | S | * | . | trans | -41.8 | 120 | -170.6 | 46.5 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 267 | C | 69.5 | Low | 77 | Confident | 55 Ų | 55 | 86 Ų | 86 | 37% | 0.372 | 46% | 0.463 | S | S | . | . | trans | -95.5 | 118.6 | -155.9 | -128.2 | 0 | 0 | 0 | 0 | 112.9 | Q265 L272 | Q265-C267 PolarHBondContact O-N 3.44Å; C267-L272 HydrophobicContact CB-CD1 4.35Å; C267-L272 HydrophobicContact CB-CD2 3.77Å; C267-L272 HydrophobicContact CB-CG 3.68Å; C267-L272 WeakPolarHBondContact SG-CD2 3.43Å; C267-L272 WeakPolarHBondContact SG-CG 3.42Å | ||
| 268 | S | 86.4 | Confident | 77.3 | Confident | 52 Ų | 52 | 88.2 Ų | 88.2 | 36% | 0.364 | 48% | 0.475 | S | S | . | . | trans | -66.8 | 158.8 | 159.9 | 81.4 | 0 | 0 | 0 | 0 | 109.5 | L270 S271 L272 | S268-L270 PolarHBondContact O-N 3.38Å; S268-L270 PolarHBondContact OG-N 2.96Å; S268-S271 PolarHBondContact O-N 3.34Å; S268-S271 VanDerWaalsContact O-N 3.12Å; S268-S271 WeakPolarHBondContact OG-CB 3.4Å; S268-S271 PolarHBondContact OG-N 2.89Å; S268-S271 PolarHBondContact OG-OG 3.5Å; S268-L272 PolarHBondContact O-N 3.23Å | ||
| 269 | T | 90.4 | Very high | 77.8 | Confident | 18 Ų | 18 | 80.8 Ų | 80.8 | 11% | 0.11 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -59.5 | -32.9 | 175 | -53.4 | 0 | 0 | 0 | 0 | 111 | R234 I237 R238 L241 L272 A273 | R234-T269 HydrophobicContact CG-CG2 4.41Å; R234-T269 VanDerWaalsContact CZ-OG1 3.31Å; R234-T269 PolarHBondContact NE-OG1 3.01Å; R234-T269 PolarHBondContact NH2-OG1 3.41Å; I237-T269 HydrophobicContact CG2-CG2 4.43Å; R238-T269 HydrophobicContact CB-CG2 4.41Å; R238-T269 PolarHBondContact NE-OG1 3.45Å; R238-T269 PolarHBondContact NH2-OG1 2.91Å; L241-T269 HydrophobicContact CD1-CG2 4.41Å; T269-L272 PolarHBondContact O-N 2.97Å; T269-A273 PolarHBondContact O-N 3.5Å |
| 270 | L | 90.5 | Very high | 78.7 | Confident | 141 Ų | 141 | 80.6 Ų | 80.6 | 74% | 0.738 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -68.4 | -41.1 | 176.3 | -174.2 | 64.3 | 0 | 0 | 0 | 111.7 | S268 L272 A273 S274 | S268-L270 PolarHBondContact O-N 3.38Å; S268-L270 PolarHBondContact OG-N 2.96Å; L270-L272 VanDerWaalsContact C-N 3.33Å; L270-L272 PolarHBondContact O-N 2.9Å; L270-A273 PolarHBondContact O-N 3.13Å; L270-S274 PolarHBondContact O-N 3.41Å; L270-S274 PolarHBondContact O-OG 2.87Å |
| 271 | S | 90 | Very high | 79.7 | Confident | 50 Ų | 50 | 77.6 Ų | 77.6 | 35% | 0.35 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -65.9 | -35.2 | 176.1 | -52.1 | 0 | 0 | 0 | 0 | 112.2 | S268 S274 L275 | S268-S271 PolarHBondContact O-N 3.34Å; S268-S271 VanDerWaalsContact O-N 3.12Å; S268-S271 WeakPolarHBondContact OG-CB 3.4Å; S268-S271 PolarHBondContact OG-N 2.89Å; S268-S271 PolarHBondContact OG-OG 3.5Å; S271-S274 WeakPolarHBondContact CA-OG 3.42Å; S271-S274 PolarHBondContact O-OG 3.01Å; S271-L275 VanDerWaalsContact O-CB 3.32Å; S271-L275 WeakPolarHBondContact O-CB 3.38Å; S271-L275 PolarHBondContact O-N 2.86Å |
| 272 | L | 89.6 | Confident | 80.7 | Confident | 24 Ų | 24 | 73.9 Ų | 73.9 | 13% | 0.126 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -65.6 | -43.1 | 171.9 | -74.4 | 170.5 | 0 | 0 | 0 | 111.1 | R238 L241 I245 C267 S268 T269 L270 L275 C276 | R238-L272 HydrophobicContact CG-CD1 3.82Å; L241-L272 HydrophobicContact CB-CB 4.19Å; L241-L272 HydrophobicContact CD1-CB 4.09Å; I245-L272 HydrophobicContact CD1-CB 4.15Å; I245-L272 HydrophobicContact CD1-CD2 3.5Å; I245-L272 VanDerWaalsContact CD1-CD2 3.5Å; I245-L272 HydrophobicContact CD1-CG 4.43Å; C267-L272 HydrophobicContact CB-CD1 4.35Å; C267-L272 HydrophobicContact CB-CD2 3.77Å; C267-L272 HydrophobicContact CB-CG 3.68Å; C267-L272 WeakPolarHBondContact SG-CD2 3.43Å; C267-L272 WeakPolarHBondContact SG-CG 3.42Å; S268-L272 PolarHBondContact O-N 3.23Å; T269-L272 PolarHBondContact O-N 2.97Å; L270-L272 VanDerWaalsContact C-N 3.33Å; L270-L272 PolarHBondContact O-N 2.9Å; L272-L275 PolarHBondContact O-N 3.12Å; L272-C276 WeakPolarHBondContact O-CB 3.36Å; L272-C276 PolarHBondContact O-N 3.24Å |
| 273 | A | 90.7 | Very high | 81.9 | Confident | 39 Ų | 39 | 72 Ų | 72 | 32% | 0.322 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -64.7 | -43.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L241 T269 L270 C276 F277 | L241-A273 HydrophobicContact CD1-CB 4Å; T269-A273 PolarHBondContact O-N 3.5Å; L270-A273 PolarHBondContact O-N 3.13Å; A273-C276 PolarHBondContact O-N 2.86Å; A273-F277 WeakPolarHBondContact O-CB 3.36Å; A273-F277 PolarHBondContact O-N 2.9Å |
