| 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 | 38.1 | Very low | 34.3 | Very low | 251 Ų | 251 | 142.8 Ų | 142.8 | 100% | 1.236 | 86% | 0.858 | S | S | * | * | 0 | 98.7 | 0 | -69.9 | 179.8 | 176.2 | 0 | 0 | 106.8 | |||||
| 2 | A | 37.2 | Very low | 34.4 | Very low | 104 Ų | 104 | 140.3 Ų | 140.3 | 86% | 0.86 | 85% | 0.848 | S | S | * | * | trans | -114.9 | 96 | -176.3 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 3 | D | 37.3 | Very low | 34.1 | Very low | 162 Ų | 162 | 143.3 Ų | 143.3 | 87% | 0.866 | 86% | 0.855 | S | S | * | * | trans | -92.7 | 107.6 | 179.3 | -160.7 | 7.2 | 0 | 0 | 0 | 108.8 | ||||
| 4 | K | 34.2 | Very low | 33.8 | Very low | 207 Ų | 207 | 139.4 Ų | 139.4 | 90% | 0.9 | 85% | 0.846 | S | S | * | * | trans | -97.2 | 87.3 | 174 | -84.9 | -176.3 | 174 | 179.5 | 0 | 107.5 | ||||
| 5 | G | 35.9 | Very low | 33.4 | Very low | 68 Ų | 68 | 141.1 Ų | 141.1 | 70% | 0.701 | 85% | 0.847 | S | S | * | * | trans | -104.3 | 94.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 6 | S | 35 | Very low | 33.2 | Very low | 117 Ų | 117 | 139.3 Ų | 139.3 | 82% | 0.818 | 84% | 0.84 | S | S | * | * | trans | 1.1 | 122.7 | 158.9 | -167.8 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 7 | G | 30.7 | Very low | 33.2 | Very low | 77 Ų | 77 | 138.4 Ų | 138.4 | 79% | 0.794 | 84% | 0.838 | S | S | * | * | trans | -67.4 | 124.4 | 166.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 8 | G | 32 | Very low | 33.1 | Very low | 70 Ų | 70 | 136.2 Ų | 136.2 | 72% | 0.722 | 84% | 0.837 | S | S | * | * | trans | -106.7 | 98.4 | 165.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | R10 | G8-R10 PolarHBondContact O-N 3.49Š| ||
| 9 | S | 33.3 | Very low | 33.1 | Very low | 114 Ų | 114 | 135.2 Ų | 135.2 | 80% | 0.797 | 84% | 0.836 | S | S | * | * | trans | -68.1 | 93.3 | 172.3 | 36.6 | 0 | 0 | 0 | 0 | 110.2 | L11 | S9-L11 PolarHBondContact O-N 3.15Š| ||
| 10 | R | 33.5 | Very low | 33.1 | Very low | 240 Ų | 240 | 138 Ų | 138 | 91% | 0.906 | 84% | 0.838 | S | S | * | * | trans | -75.6 | 97.5 | 165.7 | -73.8 | -174.7 | 177.9 | -165.4 | -0.5 | 108.7 | G8 P12 | G8-R10 PolarHBondContact O-N 3.49Å; R10-P12 WeakPolarHBondContact O-CD 3.4Å | ||
| 11 | L | 30.3 | Very low | 33 | Very low | 161 Ų | 161 | 134.7 Ų | 134.7 | 84% | 0.843 | 83% | 0.833 | S | S | * | * | trans | -71.6 | 119.9 | 164.8 | -87.1 | 155.6 | 0 | 0 | 0 | 108.8 | S9 L13 | S9-L11 PolarHBondContact O-N 3.15Å; L11-L13 PolarHBondContact O-N 2.94Å | ||
| 12 | P | 35.2 | Very low | 32.4 | Very low | 113 Ų | 113 | 128.6 Ų | 128.6 | 73% | 0.734 | 81% | 0.813 | S | S | * | * | trans | -79.9 | 118.2 | 175.1 | 29.9 | -28.4 | 0 | 0 | 0 | 109.5 | R10 A14 | R10-P12 WeakPolarHBondContact O-CD 3.4Å; P12-A14 VanDerWaalsContact C-N 3.28Å; P12-A14 PolarHBondContact O-N 3.42Å | ||
| 13 | L | 30.8 | Very low | 31.9 | Very low | 179 Ų | 179 | 129.9 Ų | 129.9 | 94% | 0.937 | 82% | 0.816 | S | S | * | * | trans | -67.1 | 88.5 | 163.7 | -92.8 | 122.9 | 0 | 0 | 0 | 108.5 | L11 | L11-L13 PolarHBondContact O-N 2.94Š| ||
| 14 | A | 30.4 | Very low | 31.5 | Very low | 89 Ų | 89 | 127.6 Ų | 127.6 | 74% | 0.736 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -83.2 | 116.6 | 167.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | P12 | P12-A14 VanDerWaalsContact C-N 3.28Å; P12-A14 PolarHBondContact O-N 3.42Å |
| 15 | L | 27.2 | Very low | 30.9 | Very low | 164 Ų | 164 | 121.8 Ų | 121.8 | 86% | 0.859 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 138.9 | 168.5 | -90.2 | 110.4 | 0 | 0 | 0 | 110 | ||
| 16 | P | 29.8 | Very low | 30.3 | Very low | 112 Ų | 112 | 122.3 Ų | 122.3 | 73% | 0.727 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 151.1 | 179.8 | 28.2 | -32.9 | 0 | 0 | 0 | 112 | ||
| 17 | P | 33.2 | Very low | 29.7 | Very low | 125 Ų | 125 | 123.1 Ų | 123.1 | 81% | 0.812 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 145.4 | -178.1 | 28.8 | -33.2 | 0 | 0 | 0 | 112 | S19 | P17-S19 PolarHBondContact O-N 3.42Š|
| 18 | A | 32.3 | Very low | 29.4 | Very low | 99 Ų | 99 | 123.2 Ų | 123.2 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 120.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q20 | A18-Q20 PolarHBondContact O-N 3.45Š|
| 19 | S | 32.3 | Very low | 29 | Very low | 116 Ų | 116 | 125.5 Ų | 125.5 | 81% | 0.811 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 120.1 | 173.7 | 50.3 | 0 | 0 | 0 | 0 | 110.2 | P17 G21 | P17-S19 PolarHBondContact O-N 3.42Å; S19-G21 PolarHBondContact O-N 3.24Å |
| 20 | Q | 32.9 | Very low | 28.6 | Very low | 191 Ų | 191 | 125.8 Ų | 125.8 | 89% | 0.893 | 83% | 0.831 | S | S | * | * | trans | -65 | 98.9 | 168.1 | -67.1 | 179.7 | 11.5 | 0 | 0 | 108.5 | A18 C22 | A18-Q20 PolarHBondContact O-N 3.45Å; Q20-C22 PolarHBondContact O-N 3.41Å | ||
| 21 | G | 30.6 | Very low | 28.5 | Very low | 70 Ų | 70 | 119.1 Ų | 119.1 | 72% | 0.722 | 83% | 0.827 | S | S | * | * | trans | -75.5 | 111.8 | 170.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | S19 S23 | S19-G21 PolarHBondContact O-N 3.24Å; G21-S23 PolarHBondContact O-N 3.28Å | ||
| 22 | C | 26.7 | Very low | 28.2 | Very low | 122 Ų | 122 | 116 Ų | 116 | 82% | 0.824 | 83% | 0.833 | S | S | * | * | trans | -59.6 | 123.6 | 173.7 | -69.4 | 0 | 0 | 0 | 0 | 111 | Q20 S24 | Q20-C22 PolarHBondContact O-N 3.41Å; C22-S24 PolarHBondContact O-N 2.96Å | ||
| 23 | S | 25.8 | Very low | 27.8 | Very low | 131 Ų | 131 | 113.9 Ų | 113.9 | 92% | 0.916 | 83% | 0.832 | S | S | * | * | trans | -56.3 | 117.6 | 169.3 | -47.1 | 0 | 0 | 0 | 0 | 110.7 | G21 | G21-S23 PolarHBondContact O-N 3.28Š| ||
| 24 | S | 30.5 | Very low | 27.9 | Very low | 114 Ų | 114 | 111.6 Ų | 111.6 | 80% | 0.797 | 83% | 0.831 | S | S | * | * | trans | -131.5 | 129.4 | 161.8 | 51.6 | 0 | 0 | 0 | 0 | 108.2 | C22 | C22-S24 PolarHBondContact O-N 2.96Š| ||
| 25 | G | 21.4 | Very low | 28.1 | Very low | 86 Ų | 86 | 110.4 Ų | 110.4 | 89% | 0.887 | 83% | 0.827 | S | S | * | * | trans | -71.8 | 160.1 | -169.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 26 | G | 22.4 | Very low | 28.6 | Very low | 78 Ų | 78 | 109.9 Ų | 109.9 | 80% | 0.804 | 83% | 0.826 | S | S | * | * | trans | 176.5 | 107.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 27 | S | 23.1 | Very low | 29.6 | Very low | 135 Ų | 135 | 108.8 Ų | 108.8 | 94% | 0.944 | 82% | 0.819 | S | S | * | * | trans | -52.3 | 145.7 | 173.2 | -45.3 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 28 | G | 24.7 | Very low | 30.6 | Very low | 78 Ų | 78 | 110.6 Ų | 110.6 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | 179 | 104 | 169.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 29 | S | 23.1 | Very low | 31.9 | Very low | 118 Ų | 118 | 110.9 Ų | 110.9 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | trans | -69.5 | 157.9 | 176.3 | -59.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 30 | S | 25.2 | Very low | 33.5 | Very low | 121 Ų | 121 | 106.9 Ų | 106.9 | 85% | 0.846 | 77% | 0.774 | S | S | * | * | trans | 70 | 108.5 | 155.6 | 72.9 | 0 | 0 | 0 | 0 | 120 | ||||
| 31 | A | 31.3 | Very low | 34.9 | Very low | 100 Ų | 100 | 102.1 Ų | 102.1 | 83% | 0.826 | 75% | 0.748 | S | S | * | * | trans | -165.8 | 110.1 | 131 | 0 | 0 | 0 | 0 | 0 | 108.7 | G33 | A31-G33 PolarHBondContact O-N 3.32Š| ||
| 32 | G | 22.5 | Very low | 36.5 | Very low | 94 Ų | 94 | 102.6 Ų | 102.6 | 97% | 0.969 | 73% | 0.733 | S | S | * | * | trans | -70.5 | 94.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 33 | G | 27.3 | Very low | 38.3 | Very low | 70 Ų | 70 | 101.9 Ų | 101.9 | 72% | 0.722 | 72% | 0.721 | S | S | * | * | trans | -103.8 | 105.2 | 156.6 | 0 | 0 | 0 | 0 | 0 | 107.5 | A31 G35 | A31-G33 PolarHBondContact O-N 3.32Å; G33-G35 PolarHBondContact O-N 2.99Å | ||
| 34 | S | 33.5 | Very low | 40.5 | Very low | 130 Ų | 130 | 103 Ų | 103 | 91% | 0.909 | 71% | 0.712 | S | S | * | * | trans | -70.7 | 62.9 | 167.9 | 60.8 | 0 | 0 | 0 | 0 | 109.4 | N36 | S34-N36 PolarHBondContact O-N 2.71Å; S34-N36 VanDerWaalsContact O-N 3.1Å | ||
| 35 | G | 34 | Very low | 42.2 | Very low | 64 Ų | 64 | 98.5 Ų | 98.5 | 66% | 0.66 | 68% | 0.684 | S | S | * | * | trans | -74.8 | 94.4 | 169.1 | 0 | 0 | 0 | 0 | 0 | 107 | G33 P37 | G33-G35 PolarHBondContact O-N 2.99Å; G35-P37 WeakPolarHBondContact O-CD 3.4Å; G35-P37 VanDerWaalsContact O-N 3.12Å | ||
| 36 | N | 38.1 | Very low | 44.6 | Very low | 154 Ų | 154 | 97.6 Ų | 97.6 | 82% | 0.824 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 119 | 169.2 | -158.4 | 26.1 | 0 | 0 | 0 | 106.9 | S34 R38 | S34-N36 PolarHBondContact O-N 2.71Å; S34-N36 VanDerWaalsContact O-N 3.1Å; N36-R38 PolarHBondContact O-N 2.81Å |
| 37 | P | 50.6 | Low | 46.9 | Very low | 89 Ų | 89 | 99.2 Ų | 99.2 | 58% | 0.578 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 136.5 | -176.7 | 20.8 | -30.3 | 0 | 0 | 0 | 109.4 | G35 | G35-P37 WeakPolarHBondContact O-CD 3.4Å; G35-P37 VanDerWaalsContact O-N 3.12Å |
| 38 | R | 54.6 | Low | 49.1 | Very low | 163 Ų | 163 | 99.2 Ų | 99.2 | 62% | 0.615 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 135.1 | 177.9 | -79.4 | -178.7 | 173 | 179.7 | 0.3 | 109.4 | N36 | N36-R38 PolarHBondContact O-N 2.81Š|
| 39 | P | 59.5 | Low | 51.3 | Low | 105 Ų | 105 | 98.9 Ų | 98.9 | 68% | 0.682 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 142.4 | 174.7 | -22.3 | 30.6 | 0 | 0 | 0 | 110.7 | R41 | P39-R41 PolarHBondContact O-N 3.23Š|
| 40 | P | 64.8 | Low | 53.7 | Low | 31 Ų | 31 | 96.2 Ų | 96.2 | 20% | 0.201 | 60% | 0.596 | C | S | . | * | P | Polyproline II helix | trans | -69.4 | 127.3 | -177.4 | 26.9 | -27.4 | 0 | 0 | 0 | 110.1 | L46 M49 F81 | P40-L46 HydrophobicContact CB-CB 3.9Å; P40-L46 HydrophobicContact CB-CD1 4.42Å; P40-L46 HydrophobicContact CG-CB 3.98Å; P40-L46 HydrophobicContact CG-CD1 3.58Å; P40-L46 HydrophobicContact CG-CG 4.4Å; P40-M49 HydrophobicContact CB-CE 4.4Å; P40-M49 HydrophobicContact CG-CE 3.99Å; P40-M49 HydrophobicContact CG-SD 4.24Å; P40-F81 VanDerWaalsContact O-CE1 3.29Å; P40-F81 WeakPolarHBondContact O-CE1 3.32Å |
| 41 | R | 64.2 | Low | 55.8 | Low | 92 Ų | 92 | 96.1 Ų | 96.1 | 35% | 0.347 | 59% | 0.585 | S | S | . | * | trans | -88.6 | -12.4 | -173.9 | -61 | -176 | -178.6 | 165.4 | 13.1 | 114.6 | P39 D133 | P39-R41 PolarHBondContact O-N 3.23Å; R41-D133 IonicContact CZ-OD1 3.52Å; R41-D133 IonicContact CZ-OD2 2.77Å; R41-D133 VanDerWaalsContact NE-CG 3.32Å; R41-D133 IonicContact NE-OD1 3.19Å; R41-D133 IonicContact NE-OD2 3.85Å; R41-D133 PolarHBondContact NE-OD2 3.45Å; R41-D133 IonicContact NH1-OD1 2.52Å; R41-D133 PolarHBondContact NH1-OD1 3.09Å; R41-D133 IonicContact NH1-OD2 3.04Å; R41-D133 IonicContact NH2-OD1 3.55Å; R41-D133 PolarHBondContact NH2-OD1 3.06Å; R41-D133 IonicContact NH2-OD2 2.85Å; R41-D133 PolarHBondContact NH2-OD2 3.28Å | ||