| 274 | S | 90 | Very high | 83.1 | Confident | 56 Ų | 56 | 70.4 Ų | 70.4 | 39% | 0.392 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -63.5 | -44.2 | 176.4 | 67.2 | 0 | 0 | 0 | 0 | 111.5 | L270 S271 C276 F277 D278 | L270-S274 PolarHBondContact O-N 3.41Å; L270-S274 PolarHBondContact O-OG 2.87Å; S271-S274 WeakPolarHBondContact CA-OG 3.42Å; S271-S274 PolarHBondContact O-OG 3.01Å; S274-C276 VanDerWaalsContact C-N 3.33Å; S274-C276 PolarHBondContact O-N 3.34Å; S274-F277 WeakPolarHBondContact O-CB 3.41Å; S274-F277 PolarHBondContact O-N 3.02Å; S274-F277 VanDerWaalsContact O-N 3.14Å; S274-D278 WeakPolarHBondContact O-CB 3.44Å; S274-D278 PolarHBondContact O-N 3.36Å |
| 275 | L | 88.2 | Confident | 84 | Confident | 23 Ų | 23 | 67.5 Ų | 67.5 | 12% | 0.12 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -61.2 | -43 | 176.3 | -170.6 | 103.3 | 0 | 0 | 0 | 111.6 | I245 L262 S271 L272 F277 D278 L279 | I245-L275 HydrophobicContact CB-CD2 4.3Å; I245-L275 HydrophobicContact CD1-CD2 3.76Å; I245-L275 HydrophobicContact CG1-CD2 3.94Å; I245-L275 HydrophobicContact CG2-CD2 3.4Å; L262-L275 HydrophobicContact CD1-CD1 3.86Å; L262-L275 HydrophobicContact CD1-CD2 4.07Å; S271-L275 VanDerWaalsContact O-CB 3.32Å; S271-L275 WeakPolarHBondContact O-CB 3.38Å; S271-L275 PolarHBondContact O-N 2.86Å; L272-L275 PolarHBondContact O-N 3.12Å; L275-F277 VanDerWaalsContact C-N 3.28Å; L275-F277 PolarHBondContact O-N 3.42Å; L275-D278 PolarHBondContact O-N 3.36Å; L275-L279 HydrophobicContact CD2-CD1 4.19Å; L275-L279 HydrophobicContact CG-CD1 4.45Å; L275-L279 WeakPolarHBondContact O-CB 3.39Å; L275-L279 VanDerWaalsContact O-CG 3.26Å; L275-L279 WeakPolarHBondContact O-CG 3.46Å; L275-L279 PolarHBondContact O-N 2.82Å |
| 276 | C | 89.4 | Confident | 84.6 | Confident | 23 Ų | 23 | 67.9 Ų | 67.9 | 16% | 0.155 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -62 | -38 | 176.3 | -169.1 | 0 | 0 | 0 | 0 | 111.8 | L241 I245 L272 A273 S274 A280 | L241-C276 HydrophobicContact CD2-CB 3.89Å; I245-C276 HydrophobicContact CD1-CB 4.46Å; I245-C276 HydrophobicContact CG1-CB 4Å; L272-C276 WeakPolarHBondContact O-CB 3.36Å; L272-C276 PolarHBondContact O-N 3.24Å; A273-C276 PolarHBondContact O-N 2.86Å; S274-C276 VanDerWaalsContact C-N 3.33Å; S274-C276 PolarHBondContact O-N 3.34Å; C276-A280 WeakPolarHBondContact O-CB 3.46Å; C276-A280 PolarHBondContact O-N 3.42Å; C276-A280 VanDerWaalsContact O-N 3.11Å |
| 277 | F | 88.2 | Confident | 85.2 | Confident | 125 Ų | 125 | 64.4 Ų | 64.4 | 55% | 0.548 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -69.7 | -44.9 | 176.2 | 179.7 | -104.8 | 0 | 0 | 0 | 112.3 | A273 S274 L275 L279 A280 L281 | A273-F277 WeakPolarHBondContact O-CB 3.36Å; A273-F277 PolarHBondContact O-N 2.9Å; S274-F277 WeakPolarHBondContact O-CB 3.41Å; S274-F277 PolarHBondContact O-N 3.02Å; S274-F277 VanDerWaalsContact O-N 3.14Å; L275-F277 VanDerWaalsContact C-N 3.28Å; L275-F277 PolarHBondContact O-N 3.42Å; F277-L279 VanDerWaalsContact C-N 3.33Å; F277-L279 PolarHBondContact O-N 3.47Å; F277-A280 WeakPolarHBondContact O-CB 3.41Å; F277-A280 PolarHBondContact O-N 3.04Å; F277-A280 VanDerWaalsContact O-N 3.1Å; F277-L281 HydrophobicContact CD1-CD1 3.87Å; F277-L281 HydrophobicContact CD1-CG 4.29Å; F277-L281 HydrophobicContact CE1-CD1 3.31Å; F277-L281 HydrophobicContact CE1-CD2 4.47Å; F277-L281 HydrophobicContact CE1-CG 3.89Å; F277-L281 HydrophobicContact CE2-CD2 4.48Å; F277-L281 HydrophobicContact CE2-CG 4.37Å; F277-L281 HydrophobicContact CZ-CD1 3.75Å; F277-L281 HydrophobicContact CZ-CD2 4.06Å; F277-L281 HydrophobicContact CZ-CG 3.93Å; F277-L281 PolarHBondContact O-N 3.2Å |
| 278 | D | 88.1 | Confident | 85.3 | Confident | 87 Ų | 87 | 67.2 Ų | 67.2 | 47% | 0.465 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -59.8 | -44.1 | 176.7 | -64.9 | -23.7 | 0 | 0 | 0 | 110.5 | S274 L275 A280 L281 E282 | S274-D278 WeakPolarHBondContact O-CB 3.44Å; S274-D278 PolarHBondContact O-N 3.36Å; L275-D278 PolarHBondContact O-N 3.36Å; D278-A280 VanDerWaalsContact C-N 3.33Å; D278-A280 PolarHBondContact O-N 3.25Å; D278-L281 PolarHBondContact O-N 3.28Å; D278-E282 WeakPolarHBondContact O-CG 3.44Å; D278-E282 PolarHBondContact O-N 3.5Å |
| 279 | L | 87.8 | Confident | 84.9 | Confident | 12 Ų | 12 | 70.7 Ų | 70.7 | 6% | 0.063 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -60.7 | -41.3 | 173.9 | -71.5 | 174.4 | 0 | 0 | 0 | 112.3 | I245 L248 L259 L275 F277 E282 I283 | I245-L279 HydrophobicContact CG2-CD1 4.05Å; L248-L279 HydrophobicContact CB-CB 4.25Å; L248-L279 HydrophobicContact CB-CD1 4.18Å; L248-L279 HydrophobicContact CD2-CB 3.95Å; L259-L279 HydrophobicContact CD1-CD2 4.03Å; L259-L279 HydrophobicContact CD2-CD2 3.4Å; L259-L279 HydrophobicContact CG-CD2 4.35Å; L275-L279 HydrophobicContact CD2-CD1 4.19Å; L275-L279 HydrophobicContact CG-CD1 4.45Å; L275-L279 WeakPolarHBondContact O-CB 3.39Å; L275-L279 VanDerWaalsContact O-CG 3.26Å; L275-L279 WeakPolarHBondContact O-CG 3.46Å; L275-L279 PolarHBondContact O-N 2.82Å; F277-L279 VanDerWaalsContact C-N 3.33Å; F277-L279 PolarHBondContact O-N 3.47Å; L279-E282 PolarHBondContact O-N 3.42Å; L279-I283 WeakPolarHBondContact O-CD1 3.46Å; L279-I283 VanDerWaalsContact O-CG1 3.26Å; L279-I283 WeakPolarHBondContact O-CG1 3.5Å; L279-I283 PolarHBondContact O-N 3.24Å; L279-I283 VanDerWaalsContact O-N 3.15Å |
| 280 | A | 88.4 | Confident | 84.4 | Confident | 46 Ų | 46 | 76.8 Ų | 76.8 | 38% | 0.38 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -66.7 | -36.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L248 C276 F277 D278 I283 S284 | L248-A280 HydrophobicContact CD2-CB 4.28Å; C276-A280 WeakPolarHBondContact O-CB 3.46Å; C276-A280 PolarHBondContact O-N 3.42Å; C276-A280 VanDerWaalsContact O-N 3.11Å; F277-A280 WeakPolarHBondContact O-CB 3.41Å; F277-A280 PolarHBondContact O-N 3.04Å; F277-A280 VanDerWaalsContact O-N 3.1Å; D278-A280 VanDerWaalsContact C-N 3.33Å; D278-A280 PolarHBondContact O-N 3.25Å; A280-I283 PolarHBondContact O-N 3.09Å; A280-S284 PolarHBondContact O-N 3.43Å; A280-S284 VanDerWaalsContact O-N 3.14Å |
| 281 | L | 86.7 | Confident | 83.9 | Confident | 82 Ų | 82 | 73.8 Ų | 73.8 | 43% | 0.429 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -66 | -41.6 | 174.7 | -76.8 | -178.8 | 0 | 0 | 0 | 112.3 | F277 D278 I283 S284 P285 | F277-L281 HydrophobicContact CD1-CD1 3.87Å; F277-L281 HydrophobicContact CD1-CG 4.29Å; F277-L281 HydrophobicContact CE1-CD1 3.31Å; F277-L281 HydrophobicContact CE1-CD2 4.47Å; F277-L281 HydrophobicContact CE1-CG 3.89Å; F277-L281 HydrophobicContact CE2-CD2 4.48Å; F277-L281 HydrophobicContact CE2-CG 4.37Å; F277-L281 HydrophobicContact CZ-CD1 3.75Å; F277-L281 HydrophobicContact CZ-CD2 4.06Å; F277-L281 HydrophobicContact CZ-CG 3.93Å; F277-L281 PolarHBondContact O-N 3.2Å; D278-L281 PolarHBondContact O-N 3.28Å; L281-I283 VanDerWaalsContact C-N 3.29Å; L281-I283 PolarHBondContact O-N 2.88Å; L281-S284 CarbonylContact O-C 3.56Å; L281-S284 VanDerWaalsContact O-C 3.23Å; L281-S284 PolarHBondContact O-N 3.37Å; L281-P285 VanDerWaalsContact O-CA 3.28Å; L281-P285 WeakPolarHBondContact O-CA 3.18Å; L281-P285 WeakPolarHBondContact O-CD 3.39Å |
| 282 | E | 85.8 | Confident | 83.6 | Confident | 97 Ų | 97 | 80.5 Ų | 80.5 | 45% | 0.453 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -65.4 | -33.5 | 176.9 | -67.5 | -63 | 161.2 | 0 | 0 | 112.1 | I257 D278 L279 S284 | I257-E282 HydrophobicContact CG2-CB 4Å; D278-E282 WeakPolarHBondContact O-CG 3.44Å; D278-E282 PolarHBondContact O-N 3.5Å; L279-E282 PolarHBondContact O-N 3.42Å; E282-S284 VanDerWaalsContact C-N 3.35Å |
| 283 | I | 85.8 | Confident | 83.3 | Confident | 51 Ų | 51 | 88.3 Ų | 88.3 | 26% | 0.262 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67.6 | -37 | 174.5 | -69.1 | 165.9 | 0 | 0 | 0 | 111.4 | L248 Y251 C252 I257 L279 A280 L281 | L248-I283 HydrophobicContact CB-CD1 4.26Å; L248-I283 HydrophobicContact CD2-CD1 4.14Å; L248-I283 HydrophobicContact CG-CD1 3.98Å; Y251-I283 HydrophobicContact CD1-CD1 3.75Å; Y251-I283 HydrophobicContact CD1-CG1 3.84Å; Y251-I283 HydrophobicContact CD1-CG2 4.22Å; Y251-I283 HydrophobicContact CE1-CB 4.43Å; Y251-I283 HydrophobicContact CE1-CD1 4.28Å; Y251-I283 HydrophobicContact CE1-CG1 4.03Å; Y251-I283 HydrophobicContact CE1-CG2 3.62Å; C252-I283 WeakPolarHBondContact SG-CG1 3.23Å; I257-I283 HydrophobicContact CD1-CG1 4.14Å; L279-I283 WeakPolarHBondContact O-CD1 3.46Å; L279-I283 VanDerWaalsContact O-CG1 3.26Å; L279-I283 WeakPolarHBondContact O-CG1 3.5Å; L279-I283 PolarHBondContact O-N 3.24Å; L279-I283 VanDerWaalsContact O-N 3.15Å; A280-I283 PolarHBondContact O-N 3.09Å; L281-I283 VanDerWaalsContact C-N 3.29Å; L281-I283 PolarHBondContact O-N 2.88Å |