| 42 | N | 63.9 | Low | 57.7 | Low | 79 Ų | 79 | 96.7 Ų | 96.7 | 42% | 0.422 | 58% | 0.578 | S | S | . | * | S | Bend | trans | -154.6 | 173.6 | -178.9 | 63.1 | 22.1 | 0 | 0 | 0 | 109.7 | Q44 G45 L46 | N42-Q44 PolarHBondContact O-N 2.69Å; N42-Q44 PolarHBondContact OD1-N 3.14Å; N42-G45 PolarHBondContact O-N 3.47Å; N42-G45 PolarHBondContact OD1-N 3.08Å; N42-L46 PolarHBondContact O-N 3.17Å; N42-L46 VanDerWaalsContact O-N 3.08Å |
| 43 | L | 64.7 | Low | 60.1 | Low | 107 Ų | 107 | 96.2 Ų | 96.2 | 56% | 0.56 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -58 | -34.4 | -179.7 | -63.9 | 177.1 | 0 | 0 | 0 | 112.9 | L46 L47 M77 | L43-L46 PolarHBondContact O-N 2.7Å; L43-L47 WeakPolarHBondContact O-CB 3.5Å; L43-L47 PolarHBondContact O-N 3.29Å; L43-M77 HydrophobicContact CD2-CE 3.87Å; L43-M77 HydrophobicContact CD2-CG 4.43Å; L43-M77 HydrophobicContact CD2-SD 3.15Å; L43-M77 WeakPolarHBondContact CD2-SD 3.2Å |
| 44 | Q | 70.2 | Confident | 62.1 | Low | 154 Ų | 154 | 95 Ų | 95 | 72% | 0.72 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -68.5 | -43.5 | 179.2 | -70.6 | 176.8 | -11 | 0 | 0 | 111.7 | N42 L46 L47 Q48 | N42-Q44 PolarHBondContact O-N 2.69Å; N42-Q44 PolarHBondContact OD1-N 3.14Å; Q44-L46 VanDerWaalsContact C-N 3.32Å; Q44-L46 PolarHBondContact O-N 3.24Å; Q44-L47 PolarHBondContact O-N 3.28Å; Q44-Q48 WeakPolarHBondContact O-CB 3.5Å; Q44-Q48 PolarHBondContact O-N 3.43Å |
| 45 | G | 68.2 | Low | 63.3 | Low | 21 Ų | 21 | 92.5 Ų | 92.5 | 22% | 0.216 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -64.5 | -37.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | N42 Q48 M49 | N42-G45 PolarHBondContact O-N 3.47Å; N42-G45 PolarHBondContact OD1-N 3.08Å; G45-Q48 PolarHBondContact O-N 3.32Å; G45-M49 WeakPolarHBondContact O-CB 3.39Å; G45-M49 PolarHBondContact O-N 3.11Å |
| 46 | L | 71.4 | Confident | 64.5 | Low | 66 Ų | 66 | 99.3 Ų | 99.3 | 35% | 0.346 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -68 | -41.5 | 176.8 | -175.7 | 66.4 | 0 | 0 | 0 | 110.8 | P40 N42 L43 Q44 M49 A50 M77 | P40-L46 HydrophobicContact CB-CB 3.9Å; P40-L46 HydrophobicContact CB-CD1 4.42Å; P40-L46 HydrophobicContact CG-CB 3.98Å; P40-L46 HydrophobicContact CG-CD1 3.58Å; P40-L46 HydrophobicContact CG-CG 4.4Å; N42-L46 PolarHBondContact O-N 3.17Å; N42-L46 VanDerWaalsContact O-N 3.08Å; L43-L46 PolarHBondContact O-N 2.7Å; Q44-L46 VanDerWaalsContact C-N 3.32Å; Q44-L46 PolarHBondContact O-N 3.24Å; L46-M49 PolarHBondContact O-N 2.99Å; L46-A50 WeakPolarHBondContact O-CB 3.44Å; L46-A50 PolarHBondContact O-N 3.17Å; L46-M77 HydrophobicContact CD2-CG 4.4Å; L46-M77 HydrophobicContact CD2-SD 4.29Å |
| 47 | L | 69.7 | Low | 65.5 | Low | 112 Ų | 112 | 99 Ų | 99 | 59% | 0.586 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -61.7 | -45.3 | 174.9 | -168.6 | 104.1 | 0 | 0 | 0 | 111.2 | L43 Q44 M49 A50 I51 | L43-L47 WeakPolarHBondContact O-CB 3.5Å; L43-L47 PolarHBondContact O-N 3.29Å; Q44-L47 PolarHBondContact O-N 3.28Å; L47-M49 PolarHBondContact O-N 2.99Å; L47-A50 PolarHBondContact O-N 3.46Å; L47-I51 HydrophobicContact CD2-CD1 3.72Å; L47-I51 HydrophobicContact CG-CD1 3.94Å; L47-I51 VanDerWaalsContact O-CG1 3.25Å; L47-I51 WeakPolarHBondContact O-CG1 3.38Å; L47-I51 PolarHBondContact O-N 3.04Å |
| 48 | Q | 69.3 | Low | 65.7 | Low | 136 Ų | 136 | 100.7 Ų | 100.7 | 64% | 0.636 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -64.9 | -40 | 179.1 | -167.4 | 171.5 | 21 | 0 | 0 | 112 | Q44 G45 I51 T52 | Q44-Q48 WeakPolarHBondContact O-CB 3.5Å; Q44-Q48 PolarHBondContact O-N 3.43Å; G45-Q48 PolarHBondContact O-N 3.32Å; Q48-I51 PolarHBondContact O-N 3.12Å; Q48-T52 WeakPolarHBondContact O-CB 3.43Å; Q48-T52 PolarHBondContact O-N 3.35Å; Q48-T52 PolarHBondContact O-OG1 3.14Å |
| 49 | M | 71.9 | Confident | 65.9 | Low | 71 Ų | 71 | 99.7 Ų | 99.7 | 35% | 0.35 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -61.1 | -46.2 | 171.8 | -179.3 | -180 | -67.2 | 0 | 0 | 111.3 | P40 G45 L46 L47 I51 T52 A53 | P40-M49 HydrophobicContact CB-CE 4.4Å; P40-M49 HydrophobicContact CG-CE 3.99Å; P40-M49 HydrophobicContact CG-SD 4.24Å; G45-M49 WeakPolarHBondContact O-CB 3.39Å; G45-M49 PolarHBondContact O-N 3.11Å; L46-M49 PolarHBondContact O-N 2.99Å; L47-M49 PolarHBondContact O-N 2.99Å; M49-I51 PolarHBondContact O-N 3.35Å; M49-T52 PolarHBondContact O-N 2.84Å; M49-A53 VanDerWaalsContact O-CB 3.26Å; M49-A53 WeakPolarHBondContact O-CB 3.46Å; M49-A53 PolarHBondContact O-N 2.94Å |
| 50 | A | 73.1 | Confident | 65.8 | Low | 61 Ų | 61 | 99.5 Ų | 99.5 | 50% | 0.504 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.2 | -42.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L46 L47 A53 G54 | L46-A50 WeakPolarHBondContact O-CB 3.44Å; L46-A50 PolarHBondContact O-N 3.17Å; L47-A50 PolarHBondContact O-N 3.46Å; A50-A53 PolarHBondContact O-N 3.3Å; A50-G54 PolarHBondContact O-N 3Å |
| 51 | I | 69.8 | Low | 65.6 | Low | 119 Ų | 119 | 102.9 Ų | 102.9 | 61% | 0.61 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -63.4 | -42.7 | 176.2 | -68.3 | 164.6 | 0 | 0 | 0 | 110.8 | L47 Q48 M49 G54 | L47-I51 HydrophobicContact CD2-CD1 3.72Å; L47-I51 HydrophobicContact CG-CD1 3.94Å; L47-I51 VanDerWaalsContact O-CG1 3.25Å; L47-I51 WeakPolarHBondContact O-CG1 3.38Å; L47-I51 PolarHBondContact O-N 3.04Å; Q48-I51 PolarHBondContact O-N 3.12Å; M49-I51 PolarHBondContact O-N 3.35Å; I51-G54 PolarHBondContact O-N 2.96Å |
| 52 | T | 70.9 | Confident | 65.4 | Low | 112 Ų | 112 | 104.7 Ų | 104.7 | 69% | 0.687 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -71.8 | -33.5 | -178.5 | -49.7 | 0 | 0 | 0 | 0 | 112 | Q48 M49 G54 | Q48-T52 WeakPolarHBondContact O-CB 3.43Å; Q48-T52 PolarHBondContact O-N 3.35Å; Q48-T52 PolarHBondContact O-OG1 3.14Å; M49-T52 PolarHBondContact O-N 2.84Å; T52-G54 VanDerWaalsContact C-N 3.3Å |
| 53 | A | 72.4 | Confident | 65.5 | Low | 85 Ų | 85 | 108.9 Ų | 108.9 | 70% | 0.702 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -78.4 | -15.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | M49 A50 | M49-A53 VanDerWaalsContact O-CB 3.26Å; M49-A53 WeakPolarHBondContact O-CB 3.46Å; M49-A53 PolarHBondContact O-N 2.94Å; A50-A53 PolarHBondContact O-N 3.3Å |
| 54 | G | 68.7 | Low | 65.7 | Low | 43 Ų | 43 | 109.3 Ų | 109.3 | 44% | 0.443 | 63% | 0.632 | S | S | . | * | S | Bend | trans | -63.1 | 134.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A50 I51 T52 | A50-G54 PolarHBondContact O-N 3Å; I51-G54 PolarHBondContact O-N 2.96Å; T52-G54 VanDerWaalsContact C-N 3.3Å |
| 55 | S | 59.4 | Low | 65.5 | Low | 79 Ų | 79 | 106.3 Ų | 106.3 | 55% | 0.552 | 62% | 0.619 | S | S | * | * | trans | -62.9 | 142.1 | 171.3 | 36 | 0 | 0 | 0 | 0 | 110.7 | E57 | S55-E57 PolarHBondContact O-N 2.88Š| ||
| 56 | Q | 58.1 | Low | 66.2 | Low | 206 Ų | 206 | 108.6 Ų | 108.6 | 96% | 0.963 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -66.7 | 13.6 | 174.4 | -68.4 | -176.5 | -2.1 | 0 | 0 | 114 | ||
| 57 | E | 59.4 | Low | 66.6 | Low | 147 Ų | 147 | 110.5 Ų | 110.5 | 69% | 0.687 | 64% | 0.639 | S | S | * | * | S | Bend | trans | -70.4 | 143.9 | 172.8 | -70.3 | -175.1 | 169 | 0 | 0 | 109.1 | S55 D59 | S55-E57 PolarHBondContact O-N 2.88Å; E57-D59 PolarHBondContact O-N 2.91Å |
| 58 | P | 55.3 | Low | 67.2 | Low | 126 Ų | 126 | 112.7 Ų | 112.7 | 82% | 0.818 | 65% | 0.646 | S | S | * | * | trans | -61.1 | 106.2 | 176.2 | 23.9 | -30.8 | 0 | 0 | 0 | 108.6 | ||||
| 59 | D | 58.5 | Low | 67.5 | Low | 141 Ų | 141 | 113 Ų | 113 | 75% | 0.754 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -54 | 134.2 | 176.1 | -85.5 | -38.3 | 0 | 0 | 0 | 109.1 | E57 | E57-D59 PolarHBondContact O-N 2.91Š|
| 60 | P | 58.5 | Low | 67.7 | Low | 101 Ų | 101 | 114.9 Ų | 114.9 | 66% | 0.656 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 151.7 | 167.5 | 22.7 | -30.2 | 0 | 0 | 0 | 109.5 | ||
| 61 | P | 59.6 | Low | 68.1 | Low | 103 Ų | 103 | 116.4 Ų | 116.4 | 67% | 0.669 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 140.1 | -179.2 | 20.4 | -31.5 | 0 | 0 | 0 | 110.1 | E63 | P61-E63 PolarHBondContact O-N 3.25Š|
| 62 | P | 59.7 | Low | 68.8 | Low | 129 Ų | 129 | 117.4 Ų | 117.4 | 84% | 0.838 | 64% | 0.638 | S | S | * | * | trans | -60.5 | 100.3 | -174.3 | 23.3 | -33.1 | 0 | 0 | 0 | 109.7 | ||||
| 63 | E | 67.1 | Low | 69.2 | Low | 168 Ų | 168 | 115.1 Ų | 115.1 | 79% | 0.785 | 62% | 0.621 | S | S | * | * | trans | -70.1 | 136.5 | 173.4 | -73.6 | -177.3 | 171.9 | 0 | 0 | 108.5 | P61 M65 | P61-E63 PolarHBondContact O-N 3.25Å; E63-M65 PolarHBondContact O-N 3.44Å | ||
| 64 | P | 68.4 | Low | 69.6 | Low | 115 Ų | 115 | 117.5 Ų | 117.5 | 75% | 0.747 | 62% | 0.617 | S | S | * | * | trans | -58.3 | 115.1 | 173.1 | 24.4 | -31.5 | 0 | 0 | 0 | 108.1 | S66 | P64-S66 PolarHBondContact O-N 2.82Š| ||
| 65 | M | 66.1 | Low | 70.1 | Confident | 92 Ų | 92 | 121.3 Ų | 121.3 | 45% | 0.453 | 62% | 0.624 | S | S | . | * | trans | -58.6 | 141.3 | -177.5 | 97.5 | -174.3 | 82.9 | 0 | 0 | 109.8 | E63 R69 R70 L73 | E63-M65 PolarHBondContact O-N 3.44Å; M65-R69 HydrophobicContact CG-CB 4.48Å; M65-R70 HydrophobicContact CE-CG 3.97Å; M65-R70 HydrophobicContact CG-CB 4.36Å; M65-R70 HydrophobicContact CG-CG 3.2Å; M65-R70 HydrophobicContact SD-CB 4.14Å; M65-R70 HydrophobicContact SD-CG 3.25Å; M65-R70 WeakPolarHBondContact SD-CG 3.48Å; M65-L73 HydrophobicContact SD-CD1 3.8Å | ||
| 66 | S | 81.9 | Confident | 71.1 | Confident | 68 Ų | 68 | 119.7 Ų | 119.7 | 48% | 0.476 | 62% | 0.615 | S | S | . | * | trans | -60 | 150.8 | 178.4 | 65.9 | 0 | 0 | 0 | 0 | 111.1 | P64 E68 R69 R70 | P64-S66 PolarHBondContact O-N 2.82Å; S66-E68 PolarHBondContact O-N 3.5Å; S66-R69 PolarHBondContact O-N 2.91Å; S66-R69 VanDerWaalsContact O-N 3.07Å; S66-R69 VanDerWaalsContact OG-CB 3.3Å; S66-R69 WeakPolarHBondContact OG-CB 3.33Å; S66-R69 PolarHBondContact OG-N 3.45Å; S66-R70 PolarHBondContact O-N 3.43Å | ||