| 284 | S | 84.5 | Confident | 82.9 | Confident | 50 Ų | 50 | 92.6 Ų | 92.6 | 35% | 0.35 | 51% | 0.508 | S | S | . | . | trans | -139.7 | 67.2 | -171.6 | -150.5 | 0 | 0 | 0 | 0 | 112.6 | A280 L281 E282 N286 T287 | A280-S284 PolarHBondContact O-N 3.43Å; A280-S284 VanDerWaalsContact O-N 3.14Å; L281-S284 CarbonylContact O-C 3.56Å; L281-S284 VanDerWaalsContact O-C 3.23Å; L281-S284 PolarHBondContact O-N 3.37Å; E282-S284 VanDerWaalsContact C-N 3.35Å; S284-N286 PolarHBondContact O-N 2.85Å; S284-T287 WeakPolarHBondContact CB-OG1 3.27Å; S284-T287 PolarHBondContact O-OG1 3.25Å; S284-T287 PolarHBondContact OG-OG1 2.93Å | ||
| 285 | P | 77.3 | Confident | 82.7 | Confident | 95 Ų | 95 | 96.1 Ų | 96.1 | 62% | 0.617 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | -23.1 | -172.7 | 25.8 | -35 | 0 | 0 | 0 | 113.3 | L281 | L281-P285 VanDerWaalsContact O-CA 3.28Å; L281-P285 WeakPolarHBondContact O-CA 3.18Å; L281-P285 WeakPolarHBondContact O-CD 3.39Å |
| 286 | N | 71.8 | Confident | 82.6 | Confident | 158 Ų | 158 | 99.4 Ų | 99.4 | 85% | 0.845 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.7 | 8 | -171 | -68.4 | -28.1 | 0 | 0 | 0 | 114.4 | S284 S288 | S284-N286 PolarHBondContact O-N 2.85Å; N286-S288 PolarHBondContact O-N 2.75Å |
| 287 | T | 69.4 | Low | 82.6 | Confident | 68 Ų | 68 | 102.6 Ų | 102.6 | 42% | 0.417 | 57% | 0.574 | S | S | . | * | trans | -88.8 | 111 | 179.5 | 13.7 | 0 | 0 | 0 | 0 | 111.3 | S284 I289 | S284-T287 WeakPolarHBondContact CB-OG1 3.27Å; S284-T287 PolarHBondContact O-OG1 3.25Å; S284-T287 PolarHBondContact OG-OG1 2.93Å; T287-I289 HydrophobicContact CG2-CD1 3.63Å; T287-I289 HydrophobicContact CG2-CG1 3.75Å; T287-I289 PolarHBondContact O-N 2.95Å | ||
| 288 | S | 73.4 | Confident | 82.6 | Confident | 114 Ų | 114 | 99.1 Ų | 99.1 | 80% | 0.797 | 56% | 0.562 | S | S | * | * | trans | -73.6 | 59.2 | 161.5 | 178.8 | 0 | 0 | 0 | 0 | 110.4 | N286 | N286-S288 PolarHBondContact O-N 2.75Š| ||
| 289 | I | 77 | Confident | 82.7 | Confident | 126 Ų | 126 | 99.4 Ų | 99.4 | 65% | 0.646 | 56% | 0.564 | S | S | * | * | P | Polyproline II helix | trans | -76 | 127.7 | 173 | -68.9 | 159.9 | 0 | 0 | 0 | 107.9 | T287 | T287-I289 HydrophobicContact CG2-CD1 3.63Å; T287-I289 HydrophobicContact CG2-CG1 3.75Å; T287-I289 PolarHBondContact O-N 2.95Å |
| 290 | Q | 79.3 | Confident | 82.8 | Confident | 146 Ų | 146 | 98.9 Ų | 98.9 | 68% | 0.682 | 56% | 0.561 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 135.3 | 173.7 | -67.4 | -64.9 | -22.4 | 0 | 0 | 110 | M292 | Q290-M292 PolarHBondContact O-N 3.39Š|
| 291 | P | 79.8 | Confident | 82.9 | Confident | 78 Ų | 78 | 100.5 Ų | 100.5 | 51% | 0.506 | 56% | 0.56 | S | S | . | * | P | Polyproline II helix | trans | -61.4 | 135.3 | 175.6 | 26.2 | -33 | 0 | 0 | 0 | 110 | Y293 | P291-Y293 HydrophobicContact CG-CE2 4.08Å; P291-Y293 WeakPolarHBondContact O-CD2 3.38Å |
| 292 | M | 83.7 | Confident | 83.2 | Confident | 190 Ų | 190 | 102.4 Ų | 102.4 | 94% | 0.936 | 57% | 0.567 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 130.5 | 170 | -69.7 | -177.2 | 178.3 | 0 | 0 | 109.2 | Q290 | Q290-M292 PolarHBondContact O-N 3.39Š|
| 293 | Y | 84 | Confident | 83.4 | Confident | 189 Ų | 189 | 99.9 Ų | 99.9 | 74% | 0.741 | 56% | 0.557 | S | S | * | * | P | Polyproline II helix | trans | -97.5 | 136.9 | 175.8 | -65.9 | -85.9 | 0 | 0 | 0 | 110.2 | P291 S295 | P291-Y293 HydrophobicContact CG-CE2 4.08Å; P291-Y293 WeakPolarHBondContact O-CD2 3.38Å; Y293-S295 PolarHBondContact O-N 3.36Å |
| 294 | C | 83 | Confident | 83.6 | Confident | 129 Ų | 129 | 98.6 Ų | 98.6 | 87% | 0.872 | 55% | 0.554 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 127.5 | 168.1 | -66.7 | 0 | 0 | 0 | 0 | 109 | ||
| 295 | S | 84.6 | Confident | 83.8 | Confident | 129 Ų | 129 | 101.6 Ų | 101.6 | 90% | 0.902 | 56% | 0.562 | S | S | * | * | trans | -92.8 | -8.5 | -178.4 | -52 | 0 | 0 | 0 | 0 | 113.3 | Y293 | Y293-S295 PolarHBondContact O-N 3.36Š| ||
| 296 | S | 87.6 | Confident | 84.3 | Confident | 93 Ų | 93 | 102.7 Ų | 102.7 | 65% | 0.65 | 56% | 0.555 | S | S | * | * | S | Bend | trans | -151.7 | 144.1 | -175 | 57.4 | 0 | 0 | 0 | 0 | 110.3 | ||