| 67 | E | 80.9 | Confident | 71.9 | Confident | 107 Ų | 107 | 112.4 Ų | 112.4 | 50% | 0.5 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -60 | -36.4 | 179.2 | -172.9 | 56.2 | -152.3 | 0 | 0 | 111.6 | R69 R70 Q71 | E67-R69 PolarHBondContact O-N 3.04Å; E67-R70 WeakPolarHBondContact O-CB 3.27Å; E67-R70 PolarHBondContact O-N 3.25Å; E67-R70 IonicContact OE2-NH1 3.93Å; E67-Q71 WeakPolarHBondContact O-CG 3.4Å; E67-Q71 PolarHBondContact O-N 3.21Å; E67-Q71 PolarHBondContact OE1-NE2 3.5Å |
| 68 | E | 80.9 | Confident | 72.8 | Confident | 158 Ų | 158 | 108.3 Ų | 108.3 | 74% | 0.738 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -62.1 | -42.7 | 173.7 | -63.1 | 179.7 | 172.6 | 0 | 0 | 112.2 | S66 Q71 W72 | S66-E68 PolarHBondContact O-N 3.5Å; E68-Q71 PolarHBondContact O-N 2.96Å; E68-W72 WeakPolarHBondContact O-CB 3.35Å; E68-W72 PolarHBondContact O-N 2.67Å |
| 69 | R | 76.8 | Confident | 73.8 | Confident | 142 Ų | 142 | 105 Ų | 105 | 54% | 0.536 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66.6 | -37.9 | 176.8 | -170.5 | 76.6 | 175.1 | -170.8 | 0.5 | 111 | M65 S66 E67 L73 | M65-R69 HydrophobicContact CG-CB 4.48Å; S66-R69 PolarHBondContact O-N 2.91Å; S66-R69 VanDerWaalsContact O-N 3.07Å; S66-R69 VanDerWaalsContact OG-CB 3.3Å; S66-R69 WeakPolarHBondContact OG-CB 3.33Å; S66-R69 PolarHBondContact OG-N 3.45Å; E67-R69 PolarHBondContact O-N 3.04Å; R69-L73 HydrophobicContact CG-CD1 4.07Å; R69-L73 VanDerWaalsContact O-CB 3.3Å; R69-L73 WeakPolarHBondContact O-CB 3.43Å; R69-L73 WeakPolarHBondContact O-CD1 3.37Å; R69-L73 VanDerWaalsContact O-CG 3.29Å; R69-L73 WeakPolarHBondContact O-CG 3.45Å; R69-L73 PolarHBondContact O-N 2.85Å |
| 70 | R | 76.4 | Confident | 74.5 | Confident | 111 Ų | 111 | 102 Ų | 102 | 42% | 0.419 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -59 | -51.2 | 173.7 | -73.5 | 179.6 | 179.2 | 167.2 | 3.1 | 111.2 | M65 S66 E67 L73 Q74 | M65-R70 HydrophobicContact CE-CG 3.97Å; M65-R70 HydrophobicContact CG-CB 4.36Å; M65-R70 HydrophobicContact CG-CG 3.2Å; M65-R70 HydrophobicContact SD-CB 4.14Å; M65-R70 HydrophobicContact SD-CG 3.25Å; M65-R70 WeakPolarHBondContact SD-CG 3.48Å; S66-R70 PolarHBondContact O-N 3.43Å; E67-R70 WeakPolarHBondContact O-CB 3.27Å; E67-R70 PolarHBondContact O-N 3.25Å; E67-R70 IonicContact OE2-NH1 3.93Å; R70-L73 PolarHBondContact O-N 3.48Å; R70-Q74 VanDerWaalsContact O-CB 3.32Å; R70-Q74 WeakPolarHBondContact O-CB 3.39Å; R70-Q74 PolarHBondContact O-N 3.35Å |
| 71 | Q | 80.9 | Confident | 75.2 | Confident | 93 Ų | 93 | 98.8 Ų | 98.8 | 44% | 0.435 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.7 | -47.8 | -177 | -71.5 | 172.9 | 13.9 | 0 | 0 | 110.8 | E67 E68 L73 Q74 E75 | E67-Q71 WeakPolarHBondContact O-CG 3.4Å; E67-Q71 PolarHBondContact O-N 3.21Å; E67-Q71 PolarHBondContact OE1-NE2 3.5Å; E68-Q71 PolarHBondContact O-N 2.96Å; Q71-L73 PolarHBondContact O-N 3.43Å; Q71-Q74 PolarHBondContact O-N 3.42Å; Q71-E75 WeakPolarHBondContact O-CB 3.28Å; Q71-E75 WeakPolarHBondContact O-CG 3.49Å; Q71-E75 PolarHBondContact O-N 3.48Å |
| 72 | W | 85.1 | Confident | 76 | Confident | 140 Ų | 140 | 100.8 Ų | 100.8 | 53% | 0.53 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -58.4 | -44.6 | 175.4 | 176.7 | 81.8 | 0 | 0 | 0 | 112.6 | E68 E75 A76 | E68-W72 WeakPolarHBondContact O-CB 3.35Å; E68-W72 PolarHBondContact O-N 2.67Å; W72-E75 PolarHBondContact O-N 3.04Å; W72-A76 WeakPolarHBondContact O-CB 3.46Å; W72-A76 PolarHBondContact O-N 2.97Å |
| 73 | L | 79.1 | Confident | 76.9 | Confident | 63 Ų | 63 | 96.4 Ų | 96.4 | 33% | 0.33 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.5 | -44.7 | 176.2 | -81.4 | 165.5 | 0 | 0 | 0 | 111.4 | M65 R69 R70 Q71 E75 A76 M77 | M65-L73 HydrophobicContact SD-CD1 3.8Å; R69-L73 HydrophobicContact CG-CD1 4.07Å; R69-L73 VanDerWaalsContact O-CB 3.3Å; R69-L73 WeakPolarHBondContact O-CB 3.43Å; R69-L73 WeakPolarHBondContact O-CD1 3.37Å; R69-L73 VanDerWaalsContact O-CG 3.29Å; R69-L73 WeakPolarHBondContact O-CG 3.45Å; R69-L73 PolarHBondContact O-N 2.85Å; R70-L73 PolarHBondContact O-N 3.48Å; Q71-L73 PolarHBondContact O-N 3.43Å; L73-E75 VanDerWaalsContact C-N 3.34Å; L73-E75 PolarHBondContact O-N 2.98Å; L73-A76 PolarHBondContact O-N 3.43Å; L73-M77 WeakPolarHBondContact O-CB 3.19Å; L73-M77 WeakPolarHBondContact O-CG 3.42Å; L73-M77 PolarHBondContact O-N 3.18Å |
| 74 | Q | 80.3 | Confident | 77.5 | Confident | 135 Ų | 135 | 91 Ų | 91 | 63% | 0.631 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -62.2 | -42.4 | 178.7 | -176.4 | 173.9 | -13.6 | 0 | 0 | 111.6 | R70 Q71 S78 | R70-Q74 VanDerWaalsContact O-CB 3.32Å; R70-Q74 WeakPolarHBondContact O-CB 3.39Å; R70-Q74 PolarHBondContact O-N 3.35Å; Q71-Q74 PolarHBondContact O-N 3.42Å; Q74-S78 WeakPolarHBondContact O-CB 3.34Å; Q74-S78 PolarHBondContact O-N 2.92Å |
| 75 | E | 80.4 | Confident | 78.2 | Confident | 124 Ų | 124 | 94.4 Ų | 94.4 | 58% | 0.579 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -63.7 | -49.5 | 175.5 | -74.4 | 176.6 | -175.7 | 0 | 0 | 111.6 | Q71 W72 L73 M77 S78 A79 | Q71-E75 WeakPolarHBondContact O-CB 3.28Å; Q71-E75 WeakPolarHBondContact O-CG 3.49Å; Q71-E75 PolarHBondContact O-N 3.48Å; W72-E75 PolarHBondContact O-N 3.04Å; L73-E75 VanDerWaalsContact C-N 3.34Å; L73-E75 PolarHBondContact O-N 2.98Å; E75-M77 VanDerWaalsContact C-N 3.33Å; E75-M77 PolarHBondContact O-N 3.35Å; E75-S78 PolarHBondContact O-N 3.35Å; E75-S78 VanDerWaalsContact O-N 3.15Å; E75-S78 PolarHBondContact O-OG 3.08Å; E75-A79 WeakPolarHBondContact O-CB 3.37Å; E75-A79 PolarHBondContact O-N 3.13Å |
| 76 | A | 80.2 | Confident | 79.3 | Confident | 44 Ų | 44 | 95 Ų | 95 | 36% | 0.364 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -59.6 | -43 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112 | W72 L73 A79 A80 | W72-A76 WeakPolarHBondContact O-CB 3.46Å; W72-A76 PolarHBondContact O-N 2.97Å; L73-A76 PolarHBondContact O-N 3.43Å; A76-A79 PolarHBondContact O-N 3.38Å; A76-A80 WeakPolarHBondContact O-CB 3.38Å; A76-A80 PolarHBondContact O-N 3.04Å |
| 77 | M | 75.3 | Confident | 79.8 | Confident | 53 Ų | 53 | 94.8 Ų | 94.8 | 26% | 0.261 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.7 | -44.1 | 174.7 | -69.9 | -176.5 | -50.6 | 0 | 0 | 111.4 | L43 L46 L73 E75 A79 A80 F81 | L43-M77 HydrophobicContact CD2-CE 3.87Å; L43-M77 HydrophobicContact CD2-CG 4.43Å; L43-M77 HydrophobicContact CD2-SD 3.15Å; L43-M77 WeakPolarHBondContact CD2-SD 3.2Å; L46-M77 HydrophobicContact CD2-CG 4.4Å; L46-M77 HydrophobicContact CD2-SD 4.29Å; L73-M77 WeakPolarHBondContact O-CB 3.19Å; L73-M77 WeakPolarHBondContact O-CG 3.42Å; L73-M77 PolarHBondContact O-N 3.18Å; E75-M77 VanDerWaalsContact C-N 3.33Å; E75-M77 PolarHBondContact O-N 3.35Å; M77-A79 VanDerWaalsContact C-N 3.26Å; M77-A79 PolarHBondContact O-N 3.16Å; M77-A80 PolarHBondContact O-N 3.28Å; M77-F81 HydrophobicContact CB-CD2 4.41Å; M77-F81 HydrophobicContact CB-CE2 4.47Å; M77-F81 WeakPolarHBondContact O-CD2 3.41Å; M77-F81 PolarHBondContact O-N 3.2Å |
| 78 | S | 77.1 | Confident | 80.4 | Confident | 62 Ų | 62 | 91 Ų | 91 | 43% | 0.434 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.5 | -36.3 | 177.7 | 78.8 | 0 | 0 | 0 | 0 | 112.2 | Q74 E75 R82 | Q74-S78 WeakPolarHBondContact O-CB 3.34Å; Q74-S78 PolarHBondContact O-N 2.92Å; E75-S78 PolarHBondContact O-N 3.35Å; E75-S78 VanDerWaalsContact O-N 3.15Å; E75-S78 PolarHBondContact O-OG 3.08Å; S78-R82 WeakPolarHBondContact O-CB 3.49Å; S78-R82 PolarHBondContact O-N 3.34Å |
| 79 | A | 76.4 | Confident | 81.1 | Confident | 57 Ų | 57 | 87.9 Ų | 87.9 | 47% | 0.471 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -70.6 | -45.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | E75 A76 M77 F81 R82 | E75-A79 WeakPolarHBondContact O-CB 3.37Å; E75-A79 PolarHBondContact O-N 3.13Å; A76-A79 PolarHBondContact O-N 3.38Å; M77-A79 VanDerWaalsContact C-N 3.26Å; M77-A79 PolarHBondContact O-N 3.16Å; A79-F81 PolarHBondContact O-N 2.99Å; A79-R82 WeakPolarHBondContact O-CB 3.27Å; A79-R82 PolarHBondContact O-N 3.41Å |
| 80 | A | 73.7 | Confident | 82 | Confident | 78 Ų | 78 | 84.7 Ų | 84.7 | 65% | 0.645 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -62.4 | -40.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | A76 M77 | A76-A80 WeakPolarHBondContact O-CB 3.38Å; A76-A80 PolarHBondContact O-N 3.04Å; M77-A80 PolarHBondContact O-N 3.28Å |
| 81 | F | 73.6 | Confident | 83 | Confident | 33 Ų | 33 | 79.4 Ų | 79.4 | 15% | 0.145 | 40% | 0.402 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | 3.1 | -179.2 | -64.3 | -63.8 | 0 | 0 | 0 | 114.1 | P40 M77 A79 R85 | P40-F81 VanDerWaalsContact O-CE1 3.29Å; P40-F81 WeakPolarHBondContact O-CE1 3.32Å; M77-F81 HydrophobicContact CB-CD2 4.41Å; M77-F81 HydrophobicContact CB-CE2 4.47Å; M77-F81 WeakPolarHBondContact O-CD2 3.41Å; M77-F81 PolarHBondContact O-N 3.2Å; A79-F81 PolarHBondContact O-N 2.99Å; F81-R85 WeakPolarHBondContact O-CB 3.38Å; F81-R85 WeakPolarHBondContact O-CG 3.46Å; F81-R85 PolarHBondContact O-N 3.25Å; F81-R85 VanDerWaalsContact O-N 3.1Å |
| 82 | R | 75.8 | Confident | 83.8 | Confident | 144 Ų | 144 | 79.4 Ų | 79.4 | 54% | 0.543 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -60.8 | -51.3 | -176.9 | -170.5 | -179.5 | -62.4 | -172.8 | 0.8 | 111.6 | S78 A79 Q84 R85 E86 | S78-R82 WeakPolarHBondContact O-CB 3.49Å; S78-R82 PolarHBondContact O-N 3.34Å; A79-R82 WeakPolarHBondContact O-CB 3.27Å; A79-R82 PolarHBondContact O-N 3.41Å; R82-Q84 PolarHBondContact O-N 2.98Å; R82-R85 PolarHBondContact O-N 3.48Å; R82-E86 VanDerWaalsContact CG-OE1 3.24Å; R82-E86 WeakPolarHBondContact CG-OE1 3.41Å; R82-E86 WeakPolarHBondContact O-CG 3.43Å; R82-E86 PolarHBondContact O-N 2.99Å |
| 83 | G | 79.3 | Confident | 84.4 | Confident | 37 Ų | 37 | 75.5 Ų | 75.5 | 38% | 0.381 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -58.7 | -48.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | R85 E86 E87 | G83-R85 VanDerWaalsContact C-N 3.34Å; G83-R85 PolarHBondContact O-N 3.26Å; G83-E86 WeakPolarHBondContact O-CB 3.47Å; G83-E86 PolarHBondContact O-N 3.39Å; G83-E86 VanDerWaalsContact O-N 3.15Å; G83-E87 WeakPolarHBondContact O-CG 3.42Å; G83-E87 PolarHBondContact O-N 2.91Å |
| 84 | Q | 79.8 | Confident | 85.3 | Confident | 56 Ų | 56 | 73 Ų | 73 | 26% | 0.262 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.1 | -40.1 | 178.5 | -170.8 | -176.9 | -13.3 | 0 | 0 | 112.4 | R82 E86 E87 V88 | R82-Q84 PolarHBondContact O-N 2.98Å; Q84-E86 VanDerWaalsContact C-N 3.32Å; Q84-E86 PolarHBondContact O-N 3.05Å; Q84-E87 PolarHBondContact O-N 3.3Å; Q84-V88 WeakPolarHBondContact O-CG2 3.41Å; Q84-V88 PolarHBondContact O-N 3.38Å |