| 297 | D | 87.6 | Confident | 85.1 | Confident | 90 Ų | 90 | 96 Ų | 96 | 48% | 0.481 | 52% | 0.52 | S | S | . | . | trans | -72 | 149.2 | 171.6 | -66.4 | -21.7 | 0 | 0 | 0 | 110.3 | E301 Q305 | D297-E301 WeakPolarHBondContact CA-OE2 3.23Å; D297-E301 HydrophobicContact CB-CB 3.94Å; D297-Q305 PolarHBondContact OD2-NE2 3.13Å | ||
| 298 | T | 89.4 | Confident | 85.7 | Confident | 51 Ų | 51 | 96.6 Ų | 96.6 | 31% | 0.313 | 53% | 0.526 | S | S | . | . | trans | -72.1 | 163 | 169.5 | 72.8 | 0 | 0 | 0 | 0 | 110.8 | E233 G300 E301 E302 | E233-T298 VanDerWaalsContact CD-OG1 3.25Å; E233-T298 VanDerWaalsContact OE1-CB 3.3Å; E233-T298 WeakPolarHBondContact OE1-CB 3.47Å; E233-T298 PolarHBondContact OE1-OG1 2.85Å; E233-T298 VanDerWaalsContact OE2-CB 3.28Å; E233-T298 WeakPolarHBondContact OE2-CB 3.37Å; E233-T298 PolarHBondContact OE2-OG1 2.88Å; T298-G300 PolarHBondContact O-N 3.26Å; T298-E301 PolarHBondContact N-OE2 2.94Å; T298-E301 WeakPolarHBondContact O-CB 3.38Å; T298-E301 PolarHBondContact O-N 2.84Å; T298-E301 WeakPolarHBondContact OG1-CG 3.31Å; T298-E301 PolarHBondContact OG1-N 3.29Å; T298-E302 PolarHBondContact O-N 3.44Å | ||
| 299 | L | 89.2 | Confident | 86 | Confident | 94 Ų | 94 | 93.6 Ų | 93.6 | 49% | 0.492 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.2 | -37.9 | 175.6 | -176.4 | 69.2 | 0 | 0 | 0 | 111.4 | L303 | L299-L303 HydrophobicContact CG-CD1 4.22Å; L299-L303 WeakPolarHBondContact O-CB 3.23Å; L299-L303 VanDerWaalsContact O-CG 3.24Å; L299-L303 WeakPolarHBondContact O-CG 3.49Å; L299-L303 PolarHBondContact O-N 2.83Å; L299-L303 VanDerWaalsContact O-N 3.16Å |
| 300 | G | 90.2 | Very high | 85.7 | Confident | 0 Ų | 0 | 93 Ų | 93 | 0% | 0 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -62.3 | -41.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113 | E233 T298 A304 | E233-G300 PolarHBondContact OE1-N 3.42Å; T298-G300 PolarHBondContact O-N 3.26Å; G300-A304 VanDerWaalsContact O-CB 3.26Å; G300-A304 WeakPolarHBondContact O-CB 3.32Å; G300-A304 PolarHBondContact O-N 3.29Å |
| 301 | E | 91.9 | Very high | 84.9 | Confident | 80 Ų | 80 | 92.8 Ų | 92.8 | 37% | 0.374 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -68.4 | -47.2 | 179.1 | -72.4 | 169.5 | 162.3 | 0 | 0 | 111.9 | L230 D297 T298 L303 A304 Q305 | L230-E301 HydrophobicContact CD2-CG 3.98Å; D297-E301 WeakPolarHBondContact CA-OE2 3.23Å; D297-E301 HydrophobicContact CB-CB 3.94Å; T298-E301 PolarHBondContact N-OE2 2.94Å; T298-E301 WeakPolarHBondContact O-CB 3.38Å; T298-E301 PolarHBondContact O-N 2.84Å; T298-E301 WeakPolarHBondContact OG1-CG 3.31Å; T298-E301 PolarHBondContact OG1-N 3.29Å; E301-L303 VanDerWaalsContact C-N 3.32Å; E301-L303 PolarHBondContact O-N 2.96Å; E301-A304 PolarHBondContact O-N 2.92Å; E301-A304 VanDerWaalsContact O-N 3.13Å; E301-Q305 WeakPolarHBondContact O-CG 3.47Å; E301-Q305 PolarHBondContact O-N 2.92Å |
| 302 | E | 91.5 | Very high | 83.8 | Confident | 122 Ų | 122 | 95 Ų | 95 | 57% | 0.57 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -57.7 | -46 | 177.5 | -172.3 | -175.2 | 179.3 | 0 | 0 | 111.1 | T298 A304 Q305 Y306 | T298-E302 PolarHBondContact O-N 3.44Å; E302-A304 PolarHBondContact O-N 3.3Å; E302-Q305 PolarHBondContact O-N 2.95Å; E302-Y306 WeakPolarHBondContact O-CB 3.43Å; E302-Y306 PolarHBondContact O-N 2.95Å |
| 303 | L | 90.2 | Very high | 82.5 | Confident | 45 Ų | 45 | 94.4 Ų | 94.4 | 24% | 0.236 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -66.1 | -38.3 | 177 | -70.6 | 174.3 | 0 | 0 | 0 | 112.5 | A226 L299 E301 Y306 V307 | A226-L303 HydrophobicContact CB-CB 3.81Å; L299-L303 HydrophobicContact CG-CD1 4.22Å; L299-L303 WeakPolarHBondContact O-CB 3.23Å; L299-L303 VanDerWaalsContact O-CG 3.24Å; L299-L303 WeakPolarHBondContact O-CG 3.49Å; L299-L303 PolarHBondContact O-N 2.83Å; L299-L303 VanDerWaalsContact O-N 3.16Å; E301-L303 VanDerWaalsContact C-N 3.32Å; E301-L303 PolarHBondContact O-N 2.96Å; L303-Y306 PolarHBondContact O-N 2.99Å; L303-V307 VanDerWaalsContact O-CG2 3.31Å; L303-V307 WeakPolarHBondContact O-CG2 3.25Å; L303-V307 PolarHBondContact O-N 3.48Å; L303-V307 VanDerWaalsContact O-N 3.08Å |
| 304 | A | 90.3 | Very high | 81.2 | Confident | 24 Ų | 24 | 87.4 Ų | 87.4 | 20% | 0.198 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -68.8 | -38.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | A226 L230 G300 E301 E302 V307 S308 | A226-A304 HydrophobicContact CB-CB 4.24Å; L230-A304 HydrophobicContact CD1-CB 3.83Å; G300-A304 VanDerWaalsContact O-CB 3.26Å; G300-A304 WeakPolarHBondContact O-CB 3.32Å; G300-A304 PolarHBondContact O-N 3.29Å; E301-A304 PolarHBondContact O-N 2.92Å; E301-A304 VanDerWaalsContact O-N 3.13Å; E302-A304 PolarHBondContact O-N 3.3Å; A304-V307 PolarHBondContact O-N 3.48Å; A304-S308 WeakPolarHBondContact O-CB 3.48Å; A304-S308 PolarHBondContact O-N 3.39Å; A304-S308 PolarHBondContact O-OG 3.31Å |
| 305 | Q | 89.2 | Confident | 80.1 | Confident | 112 Ų | 112 | 89.4 Ų | 89.4 | 52% | 0.523 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.5 | -46 | 172.9 | -71.8 | 179.4 | 21 | 0 | 0 | 111 | D297 E301 E302 V307 S308 G309 | D297-Q305 PolarHBondContact OD2-NE2 3.13Å; E301-Q305 WeakPolarHBondContact O-CG 3.47Å; E301-Q305 PolarHBondContact O-N 2.92Å; E302-Q305 PolarHBondContact O-N 2.95Å; Q305-V307 VanDerWaalsContact C-N 3.31Å; Q305-V307 PolarHBondContact O-N 3.46Å; Q305-S308 PolarHBondContact O-N 3.06Å; Q305-G309 PolarHBondContact O-N 2.94Å |
| 306 | Y | 87.9 | Confident | 78.8 | Confident | 118 Ų | 118 | 88.1 Ų | 88.1 | 46% | 0.463 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -57.2 | -42.5 | 176.9 | 179.6 | -102 | 0 | 0 | 0 | 112.7 | L222 E302 L303 R310 | L222-Y306 HydrophobicContact CD1-CE1 4.07Å; E302-Y306 WeakPolarHBondContact O-CB 3.43Å; E302-Y306 PolarHBondContact O-N 2.95Å; L303-Y306 PolarHBondContact O-N 2.99Å; Y306-R310 VanDerWaalsContact OH-CZ 3.23Å; Y306-R310 PolarHBondContact OH-NE 3.5Å; Y306-R310 PolarHBondContact OH-NH2 3.33Å |
| 307 | V | 87.8 | Confident | 77.4 | Confident | 18 Ų | 18 | 88.2 Ų | 88.2 | 11% | 0.109 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -71 | -40.4 | 178.4 | 172.6 | 0 | 0 | 0 | 0 | 112 | Q219 L222 A223 L303 A304 Q305 R310 | Q219-V307 HydrophobicContact CG-CG1 4.37Å; Q219-V307 PolarHBondContact NE2-O 3.12Å; L222-V307 HydrophobicContact CB-CG2 3.68Å; A223-V307 HydrophobicContact CB-CG1 3.72Å; L303-V307 VanDerWaalsContact O-CG2 3.31Å; L303-V307 WeakPolarHBondContact O-CG2 3.25Å; L303-V307 PolarHBondContact O-N 3.48Å; L303-V307 VanDerWaalsContact O-N 3.08Å; A304-V307 PolarHBondContact O-N 3.48Å; Q305-V307 VanDerWaalsContact C-N 3.31Å; Q305-V307 PolarHBondContact O-N 3.46Å; V307-R310 PolarHBondContact O-N 3.33Å |
| 308 | S | 82.9 | Confident | 76 | Confident | 80 Ų | 80 | 90.1 Ų | 90.1 | 56% | 0.559 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -66.2 | -40.9 | -178.6 | -60.8 | 0 | 0 | 0 | 0 | 112 | A304 Q305 R310 F311 | A304-S308 WeakPolarHBondContact O-CB 3.48Å; A304-S308 PolarHBondContact O-N 3.39Å; A304-S308 PolarHBondContact O-OG 3.31Å; Q305-S308 PolarHBondContact O-N 3.06Å; S308-R310 PolarHBondContact O-N 3.47Å; S308-F311 PolarHBondContact O-N 2.9Å |
| 309 | G | 78.7 | Confident | 74.7 | Confident | 51 Ų | 51 | 90 Ų | 90 | 53% | 0.526 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -60.5 | -29.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q305 | Q305-G309 PolarHBondContact O-N 2.94Å |
| 310 | R | 69.9 | Low | 73.5 | Confident | 114 Ų | 114 | 89.6 Ų | 89.6 | 43% | 0.43 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -80.2 | -20.7 | 179.7 | -73.9 | -175.3 | 170.7 | -131.5 | -3.2 | 114.5 | Y306 V307 S308 L312 F313 | Y306-R310 VanDerWaalsContact OH-CZ 3.23Å; Y306-R310 PolarHBondContact OH-NE 3.5Å; Y306-R310 PolarHBondContact OH-NH2 3.33Å; V307-R310 PolarHBondContact O-N 3.33Å; S308-R310 PolarHBondContact O-N 3.47Å; R310-L312 VanDerWaalsContact C-N 3.27Å; R310-L312 PolarHBondContact O-N 2.92Å; R310-F313 PolarHBondContact O-N 2.86Å |
| 311 | F | 62.7 | Low | 72 | Confident | 142 Ų | 142 | 92 Ų | 92 | 62% | 0.623 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -64.3 | -33 | -175.9 | -158.6 | -93.1 | 0 | 0 | 0 | 112.4 | S308 F313 | S308-F311 PolarHBondContact O-N 2.9Å; F311-F313 VanDerWaalsContact C-N 3.32Å; F311-F313 PolarHBondContact O-N 3Å |
| 312 | L | 57.5 | Low | 70.7 | Confident | 124 Ų | 124 | 92.1 Ų | 92.1 | 65% | 0.649 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -68 | -27 | 179.8 | -68.7 | 171 | 0 | 0 | 0 | 113.5 | R310 N316 | R310-L312 VanDerWaalsContact C-N 3.27Å; R310-L312 PolarHBondContact O-N 2.92Å; L312-N316 PolarHBondContact O-ND2 2.9Å |