| 85 | R | 81.6 | Confident | 86.2 | Confident | 185 Ų | 185 | 67.4 Ų | 67.4 | 70% | 0.698 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -64.4 | -38.1 | 176.3 | -74.3 | 179.2 | -179 | -144.7 | 1.8 | 112 | F81 R82 G83 E89 | F81-R85 WeakPolarHBondContact O-CB 3.38Å; F81-R85 WeakPolarHBondContact O-CG 3.46Å; F81-R85 PolarHBondContact O-N 3.25Å; F81-R85 VanDerWaalsContact O-N 3.1Å; R82-R85 PolarHBondContact O-N 3.48Å; G83-R85 VanDerWaalsContact C-N 3.34Å; G83-R85 PolarHBondContact O-N 3.26Å; R85-E89 WeakPolarHBondContact O-CB 3.42Å; R85-E89 PolarHBondContact O-N 3.44Å; R85-E89 VanDerWaalsContact O-N 3.09Å |
| 86 | E | 89.4 | Confident | 87 | Confident | 106 Ų | 106 | 68.9 Ų | 68.9 | 50% | 0.495 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -65.8 | -44.8 | 176.2 | -72.4 | 172.6 | -172 | 0 | 0 | 111.3 | R82 G83 Q84 E89 Q90 | R82-E86 VanDerWaalsContact CG-OE1 3.24Å; R82-E86 WeakPolarHBondContact CG-OE1 3.41Å; R82-E86 WeakPolarHBondContact O-CG 3.43Å; R82-E86 PolarHBondContact O-N 2.99Å; G83-E86 WeakPolarHBondContact O-CB 3.47Å; G83-E86 PolarHBondContact O-N 3.39Å; G83-E86 VanDerWaalsContact O-N 3.15Å; Q84-E86 VanDerWaalsContact C-N 3.32Å; Q84-E86 PolarHBondContact O-N 3.05Å; E86-E89 PolarHBondContact O-N 3.36Å; E86-Q90 VanDerWaalsContact O-CG 3.31Å; E86-Q90 WeakPolarHBondContact O-CG 3.38Å; E86-Q90 PolarHBondContact O-N 3.23Å |
| 87 | E | 93.2 | Very high | 87.7 | Confident | 63 Ų | 63 | 67.8 Ų | 67.8 | 29% | 0.294 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.7 | -44.7 | 177.2 | -69.8 | 177.1 | 173.5 | 0 | 0 | 112 | G83 Q84 E89 Q90 M91 L128 N134 | G83-E87 WeakPolarHBondContact O-CG 3.42Å; G83-E87 PolarHBondContact O-N 2.91Å; Q84-E87 PolarHBondContact O-N 3.3Å; E87-E89 VanDerWaalsContact C-N 3.29Å; E87-E89 PolarHBondContact O-N 3Å; E87-Q90 WeakPolarHBondContact O-CB 3.24Å; E87-Q90 PolarHBondContact O-N 3.44Å; E87-M91 WeakPolarHBondContact O-CG 3.5Å; E87-M91 PolarHBondContact O-N 3.32Å; E87-L128 HydrophobicContact CB-CD2 4.04Å; E87-L128 HydrophobicContact CG-CD2 3.79Å; E87-N134 PolarHBondContact OE2-ND2 3Å; E87-N134 PolarHBondContact OE2-OD1 3.14Å |
| 88 | V | 93.4 | Very high | 88.7 | Confident | 27 Ų | 27 | 65.3 Ų | 65.3 | 16% | 0.164 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -62.3 | -38.1 | 175.8 | 173.2 | 0 | 0 | 0 | 0 | 111.5 | Q84 M91 K92 D137 | Q84-V88 WeakPolarHBondContact O-CG2 3.41Å; Q84-V88 PolarHBondContact O-N 3.38Å; V88-M91 HydrophobicContact CB-CE 4.31Å; V88-M91 HydrophobicContact CG2-CE 3.88Å; V88-M91 PolarHBondContact O-N 3.3Å; V88-K92 WeakPolarHBondContact O-CG 3.28Å; V88-K92 PolarHBondContact O-N 3.45Å; V88-D137 HydrophobicContact CG2-CB 4.45Å; V88-D137 WeakPolarHBondContact CG2-OD2 3.35Å |
| 89 | E | 94.6 | Very high | 89.5 | Confident | 93 Ų | 93 | 65.8 Ų | 65.8 | 44% | 0.435 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -69.8 | -37.4 | 176.4 | -166.2 | 57.5 | -151.2 | 0 | 0 | 112 | R85 E86 E87 K92 N93 | R85-E89 WeakPolarHBondContact O-CB 3.42Å; R85-E89 PolarHBondContact O-N 3.44Å; R85-E89 VanDerWaalsContact O-N 3.09Å; E86-E89 PolarHBondContact O-N 3.36Å; E87-E89 VanDerWaalsContact C-N 3.29Å; E87-E89 PolarHBondContact O-N 3Å; E89-K92 PolarHBondContact O-N 3.48Å; E89-K92 IonicContact OE2-NZ 3.74Å; E89-N93 PolarHBondContact O-N 3.5Å; E89-N93 PolarHBondContact O-ND2 2.73Å |
| 90 | Q | 96.5 | Very high | 90.2 | Very high | 75 Ų | 75 | 67.4 Ų | 67.4 | 35% | 0.35 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -61.2 | -45.5 | 171.2 | -70.3 | 173.2 | 22.7 | 0 | 0 | 111.2 | E86 E87 K92 N93 C94 L128 | E86-Q90 VanDerWaalsContact O-CG 3.31Å; E86-Q90 WeakPolarHBondContact O-CG 3.38Å; E86-Q90 PolarHBondContact O-N 3.23Å; E87-Q90 WeakPolarHBondContact O-CB 3.24Å; E87-Q90 PolarHBondContact O-N 3.44Å; Q90-K92 VanDerWaalsContact C-N 3.34Å; Q90-K92 PolarHBondContact O-N 3.06Å; Q90-N93 WeakPolarHBondContact O-CB 3.41Å; Q90-N93 PolarHBondContact O-N 3.34Å; Q90-N93 VanDerWaalsContact O-N 3.12Å; Q90-C94 PolarHBondContact O-N 2.94Å; Q90-C94 PolarHBondContact O-SG 3.08Å; Q90-C94 VanDerWaalsContact O-SG 3.42Å; Q90-L128 HydrophobicContact CB-CD1 3.87Å |
| 91 | M | 97.8 | Very high | 90.7 | Very high | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -58.8 | -43.8 | 175.7 | -70 | -166.7 | -74.6 | 0 | 0 | 112.1 | E87 V88 N93 C94 L95 L125 L128 N134 D137 F138 L141 | E87-M91 WeakPolarHBondContact O-CG 3.5Å; E87-M91 PolarHBondContact O-N 3.32Å; V88-M91 HydrophobicContact CB-CE 4.31Å; V88-M91 HydrophobicContact CG2-CE 3.88Å; V88-M91 PolarHBondContact O-N 3.3Å; M91-N93 VanDerWaalsContact C-N 3.33Å; M91-N93 PolarHBondContact O-N 2.94Å; M91-C94 PolarHBondContact O-N 3.17Å; M91-L95 WeakPolarHBondContact O-CB 3.29Å; M91-L95 VanDerWaalsContact O-CG 3.32Å; M91-L95 WeakPolarHBondContact O-CG 3.48Å; M91-L95 PolarHBondContact O-N 3.44Å; M91-L125 HydrophobicContact CB-CD2 3.97Å; M91-L125 HydrophobicContact CG-CD2 3.85Å; M91-L128 HydrophobicContact CG-CB 4.35Å; M91-L128 HydrophobicContact CG-CD1 3.75Å; M91-N134 HydrophobicContact CE-CB 3.95Å; M91-N134 HydrophobicContact SD-CB 3.99Å; M91-D137 HydrophobicContact CE-CB 3.83Å; M91-F138 HydrophobicContact SD-CB 3.95Å; M91-L141 HydrophobicContact CB-CD1 4.32Å |
| 92 | K | 97.9 | Very high | 90.8 | Very high | 92 Ų | 92 | 69.6 Ų | 69.6 | 40% | 0.4 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -61.9 | -39.6 | 175.2 | -72.6 | 173.7 | -171.4 | 166.2 | 0 | 112.5 | V88 E89 Q90 L95 R96 L141 | V88-K92 WeakPolarHBondContact O-CG 3.28Å; V88-K92 PolarHBondContact O-N 3.45Å; E89-K92 PolarHBondContact O-N 3.48Å; E89-K92 IonicContact OE2-NZ 3.74Å; Q90-K92 VanDerWaalsContact C-N 3.34Å; Q90-K92 PolarHBondContact O-N 3.06Å; K92-L95 PolarHBondContact O-N 3.03Å; K92-R96 WeakPolarHBondContact O-CB 3.36Å; K92-R96 PolarHBondContact O-N 3.18Å; K92-L141 HydrophobicContact CG-CD1 3.98Å; K92-L141 HydrophobicContact CG-CD2 4.15Å |
| 93 | N | 97.4 | Very high | 90.7 | Very high | 59 Ų | 59 | 65.1 Ų | 65.1 | 32% | 0.316 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -63.7 | -46.2 | 176.2 | -77.5 | -49.6 | 0 | 0 | 0 | 111.7 | E89 Q90 M91 L95 R96 V97 | E89-N93 PolarHBondContact O-N 3.5Å; E89-N93 PolarHBondContact O-ND2 2.73Å; Q90-N93 WeakPolarHBondContact O-CB 3.41Å; Q90-N93 PolarHBondContact O-N 3.34Å; Q90-N93 VanDerWaalsContact O-N 3.12Å; M91-N93 VanDerWaalsContact C-N 3.33Å; M91-N93 PolarHBondContact O-N 2.94Å; N93-L95 PolarHBondContact O-N 2.88Å; N93-R96 WeakPolarHBondContact O-CB 3.4Å; N93-R96 PolarHBondContact O-N 2.7Å; N93-R96 PolarHBondContact OD1-NH2 3.4Å; N93-V97 PolarHBondContact O-N 2.87Å |
| 94 | C | 98.1 | Very high | 90.1 | Very high | 9 Ų | 9 | 68.3 Ų | 68.3 | 6% | 0.061 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -59 | -46.2 | 173.6 | -66.9 | 0 | 0 | 0 | 0 | 111.6 | Q90 M91 R96 V97 L98 A121 L125 | Q90-C94 PolarHBondContact O-N 2.94Å; Q90-C94 PolarHBondContact O-SG 3.08Å; Q90-C94 VanDerWaalsContact O-SG 3.42Å; M91-C94 PolarHBondContact O-N 3.17Å; C94-R96 VanDerWaalsContact C-N 3.28Å; C94-R96 PolarHBondContact O-N 3.33Å; C94-V97 PolarHBondContact O-N 3.45Å; C94-L98 WeakPolarHBondContact O-CB 3.37Å; C94-L98 VanDerWaalsContact O-CG 3.26Å; C94-L98 WeakPolarHBondContact O-CG 3.29Å; C94-L98 PolarHBondContact O-N 3.24Å; C94-A121 HydrophobicContact CB-CB 4.05Å; C94-L125 HydrophobicContact CB-CD1 3.69Å; C94-L125 HydrophobicContact CB-CD2 3.84Å; C94-L125 HydrophobicContact CB-CG 3.55Å |
| 95 | L | 97.9 | Very high | 89.6 | Confident | 18 Ų | 18 | 74.6 Ų | 74.6 | 9% | 0.094 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -62 | -35.7 | 177.5 | -74.4 | 174.3 | 0 | 0 | 0 | 112.6 | M91 K92 N93 L98 S99 F138 L141 L146 | M91-L95 WeakPolarHBondContact O-CB 3.29Å; M91-L95 VanDerWaalsContact O-CG 3.32Å; M91-L95 WeakPolarHBondContact O-CG 3.48Å; M91-L95 PolarHBondContact O-N 3.44Å; K92-L95 PolarHBondContact O-N 3.03Å; N93-L95 PolarHBondContact O-N 2.88Å; L95-L98 PolarHBondContact O-N 3.3Å; L95-S99 VanDerWaalsContact O-CB 3.24Å; L95-S99 WeakPolarHBondContact O-CB 3.32Å; L95-S99 PolarHBondContact O-N 2.87Å; L95-S99 PolarHBondContact O-OG 2.89Å; L95-F138 HydrophobicContact CD1-CD2 4.39Å; L95-F138 HydrophobicContact CD1-CE2 4.47Å; L95-F138 HydrophobicContact CD2-CD2 4.37Å; L95-F138 HydrophobicContact CD2-CE2 3.66Å; L95-F138 HydrophobicContact CD2-CZ 4.39Å; L95-F138 HydrophobicContact CG-CE2 4.24Å; L95-L141 HydrophobicContact CD1-CB 3.5Å; L95-L141 HydrophobicContact CD1-CD1 4.03Å; L95-L141 HydrophobicContact CD1-CG 4.37Å; L95-L146 HydrophobicContact CD2-CD2 4.05Å |
| 96 | R | 97.1 | Very high | 89.3 | Confident | 156 Ų | 156 | 66.6 Ų | 66.6 | 59% | 0.589 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -63.3 | -48.1 | 174.5 | 179.5 | 172.7 | 56.6 | 125.8 | -3 | 111.1 | K92 N93 C94 L98 S99 Q100 | K92-R96 WeakPolarHBondContact O-CB 3.36Å; K92-R96 PolarHBondContact O-N 3.18Å; N93-R96 WeakPolarHBondContact O-CB 3.4Å; N93-R96 PolarHBondContact O-N 2.7Å; N93-R96 PolarHBondContact OD1-NH2 3.4Å; C94-R96 VanDerWaalsContact C-N 3.28Å; C94-R96 PolarHBondContact O-N 3.33Å; R96-L98 VanDerWaalsContact C-N 3.34Å; R96-L98 PolarHBondContact O-N 3.14Å; R96-S99 PolarHBondContact O-N 3.2Å; R96-Q100 WeakPolarHBondContact O-CG 3.48Å; R96-Q100 PolarHBondContact O-N 3.48Å |
| 97 | V | 95.5 | Very high | 89 | Confident | 21 Ų | 21 | 63.5 Ų | 63.5 | 13% | 0.127 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -56.5 | -50 | 174.1 | 171.7 | 0 | 0 | 0 | 0 | 110.2 | N93 C94 S99 Q100 E117 R118 A121 | N93-V97 PolarHBondContact O-N 2.87Å; C94-V97 PolarHBondContact O-N 3.45Å; V97-S99 PolarHBondContact O-N 3.25Å; V97-Q100 PolarHBondContact O-N 3.32Å; V97-E117 HydrophobicContact CG1-CG 3.88Å; V97-R118 HydrophobicContact CG1-CG 4.25Å; V97-A121 HydrophobicContact CB-CB 4.45Å; V97-A121 HydrophobicContact CG1-CB 4.26Å |