| 313 | F | 56.7 | Low | 69.5 | Low | 177 Ų | 177 | 92.5 Ų | 92.5 | 78% | 0.776 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -76.3 | -36.3 | -179 | -105.4 | -87.3 | 0 | 0 | 0 | 113 | R310 F311 F317 | R310-F313 PolarHBondContact O-N 2.86Å; F311-F313 VanDerWaalsContact C-N 3.32Å; F311-F313 PolarHBondContact O-N 3Å; F313-F317 PolarHBondContact O-N 3.43Å |
| 314 | L | 55.9 | Low | 68.1 | Low | 43 Ų | 43 | 93.5 Ų | 93.5 | 23% | 0.225 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -72.8 | -39 | -177.2 | -89.7 | 149.1 | 0 | 0 | 0 | 113.1 | M215 F317 F318 | M215-L314 HydrophobicContact CE-CD1 4.41Å; M215-L314 HydrophobicContact CE-CD2 3.36Å; M215-L314 HydrophobicContact CE-CG 3.92Å; L314-F317 PolarHBondContact O-N 3.29Å; L314-F318 PolarHBondContact O-N 3.48Å; L314-F318 VanDerWaalsContact O-N 3.15Å |
| 315 | Y | 59.9 | Low | 66.6 | Low | 170 Ų | 170 | 97 Ų | 97 | 67% | 0.667 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -66.9 | -43.6 | -178.9 | -171.3 | -96.2 | 0 | 0 | 0 | 112.3 | F317 F318 S319 | Y315-F317 VanDerWaalsContact C-N 3.27Å; Y315-F317 PolarHBondContact O-N 2.69Å; Y315-F318 PolarHBondContact O-N 2.9Å; Y315-S319 PolarHBondContact O-N 3.46Å |
| 316 | N | 57.2 | Low | 65.4 | Low | 103 Ų | 103 | 97 Ų | 97 | 55% | 0.551 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62 | -36.8 | 177.2 | -75.6 | -53.3 | 0 | 0 | 0 | 111.7 | L312 T320 | L312-N316 PolarHBondContact O-ND2 2.9Å; N316-T320 PolarHBondContact O-N 3.38Å; N316-T320 PolarHBondContact O-OG1 3.09Å |
| 317 | F | 58.4 | Low | 63.4 | Low | 94 Ų | 94 | 102.5 Ų | 102.5 | 41% | 0.412 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -70.4 | -40.4 | 178.4 | -164.9 | -90.1 | 0 | 0 | 0 | 113 | H212 F313 L314 Y315 S319 T320 L321 | H212-F317 AromaticContact CE1-CD1 3.34Å; H212-F317 WeakPolarHBondContact CE1-CD1 3.34Å; H212-F317 AromaticContact CE1-CE1 3.4Å; H212-F317 WeakPolarHBondContact CE1-CE1 3.33Å; H212-F317 AromaticContact NE2-CD1 3.41Å; H212-F317 WeakPolarHBondContact NE2-CD1 3.48Å; H212-F317 AromaticContact NE2-CE1 3.07Å; H212-F317 WeakPolarHBondContact NE2-CE1 3.41Å; F313-F317 PolarHBondContact O-N 3.43Å; L314-F317 PolarHBondContact O-N 3.29Å; Y315-F317 VanDerWaalsContact C-N 3.27Å; Y315-F317 PolarHBondContact O-N 2.69Å; F317-S319 VanDerWaalsContact C-N 3.3Å; F317-S319 PolarHBondContact O-N 2.9Å; F317-T320 PolarHBondContact O-N 3.27Å; F317-T320 VanDerWaalsContact O-N 3.12Å; F317-L321 HydrophobicContact CD1-CB 4.37Å; F317-L321 HydrophobicContact CE1-CB 4.16Å; F317-L321 HydrophobicContact CE1-CD1 4.09Å; F317-L321 HydrophobicContact CE1-CD2 4.47Å; F317-L321 HydrophobicContact CE1-CG 4.48Å; F317-L321 HydrophobicContact CZ-CD1 4.49Å; F317-L321 WeakPolarHBondContact O-CB 3.41Å; F317-L321 PolarHBondContact O-N 3.48Å |
| 318 | F | 59.1 | Low | 62.2 | Low | 130 Ų | 130 | 106.8 Ų | 106.8 | 57% | 0.57 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.8 | -38.1 | 178.1 | -156.6 | -104.2 | 0 | 0 | 0 | 111.8 | L314 Y315 I322 | L314-F318 PolarHBondContact O-N 3.48Å; L314-F318 VanDerWaalsContact O-N 3.15Å; Y315-F318 PolarHBondContact O-N 2.9Å; F318-I322 HydrophobicContact CD1-CD1 3.49Å; F318-I322 VanDerWaalsContact CD1-CD1 3.49Å; F318-I322 HydrophobicContact CD1-CG1 4.34Å; F318-I322 HydrophobicContact CE1-CD1 3.24Å; F318-I322 HydrophobicContact CE1-CG1 4.25Å; F318-I322 HydrophobicContact CG-CD1 4.39Å; F318-I322 HydrophobicContact CZ-CD1 3.96Å; F318-I322 WeakPolarHBondContact O-CB 3.36Å; F318-I322 WeakPolarHBondContact O-CG1 3.5Å; F318-I322 PolarHBondContact O-N 3.46Å |
| 319 | S | 61.9 | Low | 61.1 | Low | 48 Ų | 48 | 108.2 Ų | 108.2 | 34% | 0.336 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.2 | -43.5 | 172.3 | -169.3 | 0 | 0 | 0 | 0 | 111.7 | Y315 F317 K323 | Y315-S319 PolarHBondContact O-N 3.46Å; F317-S319 VanDerWaalsContact C-N 3.3Å; F317-S319 PolarHBondContact O-N 2.9Å; S319-K323 WeakPolarHBondContact O-CB 3.28Å; S319-K323 WeakPolarHBondContact O-CD 3.3Å; S319-K323 WeakPolarHBondContact O-CG 3.35Å; S319-K323 PolarHBondContact O-N 3.33Å; S319-K323 VanDerWaalsContact O-N 3.13Å; S319-K323 PolarHBondContact OG-NZ 3.29Å |