| 98 | L | 96.3 | Very high | 88.5 | Confident | 0 Ų | 0 | 68.9 Ų | 68.9 | 0% | 0 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -68 | -21.2 | -177.4 | -65.3 | 173.5 | 0 | 0 | 0 | 113.9 | C94 L95 R96 R118 A121 L122 L125 L146 R150 Y151 | C94-L98 WeakPolarHBondContact O-CB 3.37Å; C94-L98 VanDerWaalsContact O-CG 3.26Å; C94-L98 WeakPolarHBondContact O-CG 3.29Å; C94-L98 PolarHBondContact O-N 3.24Å; L95-L98 PolarHBondContact O-N 3.3Å; R96-L98 VanDerWaalsContact C-N 3.34Å; R96-L98 PolarHBondContact O-N 3.14Å; L98-R118 HydrophobicContact CD2-CB 3.93Å; L98-R118 HydrophobicContact CD2-CG 4.17Å; L98-A121 HydrophobicContact CD1-CB 4.48Å; L98-A121 HydrophobicContact CD2-CB 4.17Å; L98-A121 HydrophobicContact CG-CB 4.1Å; L98-L122 HydrophobicContact CD1-CD2 3.7Å; L98-L122 HydrophobicContact CD1-CG 4.18Å; L98-L122 HydrophobicContact CD2-CD1 4.43Å; L98-L122 HydrophobicContact CD2-CD2 4.12Å; L98-L122 HydrophobicContact CD2-CG 3.86Å; L98-L125 HydrophobicContact CD1-CD1 3.5Å; L98-L125 VanDerWaalsContact CD1-CD1 3.5Å; L98-L146 HydrophobicContact CB-CD2 3.52Å; L98-R150 PolarHBondContact O-NH1 3.29Å; L98-R150 VanDerWaalsContact O-NH1 3.11Å; L98-Y151 WeakPolarHBondContact CA-OH 3.3Å; L98-Y151 HydrophobicContact CB-CE2 3.85Å; L98-Y151 HydrophobicContact CD2-CE1 3.88Å; L98-Y151 HydrophobicContact CD2-CE2 4.06Å; L98-Y151 WeakPolarHBondContact CD2-OH 3.38Å; L98-Y151 HydrophobicContact CG-CE2 4.44Å; L98-Y151 WeakPolarHBondContact O-CE2 3.22Å; L98-Y151 PolarHBondContact O-OH 2.87Å |
| 99 | S | 94.8 | Very high | 88.2 | Confident | 72 Ų | 72 | 71.2 Ų | 71.2 | 50% | 0.503 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -85.9 | -16.6 | 178.9 | -61.5 | 0 | 0 | 0 | 0 | 113 | L95 R96 V97 R150 | L95-S99 VanDerWaalsContact O-CB 3.24Å; L95-S99 WeakPolarHBondContact O-CB 3.32Å; L95-S99 PolarHBondContact O-N 2.87Å; L95-S99 PolarHBondContact O-OG 2.89Å; R96-S99 PolarHBondContact O-N 3.2Å; V97-S99 PolarHBondContact O-N 3.25Å; S99-R150 PolarHBondContact O-NH1 2.94Å |
| 100 | Q | 90.5 | Very high | 87.8 | Confident | 91 Ų | 91 | 72.7 Ų | 72.7 | 43% | 0.425 | 42% | 0.415 | S | S | . | . | S | Bend | trans | -62 | 148 | 179.2 | -70 | 175.8 | 24 | 0 | 0 | 111.7 | R96 V97 R118 R150 | R96-Q100 WeakPolarHBondContact O-CG 3.48Å; R96-Q100 PolarHBondContact O-N 3.48Å; V97-Q100 PolarHBondContact O-N 3.32Å; Q100-R118 PolarHBondContact O-NH2 3.36Å; Q100-R150 PolarHBondContact O-NH1 3.48Å; Q100-R150 PolarHBondContact O-NH2 3.41Å |
| 101 | A | 84.4 | Confident | 87.3 | Confident | 86 Ų | 86 | 72.3 Ų | 72.3 | 71% | 0.711 | 42% | 0.415 | S | S | * | . | P | Polyproline II helix | trans | -66 | 139.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | R118 | A101-R118 PolarHBondContact O-NH2 3.26Š|
| 102 | T | 75.3 | Confident | 86.8 | Confident | 72 Ų | 72 | 75.1 Ų | 75.1 | 44% | 0.442 | 44% | 0.438 | S | S | . | . | P | Polyproline II helix | trans | -63.1 | 126.9 | 170.3 | -50 | 0 | 0 | 0 | 0 | 108.4 | A104 L111 R118 R150 | T102-A104 PolarHBondContact O-N 2.99Å; T102-L111 HydrophobicContact CG2-CD2 4.29Å; T102-R118 PolarHBondContact OG1-NH1 3.47Å; T102-R150 PolarHBondContact OG1-NH2 3.47Å |
| 103 | P | 73.4 | Confident | 86.5 | Confident | 50 Ų | 50 | 74.9 Ų | 74.9 | 33% | 0.325 | 45% | 0.445 | S | S | . | . | trans | -65.3 | 104.4 | -178.2 | 24.9 | -31.9 | 0 | 0 | 0 | 109.7 | M105 A106 L111 D114 | P103-M105 PolarHBondContact O-N 3.36Å; P103-A106 HydrophobicContact CB-CB 3.68Å; P103-A106 HydrophobicContact CG-CB 3.74Å; P103-A106 PolarHBondContact O-N 3.36Å; P103-L111 HydrophobicContact CG-CD2 4.33Å; P103-L111 WeakPolarHBondContact O-CD2 3.12Å; P103-D114 HydrophobicContact CG-CB 4.41Å | ||
| 104 | A | 67.7 | Low | 86.2 | Confident | 103 Ų | 103 | 73.1 Ų | 73.1 | 85% | 0.851 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.2 | -19.7 | -172.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | T102 | T102-A104 PolarHBondContact O-N 2.99Š|
| 105 | M | 69.2 | Low | 85.9 | Confident | 189 Ų | 189 | 76.3 Ų | 76.3 | 93% | 0.931 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -112 | 11.9 | -176.6 | -66.1 | -93.5 | -72.4 | 0 | 0 | 112.2 | P103 | P103-M105 PolarHBondContact O-N 3.36Š|
| 106 | A | 74.8 | Confident | 85.8 | Confident | 17 Ų | 17 | 82.3 Ų | 82.3 | 14% | 0.14 | 48% | 0.477 | C | S | . | . | trans | -73.7 | 145.6 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | P103 E110 L111 | P103-A106 HydrophobicContact CB-CB 3.68Å; P103-A106 HydrophobicContact CG-CB 3.74Å; P103-A106 PolarHBondContact O-N 3.36Å; A106-E110 VanDerWaalsContact CA-OE2 3.22Å; A106-E110 WeakPolarHBondContact CA-OE2 3.34Å; A106-E110 HydrophobicContact CB-CB 3.62Å; A106-E110 VanDerWaalsContact CB-OE2 3.31Å; A106-E110 WeakPolarHBondContact CB-OE2 3.47Å; A106-L111 HydrophobicContact CB-CD2 3.97Å; A106-L111 HydrophobicContact CB-CG 3.89Å | ||
| 107 | G | 83.3 | Confident | 85.7 | Confident | 41 Ų | 41 | 79.8 Ų | 79.8 | 42% | 0.423 | 47% | 0.472 | S | S | . | . | trans | -64.9 | 163.6 | 168.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | A109 E110 L111 | G107-A109 PolarHBondContact O-N 3.46Å; G107-E110 PolarHBondContact N-OE2 2.83Å; G107-E110 PolarHBondContact O-N 3.05Å; G107-L111 PolarHBondContact O-N 3.07Å | ||
| 108 | E | 83.2 | Confident | 85.8 | Confident | 176 Ų | 176 | 79 Ų | 79 | 82% | 0.822 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -54.3 | -38.6 | 179.9 | -66.2 | 179.9 | 170.3 | 0 | 0 | 112.8 | L111 A112 | E108-L111 PolarHBondContact O-N 3.2Å; E108-A112 WeakPolarHBondContact O-CB 3.45Å; E108-A112 PolarHBondContact O-N 2.88Å |
| 109 | A | 85.8 | Confident | 85.9 | Confident | 76 Ų | 76 | 80.6 Ų | 80.6 | 63% | 0.628 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -66.8 | -37.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | G107 T113 | G107-A109 PolarHBondContact O-N 3.46Å; A109-T113 WeakPolarHBondContact O-CB 3.34Å; A109-T113 PolarHBondContact O-N 3.35Å; A109-T113 PolarHBondContact O-OG1 3.14Å |
| 110 | E | 86 | Confident | 86.1 | Confident | 123 Ų | 123 | 78.7 Ų | 78.7 | 58% | 0.575 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -71.3 | -40.1 | 177.2 | -72.7 | 175.7 | 173 | 0 | 0 | 110.9 | A106 G107 T113 D114 | A106-E110 VanDerWaalsContact CA-OE2 3.22Å; A106-E110 WeakPolarHBondContact CA-OE2 3.34Å; A106-E110 HydrophobicContact CB-CB 3.62Å; A106-E110 VanDerWaalsContact CB-OE2 3.31Å; A106-E110 WeakPolarHBondContact CB-OE2 3.47Å; G107-E110 PolarHBondContact N-OE2 2.83Å; G107-E110 PolarHBondContact O-N 3.05Å; E110-T113 PolarHBondContact O-N 3.06Å; E110-D114 WeakPolarHBondContact O-CB 3.4Å; E110-D114 PolarHBondContact O-N 3.44Å |
| 111 | L | 86.5 | Confident | 86.4 | Confident | 68 Ų | 68 | 74.8 Ų | 74.8 | 36% | 0.356 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.6 | -41.2 | 174.1 | -70.4 | 173.1 | 0 | 0 | 0 | 112.2 | T102 P103 A106 G107 E108 T113 D114 Q115 | T102-L111 HydrophobicContact CG2-CD2 4.29Å; P103-L111 HydrophobicContact CG-CD2 4.33Å; P103-L111 WeakPolarHBondContact O-CD2 3.12Å; A106-L111 HydrophobicContact CB-CD2 3.97Å; A106-L111 HydrophobicContact CB-CG 3.89Å; G107-L111 PolarHBondContact O-N 3.07Å; E108-L111 PolarHBondContact O-N 3.2Å; L111-T113 VanDerWaalsContact C-N 3.33Å; L111-D114 PolarHBondContact O-N 3.01Å; L111-Q115 WeakPolarHBondContact O-CB 3.49Å; L111-Q115 PolarHBondContact O-N 3.2Å |
| 112 | A | 88.3 | Confident | 87.1 | Confident | 58 Ų | 58 | 70.8 Ų | 70.8 | 48% | 0.479 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -63.2 | -40.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | E108 Q115 Q116 | E108-A112 WeakPolarHBondContact O-CB 3.45Å; E108-A112 PolarHBondContact O-N 2.88Å; A112-Q115 PolarHBondContact O-N 3.08Å; A112-Q116 WeakPolarHBondContact O-CB 3.39Å; A112-Q116 PolarHBondContact O-N 3.19Å |
| 113 | T | 90.2 | Very high | 88.2 | Confident | 88 Ų | 88 | 71.1 Ų | 71.1 | 54% | 0.54 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -67 | -45.7 | 177.5 | -53.8 | 0 | 0 | 0 | 0 | 111.5 | A109 E110 L111 Q115 Q116 E117 | A109-T113 WeakPolarHBondContact O-CB 3.34Å; A109-T113 PolarHBondContact O-N 3.35Å; A109-T113 PolarHBondContact O-OG1 3.14Å; E110-T113 PolarHBondContact O-N 3.06Å; L111-T113 VanDerWaalsContact C-N 3.33Å; T113-Q115 VanDerWaalsContact C-N 3.33Å; T113-Q115 PolarHBondContact O-N 3.14Å; T113-Q116 PolarHBondContact O-N 3.21Å; T113-E117 PolarHBondContact O-N 3.32Å |
| 114 | D | 91.6 | Very high | 89.4 | Confident | 22 Ų | 22 | 72 Ų | 72 | 12% | 0.118 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -60.4 | -41.4 | 175 | 172.7 | 76.4 | 0 | 0 | 0 | 111.5 | P103 E110 L111 E117 R118 | P103-D114 HydrophobicContact CG-CB 4.41Å; E110-D114 WeakPolarHBondContact O-CB 3.4Å; E110-D114 PolarHBondContact O-N 3.44Å; L111-D114 PolarHBondContact O-N 3.01Å; D114-E117 PolarHBondContact O-N 3.16Å; D114-R118 VanDerWaalsContact CG-NE 3.31Å; D114-R118 VanDerWaalsContact O-CG 3.27Å; D114-R118 WeakPolarHBondContact O-CG 3.48Å; D114-R118 PolarHBondContact O-N 2.85Å; D114-R118 VanDerWaalsContact O-N 3.09Å; D114-R118 IonicContact OD1-CZ 3Å; D114-R118 IonicContact OD1-NE 3.21Å; D114-R118 PolarHBondContact OD1-NE 2.8Å; D114-R118 IonicContact OD1-NH2 3.01Å; D114-R118 PolarHBondContact OD1-NH2 3.35Å; D114-R118 IonicContact OD2-CZ 3.22Å; D114-R118 IonicContact OD2-NE 2.69Å; D114-R118 PolarHBondContact OD2-NE 3.39Å; D114-R118 IonicContact OD2-NH1 2.81Å; D114-R118 IonicContact OD2-NH2 3.62Å; D114-R118 PolarHBondContact OD2-NH2 3.37Å; D114-R118 VanDerWaalsContact OD2-NH2 3.11Å |
| 115 | Q | 92.8 | Very high | 90.9 | Very high | 75 Ų | 75 | 67 Ų | 67 | 35% | 0.35 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -62.8 | -46.1 | 175.3 | -174.7 | -178.7 | -44.4 | 0 | 0 | 111.3 | L111 A112 T113 E117 R118 E119 A156 L159 | L111-Q115 WeakPolarHBondContact O-CB 3.49Å; L111-Q115 PolarHBondContact O-N 3.2Å; A112-Q115 PolarHBondContact O-N 3.08Å; T113-Q115 VanDerWaalsContact C-N 3.33Å; T113-Q115 PolarHBondContact O-N 3.14Å; Q115-E117 VanDerWaalsContact C-N 3.35Å; Q115-E117 PolarHBondContact O-N 2.96Å; Q115-R118 PolarHBondContact O-N 2.88Å; Q115-E119 HydrophobicContact CG-CG 4.36Å; Q115-E119 WeakPolarHBondContact CG-OE1 2.89Å; Q115-E119 PolarHBondContact NE2-OE1 3.32Å; Q115-E119 WeakPolarHBondContact O-CB 3.39Å; Q115-E119 VanDerWaalsContact O-CG 3.32Å; Q115-E119 WeakPolarHBondContact O-CG 3.5Å; Q115-E119 PolarHBondContact O-N 2.87Å; Q115-A156 HydrophobicContact CG-CB 4.29Å; Q115-L159 HydrophobicContact CG-CG 4.47Å |
| 116 | Q | 95.2 | Very high | 92.2 | Very high | 144 Ų | 144 | 58.2 Ų | 58.2 | 67% | 0.673 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -61.9 | -41.5 | 179.1 | -175.7 | 177.7 | -10.2 | 0 | 0 | 111.9 | A112 T113 R118 E119 G120 | A112-Q116 WeakPolarHBondContact O-CB 3.39Å; A112-Q116 PolarHBondContact O-N 3.19Å; T113-Q116 PolarHBondContact O-N 3.21Å; Q116-R118 VanDerWaalsContact C-N 3.34Å; Q116-R118 PolarHBondContact O-N 3.37Å; Q116-E119 PolarHBondContact O-N 3.23Å; Q116-G120 PolarHBondContact O-N 2.88Å |
| 117 | E | 95.9 | Very high | 93.2 | Very high | 104 Ų | 104 | 62.2 Ų | 62.2 | 49% | 0.486 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -62.1 | -42.7 | 177.2 | -165.2 | -176.4 | 179.5 | 0 | 0 | 111.4 | V97 T113 D114 Q115 G120 A121 | V97-E117 HydrophobicContact CG1-CG 3.88Å; T113-E117 PolarHBondContact O-N 3.32Å; D114-E117 PolarHBondContact O-N 3.16Å; Q115-E117 VanDerWaalsContact C-N 3.35Å; Q115-E117 PolarHBondContact O-N 2.96Å; E117-G120 PolarHBondContact O-N 2.82Å; E117-A121 WeakPolarHBondContact O-CB 3.34Å; E117-A121 PolarHBondContact O-N 3.28Å |
| 118 | R | 97.1 | Very high | 93.9 | Very high | 5 Ų | 5 | 61 Ų | 61 | 2% | 0.019 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -69.3 | -38.1 | 176.8 | -68.4 | 172.7 | -170.6 | -160.2 | 1.3 | 112.8 | V97 L98 Q100 A101 T102 D114 Q115 Q116 A121 L122 R150 L159 | V97-R118 HydrophobicContact CG1-CG 4.25Å; L98-R118 HydrophobicContact CD2-CB 3.93Å; L98-R118 HydrophobicContact CD2-CG 4.17Å; Q100-R118 PolarHBondContact O-NH2 3.36Å; A101-R118 PolarHBondContact O-NH2 3.26Å; T102-R118 PolarHBondContact OG1-NH1 3.47Å; D114-R118 VanDerWaalsContact CG-NE 3.31Å; D114-R118 VanDerWaalsContact O-CG 3.27Å; D114-R118 WeakPolarHBondContact O-CG 3.48Å; D114-R118 PolarHBondContact O-N 2.85Å; D114-R118 VanDerWaalsContact O-N 3.09Å; D114-R118 IonicContact OD1-CZ 3Å; D114-R118 IonicContact OD1-NE 3.21Å; D114-R118 PolarHBondContact OD1-NE 2.8Å; D114-R118 IonicContact OD1-NH2 3.01Å; D114-R118 PolarHBondContact OD1-NH2 3.35Å; D114-R118 IonicContact OD2-CZ 3.22Å; D114-R118 IonicContact OD2-NE 2.69Å; D114-R118 PolarHBondContact OD2-NE 3.39Å; D114-R118 IonicContact OD2-NH1 2.81Å; D114-R118 IonicContact OD2-NH2 3.62Å; D114-R118 PolarHBondContact OD2-NH2 3.37Å; D114-R118 VanDerWaalsContact OD2-NH2 3.11Å; Q115-R118 PolarHBondContact O-N 2.88Å; Q116-R118 VanDerWaalsContact C-N 3.34Å; Q116-R118 PolarHBondContact O-N 3.37Å; R118-A121 PolarHBondContact O-N 3.11Å; R118-L122 WeakPolarHBondContact O-CG 3.39Å; R118-L122 PolarHBondContact O-N 3.32Å; R118-R150 VanDerWaalsContact NH1-NH2 3.12Å; R118-L159 HydrophobicContact CB-CD2 3.74Å |
| 119 | E | 98 | Very high | 94.5 | Very high | 32 Ų | 32 | 52.8 Ų | 52.8 | 15% | 0.15 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61.4 | -46.8 | 174.1 | -75.8 | -175.3 | -167 | 0 | 0 | 111 | Q115 Q116 A121 L122 E123 G158 L159 R162 | Q115-E119 HydrophobicContact CG-CG 4.36Å; Q115-E119 WeakPolarHBondContact CG-OE1 2.89Å; Q115-E119 PolarHBondContact NE2-OE1 3.32Å; Q115-E119 WeakPolarHBondContact O-CB 3.39Å; Q115-E119 VanDerWaalsContact O-CG 3.32Å; Q115-E119 WeakPolarHBondContact O-CG 3.5Å; Q115-E119 PolarHBondContact O-N 2.87Å; Q116-E119 PolarHBondContact O-N 3.23Å; E119-A121 VanDerWaalsContact C-N 3.35Å; E119-A121 PolarHBondContact O-N 3.3Å; E119-L122 PolarHBondContact O-N 2.95Å; E119-E123 WeakPolarHBondContact O-CG 3.45Å; E119-E123 PolarHBondContact O-N 2.68Å; E119-G158 WeakPolarHBondContact OE1-CA 3.01Å; E119-L159 HydrophobicContact CG-CD2 3.72Å; E119-L159 HydrophobicContact CG-CG 4.39Å; E119-R162 WeakPolarHBondContact O-CD 3.48Å; E119-R162 IonicContact OE1-NH1 3.06Å; E119-R162 IonicContact OE2-CZ 3.65Å; E119-R162 VanDerWaalsContact OE2-CZ 3.25Å; E119-R162 IonicContact OE2-NH1 3.36Å; E119-R162 PolarHBondContact OE2-NH1 2.94Å; E119-R162 IonicContact OE2-NH2 3.96Å; E119-R162 PolarHBondContact OE2-NH2 3.5Å |
| 120 | G | 98.1 | Very high | 94.9 | Very high | 33 Ų | 33 | 56 Ų | 56 | 34% | 0.34 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -62.7 | -39 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113 | Q116 E117 L122 E123 L124 | Q116-G120 PolarHBondContact O-N 2.88Å; E117-G120 PolarHBondContact O-N 2.82Å; G120-L122 VanDerWaalsContact C-N 3.35Å; G120-L122 PolarHBondContact O-N 2.96Å; G120-E123 PolarHBondContact O-N 3.38Å; G120-L124 WeakPolarHBondContact O-CB 3.11Å; G120-L124 PolarHBondContact O-N 3.25Å |
| 121 | A | 98.4 | Very high | 95.2 | Very high | 9 Ų | 9 | 53.6 Ų | 53.6 | 7% | 0.074 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63.3 | -39.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | C94 V97 L98 E117 R118 E119 L125 | C94-A121 HydrophobicContact CB-CB 4.05Å; V97-A121 HydrophobicContact CB-CB 4.45Å; V97-A121 HydrophobicContact CG1-CB 4.26Å; L98-A121 HydrophobicContact CD1-CB 4.48Å; L98-A121 HydrophobicContact CD2-CB 4.17Å; L98-A121 HydrophobicContact CG-CB 4.1Å; E117-A121 WeakPolarHBondContact O-CB 3.34Å; E117-A121 PolarHBondContact O-N 3.28Å; R118-A121 PolarHBondContact O-N 3.11Å; E119-A121 VanDerWaalsContact C-N 3.35Å; E119-A121 PolarHBondContact O-N 3.3Å; A121-L125 WeakPolarHBondContact O-CB 3.42Å; A121-L125 WeakPolarHBondContact O-CD1 3.34Å; A121-L125 VanDerWaalsContact O-CG 3.22Å; A121-L125 WeakPolarHBondContact O-CG 3.37Å; A121-L125 PolarHBondContact O-N 3.46Å |
| 122 | L | 98.7 | Very high | 95.3 | Very high | 1 Ų | 1 | 55.2 Ų | 55.2 | 1% | 0.005 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -69.8 | -35.3 | 176.2 | -70.9 | 167.9 | 0 | 0 | 0 | 112.5 | L98 R118 E119 G120 A126 L147 Y151 L159 R162 L166 | L98-L122 HydrophobicContact CD1-CD2 3.7Å; L98-L122 HydrophobicContact CD1-CG 4.18Å; L98-L122 HydrophobicContact CD2-CD1 4.43Å; L98-L122 HydrophobicContact CD2-CD2 4.12Å; L98-L122 HydrophobicContact CD2-CG 3.86Å; R118-L122 WeakPolarHBondContact O-CG 3.39Å; R118-L122 PolarHBondContact O-N 3.32Å; E119-L122 PolarHBondContact O-N 2.95Å; G120-L122 VanDerWaalsContact C-N 3.35Å; G120-L122 PolarHBondContact O-N 2.96Å; L122-A126 PolarHBondContact O-N 3.26Å; L122-L147 HydrophobicContact CD2-CD2 3.54Å; L122-Y151 HydrophobicContact CD1-CD1 4.12Å; L122-L159 HydrophobicContact CD1-CD2 3.83Å; L122-R162 HydrophobicContact CB-CB 3.78Å; L122-R162 HydrophobicContact CD1-CB 3.88Å; L122-R162 HydrophobicContact CG-CB 4.42Å; L122-L166 HydrophobicContact CD2-CD2 4.31Å |
| 123 | E | 98.4 | Very high | 95.4 | Very high | 80 Ų | 80 | 54 Ų | 54 | 37% | 0.374 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -65.6 | -50.6 | 174.8 | -74.6 | 173 | 170.3 | 0 | 0 | 111.3 | E119 G120 L125 A126 D127 R162 | E119-E123 WeakPolarHBondContact O-CG 3.45Å; E119-E123 PolarHBondContact O-N 2.68Å; G120-E123 PolarHBondContact O-N 3.38Å; E123-L125 VanDerWaalsContact C-N 3.26Å; E123-L125 PolarHBondContact O-N 3.3Å; E123-A126 WeakPolarHBondContact O-CA 3.23Å; E123-A126 WeakPolarHBondContact O-CB 3.42Å; E123-A126 PolarHBondContact O-N 3Å; E123-D127 PolarHBondContact O-N 3.3Å; E123-R162 VanDerWaalsContact CD-NE 3.33Å; E123-R162 HydrophobicContact CG-CG 4.49Å; E123-R162 IonicContact OE1-CZ 3.08Å; E123-R162 IonicContact OE1-NE 3.03Å; E123-R162 PolarHBondContact OE1-NE 3.03Å; E123-R162 IonicContact OE1-NH2 3.05Å; E123-R162 PolarHBondContact OE1-NH2 3.21Å |
| 124 | L | 98 | Very high | 95.6 | Very high | 67 Ų | 67 | 50 Ų | 50 | 35% | 0.351 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -59.2 | -39.7 | 177.7 | 179 | 57.4 | 0 | 0 | 0 | 111.6 | G120 A126 D127 L128 | G120-L124 WeakPolarHBondContact O-CB 3.11Å; G120-L124 PolarHBondContact O-N 3.25Å; L124-A126 VanDerWaalsContact C-N 3.32Å; L124-A126 PolarHBondContact O-N 3.06Å; L124-D127 PolarHBondContact O-N 2.75Å; L124-L128 HydrophobicContact CD1-CD1 4.18Å; L124-L128 HydrophobicContact CD1-CG 4.16Å; L124-L128 HydrophobicContact CG-CD1 4.02Å; L124-L128 HydrophobicContact CG-CG 4.46Å; L124-L128 WeakPolarHBondContact O-CB 3.48Å; L124-L128 VanDerWaalsContact O-CG 3.25Å; L124-L128 WeakPolarHBondContact O-CG 3.46Å; L124-L128 PolarHBondContact O-N 2.81Å |
| 125 | L | 98.5 | Very high | 95.8 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -63 | -37.6 | 173.6 | -76.7 | 169.5 | 0 | 0 | 0 | 112.5 | M91 C94 L98 A121 E123 C129 F138 L166 | M91-L125 HydrophobicContact CB-CD2 3.97Å; M91-L125 HydrophobicContact CG-CD2 3.85Å; C94-L125 HydrophobicContact CB-CD1 3.69Å; C94-L125 HydrophobicContact CB-CD2 3.84Å; C94-L125 HydrophobicContact CB-CG 3.55Å; L98-L125 HydrophobicContact CD1-CD1 3.5Å; L98-L125 VanDerWaalsContact CD1-CD1 3.5Å; A121-L125 WeakPolarHBondContact O-CB 3.42Å; A121-L125 WeakPolarHBondContact O-CD1 3.34Å; A121-L125 VanDerWaalsContact O-CG 3.22Å; A121-L125 WeakPolarHBondContact O-CG 3.37Å; A121-L125 PolarHBondContact O-N 3.46Å; E123-L125 VanDerWaalsContact C-N 3.26Å; E123-L125 PolarHBondContact O-N 3.3Å; L125-C129 WeakPolarHBondContact O-CB 3.49Å; L125-C129 PolarHBondContact O-N 3.19Å; L125-C129 PolarHBondContact O-SG 3.37Å; L125-F138 HydrophobicContact CD1-CE2 3.82Å; L125-F138 HydrophobicContact CD2-CD2 3.82Å; L125-F138 HydrophobicContact CD2-CE2 3.83Å; L125-F138 HydrophobicContact CG-CE2 4.34Å; L125-L166 HydrophobicContact CB-CD1 4.29Å; L125-L166 HydrophobicContact CB-CD2 3.63Å; L125-L166 HydrophobicContact CD1-CD2 4.16Å |
| 126 | A | 97.7 | Very high | 95.9 | Very high | 4 Ų | 4 | 46.9 Ų | 46.9 | 3% | 0.033 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.1 | -44.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | L122 E123 L124 C129 E130 L166 | L122-A126 PolarHBondContact O-N 3.26Å; E123-A126 WeakPolarHBondContact O-CA 3.23Å; E123-A126 WeakPolarHBondContact O-CB 3.42Å; E123-A126 PolarHBondContact O-N 3Å; L124-A126 VanDerWaalsContact C-N 3.32Å; L124-A126 PolarHBondContact O-N 3.06Å; A126-C129 PolarHBondContact O-N 2.98Å; A126-E130 WeakPolarHBondContact O-CG 3.44Å; A126-E130 PolarHBondContact O-N 3.05Å; A126-L166 HydrophobicContact CB-CD1 4.39Å |
| 127 | D | 96.6 | Very high | 95.9 | Very high | 101 Ų | 101 | 41.6 Ų | 41.6 | 54% | 0.54 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -64.4 | -46 | 177.9 | -61.9 | -18.2 | 0 | 0 | 0 | 111.1 | E123 L124 C129 E130 | E123-D127 PolarHBondContact O-N 3.3Å; L124-D127 PolarHBondContact O-N 2.75Å; D127-C129 VanDerWaalsContact C-N 3.33Å; D127-C129 PolarHBondContact O-N 3.12Å; D127-E130 WeakPolarHBondContact O-CB 3.16Å; D127-E130 PolarHBondContact O-N 3.42Å |
| 128 | L | 96.2 | Very high | 95.9 | Very high | 16 Ų | 16 | 36.6 Ų | 36.6 | 8% | 0.084 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.1 | -40.7 | 177.3 | -70.9 | 172.3 | 0 | 0 | 0 | 112.1 | E87 Q90 M91 L124 E130 N131 N134 | E87-L128 HydrophobicContact CB-CD2 4.04Å; E87-L128 HydrophobicContact CG-CD2 3.79Å; Q90-L128 HydrophobicContact CB-CD1 3.87Å; M91-L128 HydrophobicContact CG-CB 4.35Å; M91-L128 HydrophobicContact CG-CD1 3.75Å; L124-L128 HydrophobicContact CD1-CD1 4.18Å; L124-L128 HydrophobicContact CD1-CG 4.16Å; L124-L128 HydrophobicContact CG-CD1 4.02Å; L124-L128 HydrophobicContact CG-CG 4.46Å; L124-L128 WeakPolarHBondContact O-CB 3.48Å; L124-L128 VanDerWaalsContact O-CG 3.25Å; L124-L128 WeakPolarHBondContact O-CG 3.46Å; L124-L128 PolarHBondContact O-N 2.81Å; L128-E130 VanDerWaalsContact C-N 3.26Å; L128-E130 PolarHBondContact O-N 2.98Å; L128-N131 PolarHBondContact O-N 3.38Å; L128-N134 WeakPolarHBondContact O-CB 3.46Å; L128-N134 PolarHBondContact O-ND2 3.07Å |