| 320 | T | 63 | Low | 60.1 | Low | 87 Ų | 87 | 111.3 Ų | 111.3 | 53% | 0.534 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -70.9 | -40.4 | 179.9 | -50 | 0 | 0 | 0 | 0 | 112.6 | N316 F317 K323 A324 | N316-T320 PolarHBondContact O-N 3.38Å; N316-T320 PolarHBondContact O-OG1 3.09Å; F317-T320 PolarHBondContact O-N 3.27Å; F317-T320 VanDerWaalsContact O-N 3.12Å; T320-K323 PolarHBondContact O-N 2.9Å; T320-A324 WeakPolarHBondContact O-CB 3.39Å; T320-A324 PolarHBondContact O-N 3.36Å |
| 321 | L | 60.1 | Low | 59.6 | Low | 51 Ų | 51 | 111.2 Ų | 111.2 | 27% | 0.267 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -68.8 | -42 | -179.6 | -168.8 | 78.9 | 0 | 0 | 0 | 111.7 | F317 K323 A324 L325 | F317-L321 HydrophobicContact CD1-CB 4.37Å; F317-L321 HydrophobicContact CE1-CB 4.16Å; F317-L321 HydrophobicContact CE1-CD1 4.09Å; F317-L321 HydrophobicContact CE1-CD2 4.47Å; F317-L321 HydrophobicContact CE1-CG 4.48Å; F317-L321 HydrophobicContact CZ-CD1 4.49Å; F317-L321 WeakPolarHBondContact O-CB 3.41Å; F317-L321 PolarHBondContact O-N 3.48Å; L321-K323 VanDerWaalsContact C-N 3.33Å; L321-A324 PolarHBondContact O-N 3.32Å; L321-L325 HydrophobicContact CG-CD1 4.28Å; L321-L325 PolarHBondContact O-N 3.3Å; L321-L325 VanDerWaalsContact O-N 3.07Å |
| 322 | I | 63.6 | Low | 59.4 | Low | 82 Ų | 82 | 109.3 Ų | 109.3 | 42% | 0.421 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.9 | -43.1 | 173.8 | -72.6 | 175.5 | 0 | 0 | 0 | 110.3 | F318 A324 L325 V326 | F318-I322 HydrophobicContact CD1-CD1 3.49Å; F318-I322 VanDerWaalsContact CD1-CD1 3.49Å; F318-I322 HydrophobicContact CD1-CG1 4.34Å; F318-I322 HydrophobicContact CE1-CD1 3.24Å; F318-I322 HydrophobicContact CE1-CG1 4.25Å; F318-I322 HydrophobicContact CG-CD1 4.39Å; F318-I322 HydrophobicContact CZ-CD1 3.96Å; F318-I322 WeakPolarHBondContact O-CB 3.36Å; F318-I322 WeakPolarHBondContact O-CG1 3.5Å; F318-I322 PolarHBondContact O-N 3.46Å; I322-A324 VanDerWaalsContact C-N 3.32Å; I322-A324 PolarHBondContact O-N 3.46Å; I322-L325 PolarHBondContact O-N 3.03Å; I322-V326 HydrophobicContact CG2-CG2 4.47Å; I322-V326 WeakPolarHBondContact O-CG2 3.33Å; I322-V326 PolarHBondContact O-N 2.88Å |
| 323 | K | 65.8 | Low | 59.5 | Low | 129 Ų | 129 | 108.3 Ų | 108.3 | 56% | 0.561 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -59.3 | -43.3 | 174.6 | -75 | 169.3 | -178.6 | 173 | 0 | 111.4 | S319 T320 L321 L325 V326 F327 | S319-K323 WeakPolarHBondContact O-CB 3.28Å; S319-K323 WeakPolarHBondContact O-CD 3.3Å; S319-K323 WeakPolarHBondContact O-CG 3.35Å; S319-K323 PolarHBondContact O-N 3.33Å; S319-K323 VanDerWaalsContact O-N 3.13Å; S319-K323 PolarHBondContact OG-NZ 3.29Å; T320-K323 PolarHBondContact O-N 2.9Å; L321-K323 VanDerWaalsContact C-N 3.33Å; K323-L325 VanDerWaalsContact C-N 3.29Å; K323-L325 PolarHBondContact O-N 2.98Å; K323-V326 PolarHBondContact O-N 3.13Å; K323-F327 WeakPolarHBondContact O-CD2 3.46Å |
| 324 | A | 62.3 | Low | 59.7 | Low | 67 Ų | 67 | 103.4 Ų | 103.4 | 55% | 0.554 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -70.9 | -17.6 | 180 | 0 | 0 | 0 | 0 | 0 | 114.9 | T320 L321 I322 | T320-A324 WeakPolarHBondContact O-CB 3.39Å; T320-A324 PolarHBondContact O-N 3.36Å; L321-A324 PolarHBondContact O-N 3.32Å; I322-A324 VanDerWaalsContact C-N 3.32Å; I322-A324 PolarHBondContact O-N 3.46Å |
| 325 | L | 59.2 | Low | 60 | Low | 97 Ų | 97 | 108 Ų | 108 | 51% | 0.508 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -92.6 | -18.5 | 178 | -89.7 | 160.2 | 0 | 0 | 0 | 113.6 | V205 L321 I322 K323 | V205-L325 HydrophobicContact CG1-CD1 4.31Å; V205-L325 HydrophobicContact CG1-CD2 4.38Å; V205-L325 HydrophobicContact CG2-CD2 4.09Å; L321-L325 HydrophobicContact CG-CD1 4.28Å; L321-L325 PolarHBondContact O-N 3.3Å; L321-L325 VanDerWaalsContact O-N 3.07Å; I322-L325 PolarHBondContact O-N 3.03Å; K323-L325 VanDerWaalsContact C-N 3.29Å; K323-L325 PolarHBondContact O-N 2.98Å |
| 326 | V | 63 | Low | 60 | Low | 113 Ų | 113 | 102.8 Ų | 102.8 | 69% | 0.685 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -90 | -14.6 | -179.5 | 174.1 | 0 | 0 | 0 | 0 | 112.1 | I322 K323 | I322-V326 HydrophobicContact CG2-CG2 4.47Å; I322-V326 WeakPolarHBondContact O-CG2 3.33Å; I322-V326 PolarHBondContact O-N 2.88Å; K323-V326 PolarHBondContact O-N 3.13Å |
| 327 | F | 46.2 | Very low | 60.2 | Low | 233 Ų | 233 | 102.8 Ų | 102.8 | 100% | 1.022 | 53% | 0.534 | S | S | * | . | trans | -106.5 | 0 | 172.5 | -71.5 | -80.1 | 0 | 0 | 0 | 110.9 | K323 | K323-F327 WeakPolarHBondContact O-CD2 3.46Š|
Retrieved 327 of 327 residues in 143.1 ms
(Link to these results)