| 129 | C | 96.8 | Very high | 95.8 | Very high | 2 Ų | 2 | 36.7 Ų | 36.7 | 1% | 0.014 | 20% | 0.2 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -79.5 | -0 | -177.9 | -68.5 | 0 | 0 | 0 | 0 | 114.4 | L125 A126 D127 N131 A135 L166 T169 C170 | L125-C129 WeakPolarHBondContact O-CB 3.49Å; L125-C129 PolarHBondContact O-N 3.19Å; L125-C129 PolarHBondContact O-SG 3.37Å; A126-C129 PolarHBondContact O-N 2.98Å; D127-C129 VanDerWaalsContact C-N 3.33Å; D127-C129 PolarHBondContact O-N 3.12Å; C129-N131 PolarHBondContact O-N 3.11Å; C129-A135 HydrophobicContact CB-CB 4.24Å; C129-L166 HydrophobicContact CB-CD1 3.85Å; C129-T169 HydrophobicContact CB-CG2 4.5Å; C129-C170 WeakPolarHBondContact CB-SG 3.3Å |
| 130 | E | 93.8 | Very high | 95.7 | Very high | 145 Ų | 145 | 42.3 Ų | 42.3 | 68% | 0.678 | 23% | 0.227 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -60.5 | -28.9 | 164.1 | -63.7 | -165.2 | 162.6 | 0 | 0 | 110.8 | A126 D127 L128 M132 T169 | A126-E130 WeakPolarHBondContact O-CG 3.44Å; A126-E130 PolarHBondContact O-N 3.05Å; D127-E130 WeakPolarHBondContact O-CB 3.16Å; D127-E130 PolarHBondContact O-N 3.42Å; L128-E130 VanDerWaalsContact C-N 3.26Å; L128-E130 PolarHBondContact O-N 2.98Å; E130-M132 PolarHBondContact O-N 2.91Å; E130-T169 HydrophobicContact CG-CG2 4.13Å |
| 131 | N | 91.6 | Very high | 95.5 | Very high | 71 Ų | 71 | 43.7 Ų | 43.7 | 38% | 0.38 | 23% | 0.226 | S | C | . | . | S | Bend | trans | -75.5 | 120.5 | 166.3 | -173.5 | -29 | 0 | 0 | 0 | 110.1 | L128 C129 D133 N134 A135 | L128-N131 PolarHBondContact O-N 3.38Å; C129-N131 PolarHBondContact O-N 3.11Å; N131-D133 PolarHBondContact O-N 3.36Å; N131-D133 VanDerWaalsContact O-N 3.09Å; N131-D133 WeakPolarHBondContact OD1-CB 3.48Å; N131-D133 PolarHBondContact OD1-N 3.34Å; N131-N134 HydrophobicContact CB-CB 4.18Å; N131-N134 PolarHBondContact O-N 3Å; N131-N134 VanDerWaalsContact O-N 3.12Å; N131-A135 PolarHBondContact O-N 3.21Å |
| 132 | M | 90.6 | Very high | 95.4 | Very high | 102 Ų | 102 | 46.3 Ų | 46.3 | 50% | 0.502 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -55 | -29.1 | 178.5 | -69.8 | -173.8 | -73.4 | 0 | 0 | 113.6 | E130 A136 V174 | E130-M132 PolarHBondContact O-N 2.91Å; M132-A136 PolarHBondContact O-N 3.27Å; M132-V174 HydrophobicContact CG-CG2 4.34Å; M132-V174 HydrophobicContact SD-CG2 4.37Å |
| 133 | D | 89.6 | Confident | 95.3 | Very high | 34 Ų | 34 | 46.2 Ų | 46.2 | 18% | 0.182 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -75.4 | -42.5 | -178 | -61.9 | -5.7 | 0 | 0 | 0 | 110.1 | R41 N131 A135 A136 D137 | R41-D133 IonicContact CZ-OD1 3.52Å; R41-D133 IonicContact CZ-OD2 2.77Å; R41-D133 VanDerWaalsContact NE-CG 3.32Å; R41-D133 IonicContact NE-OD1 3.19Å; R41-D133 IonicContact NE-OD2 3.85Å; R41-D133 PolarHBondContact NE-OD2 3.45Å; R41-D133 IonicContact NH1-OD1 2.52Å; R41-D133 PolarHBondContact NH1-OD1 3.09Å; R41-D133 IonicContact NH1-OD2 3.04Å; R41-D133 IonicContact NH2-OD1 3.55Å; R41-D133 PolarHBondContact NH2-OD1 3.06Å; R41-D133 IonicContact NH2-OD2 2.85Å; R41-D133 PolarHBondContact NH2-OD2 3.28Å; N131-D133 PolarHBondContact O-N 3.36Å; N131-D133 VanDerWaalsContact O-N 3.09Å; N131-D133 WeakPolarHBondContact OD1-CB 3.48Å; N131-D133 PolarHBondContact OD1-N 3.34Å; D133-A135 VanDerWaalsContact C-N 3.34Å; D133-A136 WeakPolarHBondContact O-CB 3.29Å; D133-A136 PolarHBondContact O-N 3.16Å; D133-D137 PolarHBondContact O-N 3.34Å |
| 134 | N | 94.6 | Very high | 95.2 | Very high | 2 Ų | 2 | 42.4 Ų | 42.4 | 1% | 0.011 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -65.2 | -38.5 | 172.1 | -68.8 | -18.2 | 0 | 0 | 0 | 111.5 | E87 M91 L128 N131 A136 D137 F138 | E87-N134 PolarHBondContact OE2-ND2 3Å; E87-N134 PolarHBondContact OE2-OD1 3.14Å; M91-N134 HydrophobicContact CE-CB 3.95Å; M91-N134 HydrophobicContact SD-CB 3.99Å; L128-N134 WeakPolarHBondContact O-CB 3.46Å; L128-N134 PolarHBondContact O-ND2 3.07Å; N131-N134 HydrophobicContact CB-CB 4.18Å; N131-N134 PolarHBondContact O-N 3Å; N131-N134 VanDerWaalsContact O-N 3.12Å; N134-A136 VanDerWaalsContact C-N 3.3Å; N134-A136 PolarHBondContact O-N 3.49Å; N134-D137 PolarHBondContact O-N 3.18Å; N134-F138 WeakPolarHBondContact O-CB 3.02Å; N134-F138 PolarHBondContact O-N 3.05Å |
| 135 | A | 95.6 | Very high | 95.2 | Very high | 1 Ų | 1 | 43.8 Ų | 43.8 | 1% | 0.008 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.7 | -40.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | C129 N131 D133 C139 C170 I177 | C129-A135 HydrophobicContact CB-CB 4.24Å; N131-A135 PolarHBondContact O-N 3.21Å; D133-A135 VanDerWaalsContact C-N 3.34Å; A135-C139 PolarHBondContact O-N 3.27Å; A135-C139 PolarHBondContact O-SG 2.75Å; A135-C170 HydrophobicContact CB-CB 3.98Å; A135-I177 HydrophobicContact CB-CD1 3.87Å |
| 136 | A | 94.2 | Very high | 95.2 | Very high | 32 Ų | 32 | 45.1 Ų | 45.1 | 26% | 0.264 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -66.9 | -45.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | M132 D133 N134 F138 C139 Q140 | M132-A136 PolarHBondContact O-N 3.27Å; D133-A136 WeakPolarHBondContact O-CB 3.29Å; D133-A136 PolarHBondContact O-N 3.16Å; N134-A136 VanDerWaalsContact C-N 3.3Å; N134-A136 PolarHBondContact O-N 3.49Å; A136-F138 VanDerWaalsContact C-N 3.34Å; A136-F138 PolarHBondContact O-N 3.26Å; A136-C139 WeakPolarHBondContact O-CB 3.45Å; A136-C139 PolarHBondContact O-N 3.22Å; A136-Q140 WeakPolarHBondContact O-CG 3.4Å; A136-Q140 PolarHBondContact O-N 3.22Å |
| 137 | D | 94.6 | Very high | 95.2 | Very high | 32 Ų | 32 | 45 Ų | 45 | 17% | 0.171 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62.9 | -40.4 | 176.6 | -73.5 | -17.2 | 0 | 0 | 0 | 111.1 | V88 M91 D133 N134 C139 Q140 L141 | V88-D137 HydrophobicContact CG2-CB 4.45Å; V88-D137 WeakPolarHBondContact CG2-OD2 3.35Å; M91-D137 HydrophobicContact CE-CB 3.83Å; D133-D137 PolarHBondContact O-N 3.34Å; N134-D137 PolarHBondContact O-N 3.18Å; D137-C139 VanDerWaalsContact C-N 3.32Å; D137-C139 PolarHBondContact O-N 3.02Å; D137-Q140 WeakPolarHBondContact O-CB 2.94Å; D137-Q140 PolarHBondContact O-N 2.97Å; D137-Q140 VanDerWaalsContact O-N 3.13Å; D137-L141 WeakPolarHBondContact O-CB 3.39Å; D137-L141 VanDerWaalsContact O-CG 3.27Å; D137-L141 WeakPolarHBondContact O-CG 3.39Å; D137-L141 PolarHBondContact O-N 2.91Å |
| 138 | F | 97.3 | Very high | 95.3 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -59.2 | -41.7 | 173.8 | 177.2 | -102.2 | 0 | 0 | 0 | 112.2 | M91 L95 L125 N134 A136 L141 S142 G143 M144 L147 L166 | M91-F138 HydrophobicContact SD-CB 3.95Å; L95-F138 HydrophobicContact CD1-CD2 4.39Å; L95-F138 HydrophobicContact CD1-CE2 4.47Å; L95-F138 HydrophobicContact CD2-CD2 4.37Å; L95-F138 HydrophobicContact CD2-CE2 3.66Å; L95-F138 HydrophobicContact CD2-CZ 4.39Å; L95-F138 HydrophobicContact CG-CE2 4.24Å; L125-F138 HydrophobicContact CD1-CE2 3.82Å; L125-F138 HydrophobicContact CD2-CD2 3.82Å; L125-F138 HydrophobicContact CD2-CE2 3.83Å; L125-F138 HydrophobicContact CG-CE2 4.34Å; N134-F138 WeakPolarHBondContact O-CB 3.02Å; N134-F138 PolarHBondContact O-N 3.05Å; A136-F138 VanDerWaalsContact C-N 3.34Å; A136-F138 PolarHBondContact O-N 3.26Å; F138-L141 PolarHBondContact O-N 3.35Å; F138-S142 PolarHBondContact O-N 2.93Å; F138-G143 VanDerWaalsContact CZ-C 3.44Å; F138-G143 VanDerWaalsContact CZ-CA 3.4Å; F138-G143 PolarHBondContact O-N 2.85Å; F138-M144 HydrophobicContact CD1-CE 3.8Å; F138-M144 HydrophobicContact CD1-CG 4.47Å; F138-M144 HydrophobicContact CE1-CE 3.69Å; F138-M144 HydrophobicContact CE1-CG 4.25Å; F138-M144 HydrophobicContact CE1-SD 4.06Å; F138-L147 HydrophobicContact CE1-CD1 3.75Å; F138-L147 HydrophobicContact CE1-CG 4.4Å; F138-L147 HydrophobicContact CZ-CD1 3.76Å; F138-L147 HydrophobicContact CZ-CG 4.04Å; F138-L166 HydrophobicContact CE1-CD2 4.32Å; F138-L166 HydrophobicContact CE1-CG 4.43Å; F138-L166 HydrophobicContact CE2-CD2 4.38Å; F138-L166 HydrophobicContact CZ-CD2 3.84Å; F138-L166 HydrophobicContact CZ-CG 4.44Å |
| 139 | C | 95.1 | Very high | 95.3 | Very high | 6 Ų | 6 | 42.2 Ų | 42.2 | 4% | 0.041 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.6 | -41.1 | 173.3 | -75.3 | 0 | 0 | 0 | 0 | 112.4 | A135 A136 D137 L141 S142 M144 | A135-C139 PolarHBondContact O-N 3.27Å; A135-C139 PolarHBondContact O-SG 2.75Å; A136-C139 WeakPolarHBondContact O-CB 3.45Å; A136-C139 PolarHBondContact O-N 3.22Å; D137-C139 VanDerWaalsContact C-N 3.32Å; D137-C139 PolarHBondContact O-N 3.02Å; C139-L141 VanDerWaalsContact C-N 3.33Å; C139-S142 PolarHBondContact O-N 3.41Å; C139-S142 VanDerWaalsContact O-N 3.09Å; C139-M144 WeakPolarHBondContact SG-CG 3.25Å |
| 140 | Q | 94.8 | Very high | 95.2 | Very high | 151 Ų | 151 | 45.6 Ų | 45.6 | 71% | 0.706 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -65 | -36.2 | 175 | -69 | -179.9 | 6.4 | 0 | 0 | 112.3 | A136 D137 S142 | A136-Q140 WeakPolarHBondContact O-CG 3.4Å; A136-Q140 PolarHBondContact O-N 3.22Å; D137-Q140 WeakPolarHBondContact O-CB 2.94Å; D137-Q140 PolarHBondContact O-N 2.97Å; D137-Q140 VanDerWaalsContact O-N 3.13Å; Q140-S142 PolarHBondContact O-N 3.19Å |
| 141 | L | 95.6 | Very high | 95.4 | Very high | 61 Ų | 61 | 38.9 Ų | 38.9 | 32% | 0.319 | 21% | 0.214 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.6 | 10.9 | 173.1 | -65.3 | 171.4 | 0 | 0 | 0 | 113.1 | M91 K92 L95 D137 F138 C139 G143 | M91-L141 HydrophobicContact CB-CD1 4.32Å; K92-L141 HydrophobicContact CG-CD1 3.98Å; K92-L141 HydrophobicContact CG-CD2 4.15Å; L95-L141 HydrophobicContact CD1-CB 3.5Å; L95-L141 HydrophobicContact CD1-CD1 4.03Å; L95-L141 HydrophobicContact CD1-CG 4.37Å; D137-L141 WeakPolarHBondContact O-CB 3.39Å; D137-L141 VanDerWaalsContact O-CG 3.27Å; D137-L141 WeakPolarHBondContact O-CG 3.39Å; D137-L141 PolarHBondContact O-N 2.91Å; F138-L141 PolarHBondContact O-N 3.35Å; C139-L141 VanDerWaalsContact C-N 3.33Å; L141-G143 PolarHBondContact O-N 3.37Å; L141-G143 VanDerWaalsContact O-N 3.15Å |
| 142 | S | 94.9 | Very high | 95.7 | Very high | 64 Ų | 64 | 35.5 Ų | 35.5 | 45% | 0.448 | 20% | 0.196 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 58.7 | 21.7 | -178.2 | -60.2 | 0 | 0 | 0 | 0 | 114.1 | F138 C139 Q140 M144 H145 L146 | F138-S142 PolarHBondContact O-N 2.93Å; C139-S142 PolarHBondContact O-N 3.41Å; C139-S142 VanDerWaalsContact O-N 3.09Å; Q140-S142 PolarHBondContact O-N 3.19Å; S142-M144 VanDerWaalsContact C-N 3.26Å; S142-M144 PolarHBondContact O-N 2.93Å; S142-H145 WeakPolarHBondContact O-CB 3.28Å; S142-H145 PolarHBondContact O-N 3.2Å; S142-H145 VanDerWaalsContact O-N 3.07Å; S142-L146 PolarHBondContact O-N 3.48Å |
| 143 | G | 97.1 | Very high | 96 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -59.1 | -37.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | F138 L141 H145 L146 L147 | F138-G143 VanDerWaalsContact CZ-C 3.44Å; F138-G143 VanDerWaalsContact CZ-CA 3.4Å; F138-G143 PolarHBondContact O-N 2.85Å; L141-G143 PolarHBondContact O-N 3.37Å; L141-G143 VanDerWaalsContact O-N 3.15Å; G143-H145 VanDerWaalsContact C-N 3.32Å; G143-H145 PolarHBondContact O-N 3.4Å; G143-L146 WeakPolarHBondContact O-CB 3.49Å; G143-L146 PolarHBondContact O-N 3.08Å; G143-L146 VanDerWaalsContact O-N 3.11Å; G143-L147 WeakPolarHBondContact O-CG 3.49Å; G143-L147 PolarHBondContact O-N 2.91Å |
| 144 | M | 97.2 | Very high | 96.2 | Very high | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61.3 | -36.3 | 175.5 | -72.3 | -59 | 165.9 | 0 | 0 | 113.9 | F138 C139 S142 L146 L147 V148 I167 C170 I177 V181 L184 | F138-M144 HydrophobicContact CD1-CE 3.8Å; F138-M144 HydrophobicContact CD1-CG 4.47Å; F138-M144 HydrophobicContact CE1-CE 3.69Å; F138-M144 HydrophobicContact CE1-CG 4.25Å; F138-M144 HydrophobicContact CE1-SD 4.06Å; C139-M144 WeakPolarHBondContact SG-CG 3.25Å; S142-M144 VanDerWaalsContact C-N 3.26Å; S142-M144 PolarHBondContact O-N 2.93Å; M144-L146 VanDerWaalsContact C-N 3.27Å; M144-L146 PolarHBondContact O-N 2.96Å; M144-L147 PolarHBondContact O-N 3.37Å; M144-L147 HydrophobicContact SD-CD1 4.08Å; M144-V148 WeakPolarHBondContact O-CB 3.4Å; M144-V148 WeakPolarHBondContact O-CG2 3.42Å; M144-V148 PolarHBondContact O-N 3.25Å; M144-I167 HydrophobicContact SD-CG1 4.11Å; M144-C170 HydrophobicContact CE-CB 3.12Å; M144-C170 WeakPolarHBondContact CE-SG 3.34Å; M144-I177 HydrophobicContact CE-CG2 4.38Å; M144-V181 HydrophobicContact CB-CG2 4.42Å; M144-V181 HydrophobicContact CE-CG2 4.42Å; M144-V181 HydrophobicContact CG-CG2 3.9Å; M144-V181 HydrophobicContact SD-CG2 3.68Å; M144-L184 HydrophobicContact CB-CD1 3.8Å |
| 145 | H | 97.4 | Very high | 96 | Very high | 95 Ų | 95 | 37.8 Ų | 37.8 | 44% | 0.44 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -62.7 | -39.9 | 176.1 | -66.8 | 84.5 | 0 | 0 | 0 | 110.8 | S142 G143 G149 L184 | S142-H145 WeakPolarHBondContact O-CB 3.28Å; S142-H145 PolarHBondContact O-N 3.2Å; S142-H145 VanDerWaalsContact O-N 3.07Å; G143-H145 VanDerWaalsContact C-N 3.32Å; G143-H145 PolarHBondContact O-N 3.4Å; H145-G149 WeakPolarHBondContact O-CA 3.45Å; H145-G149 PolarHBondContact O-N 2.94Å; H145-L184 WeakPolarHBondContact CD2-CD2 3.3Å; H145-L184 WeakPolarHBondContact NE2-CD2 3.36Å |
| 146 | L | 97 | Very high | 95.9 | Very high | 29 Ų | 29 | 38.8 Ų | 38.8 | 15% | 0.152 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -67 | -44.1 | 178.1 | -172.8 | 61.7 | 0 | 0 | 0 | 111.4 | L95 L98 S142 G143 M144 R150 Y151 | L95-L146 HydrophobicContact CD2-CD2 4.05Å; L98-L146 HydrophobicContact CB-CD2 3.52Å; S142-L146 PolarHBondContact O-N 3.48Å; G143-L146 WeakPolarHBondContact O-CB 3.49Å; G143-L146 PolarHBondContact O-N 3.08Å; G143-L146 VanDerWaalsContact O-N 3.11Å; M144-L146 VanDerWaalsContact C-N 3.27Å; M144-L146 PolarHBondContact O-N 2.96Å; L146-R150 HydrophobicContact CD1-CB 4.28Å; L146-R150 WeakPolarHBondContact O-CB 3.46Å; L146-R150 PolarHBondContact O-N 3.47Å; L146-Y151 HydrophobicContact CD1-CD2 4.41Å; L146-Y151 HydrophobicContact CD1-CE2 3.98Å; L146-Y151 HydrophobicContact CD2-CE2 4.14Å; L146-Y151 HydrophobicContact CG-CD2 3.97Å; L146-Y151 HydrophobicContact CG-CE2 3.75Å; L146-Y151 PolarHBondContact O-N 3.2Å |
| 147 | L | 98.4 | Very high | 96.1 | Very high | 1 Ų | 1 | 38.7 Ų | 38.7 | 1% | 0.005 | 24% | 0.236 | C | C | . | . | I | π-helix | trans | -62.8 | -51.3 | 178.3 | -61.3 | -177.7 | 0 | 0 | 0 | 112.1 | L122 F138 G143 M144 Y151 L152 A163 L166 I167 | L122-L147 HydrophobicContact CD2-CD2 3.54Å; F138-L147 HydrophobicContact CE1-CD1 3.75Å; F138-L147 HydrophobicContact CE1-CG 4.4Å; F138-L147 HydrophobicContact CZ-CD1 3.76Å; F138-L147 HydrophobicContact CZ-CG 4.04Å; G143-L147 WeakPolarHBondContact O-CG 3.49Å; G143-L147 PolarHBondContact O-N 2.91Å; M144-L147 PolarHBondContact O-N 3.37Å; M144-L147 HydrophobicContact SD-CD1 4.08Å; L147-Y151 PolarHBondContact O-N 3Å; L147-L152 PolarHBondContact O-N 2.95Å; L147-A163 HydrophobicContact CD2-CB 4.22Å; L147-L166 HydrophobicContact CD1-CB 4.02Å; L147-L166 HydrophobicContact CD1-CD2 3.54Å; L147-L166 HydrophobicContact CD1-CG 3.54Å; L147-L166 HydrophobicContact CD2-CD2 3.98Å; L147-L166 HydrophobicContact CG-CD2 4.33Å; L147-I167 HydrophobicContact CB-CD1 4.07Å; L147-I167 HydrophobicContact CB-CG1 4.1Å; L147-I167 HydrophobicContact CD1-CG1 3.86Å |
| 148 | V | 98.4 | Very high | 96.3 | Very high | 4 Ų | 4 | 37.8 Ų | 37.8 | 2% | 0.024 | 23% | 0.234 | C | C | . | . | I | π-helix | trans | -72.1 | -39.4 | -175.9 | 179.1 | 0 | 0 | 0 | 0 | 111.7 | M144 L152 I167 L184 A186 K189 | M144-V148 WeakPolarHBondContact O-CB 3.4Å; M144-V148 WeakPolarHBondContact O-CG2 3.42Å; M144-V148 PolarHBondContact O-N 3.25Å; V148-L152 HydrophobicContact CG2-CD1 4.48Å; V148-I167 HydrophobicContact CG2-CD1 3.88Å; V148-L184 HydrophobicContact CB-CB 4.24Å; V148-L184 HydrophobicContact CB-CD1 4.49Å; V148-L184 HydrophobicContact CG1-CB 3.95Å; V148-L184 WeakPolarHBondContact CG1-O 3.27Å; V148-L184 HydrophobicContact CG2-CB 4.26Å; V148-L184 HydrophobicContact CG2-CD1 4.23Å; V148-A186 HydrophobicContact CG1-CB 4.01Å; V148-A186 HydrophobicContact CG2-CB 3.69Å; V148-K189 HydrophobicContact CG1-CD 4.09Å; V148-K189 VanDerWaalsContact O-CD 3.26Å; V148-K189 WeakPolarHBondContact O-CD 3.43Å; V148-K189 VanDerWaalsContact O-CE 3.29Å; V148-K189 WeakPolarHBondContact O-CE 3.45Å |
| 149 | G | 95.8 | Very high | 96.3 | Very high | 54 Ų | 54 | 38.5 Ų | 38.5 | 56% | 0.557 | 24% | 0.238 | S | C | * | . | I | π-helix | trans | -79.7 | -28.9 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | H145 | H145-G149 WeakPolarHBondContact O-CA 3.45Å; H145-G149 PolarHBondContact O-N 2.94Å |
| 150 | R | 95.7 | Very high | 96.5 | Very high | 74 Ų | 74 | 39.6 Ų | 39.6 | 28% | 0.279 | 24% | 0.241 | S | C | . | . | I | π-helix | trans | -123.7 | -50.2 | -174 | -173.4 | 177.6 | -179.8 | 178 | -1.6 | 113.4 | L98 S99 Q100 T102 R118 L146 A154 | L98-R150 PolarHBondContact O-NH1 3.29Å; L98-R150 VanDerWaalsContact O-NH1 3.11Å; S99-R150 PolarHBondContact O-NH1 2.94Å; Q100-R150 PolarHBondContact O-NH1 3.48Å; Q100-R150 PolarHBondContact O-NH2 3.41Å; T102-R150 PolarHBondContact OG1-NH2 3.47Å; R118-R150 VanDerWaalsContact NH1-NH2 3.12Å; L146-R150 HydrophobicContact CD1-CB 4.28Å; L146-R150 WeakPolarHBondContact O-CB 3.46Å; L146-R150 PolarHBondContact O-N 3.47Å; R150-A154 PolarHBondContact O-N 3.16Å |
| 151 | Y | 97.9 | Very high | 96.7 | Very high | 3 Ų | 3 | 34.8 Ų | 34.8 | 1% | 0.012 | 22% | 0.216 | C | C | . | . | I | π-helix | trans | -86.6 | -26.2 | -165 | -72.9 | -84.5 | 0 | 0 | 0 | 114.9 | L98 L122 L146 L147 E153 A154 L159 R160 | L98-Y151 WeakPolarHBondContact CA-OH 3.3Å; L98-Y151 HydrophobicContact CB-CE2 3.85Å; L98-Y151 HydrophobicContact CD2-CE1 3.88Å; L98-Y151 HydrophobicContact CD2-CE2 4.06Å; L98-Y151 WeakPolarHBondContact CD2-OH 3.38Å; L98-Y151 HydrophobicContact CG-CE2 4.44Å; L98-Y151 WeakPolarHBondContact O-CE2 3.22Å; L98-Y151 PolarHBondContact O-OH 2.87Å; L122-Y151 HydrophobicContact CD1-CD1 4.12Å; L146-Y151 HydrophobicContact CD1-CD2 4.41Å; L146-Y151 HydrophobicContact CD1-CE2 3.98Å; L146-Y151 HydrophobicContact CD2-CE2 4.14Å; L146-Y151 HydrophobicContact CG-CD2 3.97Å; L146-Y151 HydrophobicContact CG-CE2 3.75Å; L146-Y151 PolarHBondContact O-N 3.2Å; L147-Y151 PolarHBondContact O-N 3Å; Y151-E153 PolarHBondContact O-N 3.46Å; Y151-A154 WeakPolarHBondContact O-CB 3.35Å; Y151-A154 PolarHBondContact O-N 3.45Å; Y151-L159 HydrophobicContact CD1-CB 4.16Å; Y151-L159 HydrophobicContact CD1-CD1 4.36Å; Y151-L159 HydrophobicContact CD1-CD2 4.34Å; Y151-L159 HydrophobicContact CE1-CD1 4.21Å; Y151-L159 HydrophobicContact CE1-CD2 4.21Å; Y151-R160 WeakPolarHBondContact O-CA 3.26Å |
| 152 | L | 98.4 | Very high | 96.8 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 21% | 0.206 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.4 | -22.9 | 169.5 | -74.2 | -172.6 | 0 | 0 | 0 | 113.1 | L147 V148 R160 A163 A164 I167 K189 L190 L193 | L147-L152 PolarHBondContact O-N 2.95Å; V148-L152 HydrophobicContact CG2-CD1 4.48Å; L152-R160 WeakPolarHBondContact O-CD 3.29Å; L152-A163 HydrophobicContact CD2-CB 4.19Å; L152-A164 HydrophobicContact CD2-CB 4.11Å; L152-I167 HydrophobicContact CD1-CD1 3.72Å; L152-I167 HydrophobicContact CD2-CD1 3.91Å; L152-I167 HydrophobicContact CG-CD1 3.87Å; L152-K189 HydrophobicContact CB-CD 4.45Å; L152-K189 HydrophobicContact CD1-CB 3.93Å; L152-K189 HydrophobicContact CD1-CD 4.33Å; L152-L190 HydrophobicContact CD1-CD2 4.06Å; L152-L190 HydrophobicContact CD1-CG 4.16Å; L152-L190 HydrophobicContact CD2-CD2 3.81Å; L152-L193 HydrophobicContact CB-CD1 4.39Å; L152-L193 HydrophobicContact CD2-CD1 3.93Å |
| 153 | E | 95.7 | Very high | 97 | Very high | 92 Ų | 92 | 30.1 Ų | 30.1 | 43% | 0.43 | 19% | 0.185 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -113.2 | 16 | 179.5 | -69.3 | 172.7 | 153.9 | 0 | 0 | 112.1 | Y151 K189 R192 | Y151-E153 PolarHBondContact O-N 3.46Å; E153-K189 IonicContact OE1-NZ 3.11Å; E153-K189 PolarHBondContact OE1-NZ 3.14Å; E153-K189 IonicContact OE2-NZ 2.95Å; E153-K189 PolarHBondContact OE2-NZ 3.37Å; E153-R192 IonicContact OE1-NH1 2.93Å; E153-R192 PolarHBondContact OE1-NH1 3.03Å |
| 154 | A | 94 | Very high | 97.1 | Very high | 16 Ų | 16 | 30.1 Ų | 30.1 | 13% | 0.132 | 19% | 0.185 | C | C | . | . | trans | -62.3 | 147.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | R150 Y151 A156 L159 R160 | R150-A154 PolarHBondContact O-N 3.16Å; Y151-A154 WeakPolarHBondContact O-CB 3.35Å; Y151-A154 PolarHBondContact O-N 3.45Å; A154-A156 PolarHBondContact O-N 3.19Å; A154-L159 HydrophobicContact CB-CB 3.74Å; A154-L159 HydrophobicContact CB-CD1 4.06Å; A154-R160 HydrophobicContact CB-CG 4.21Å; A154-R160 WeakPolarHBondContact O-CD 3.43Å; A154-R160 WeakPolarHBondContact O-CG 3.38Å; A154-R160 PolarHBondContact O-NH1 2.65Å | ||
| 155 | G | 90.7 | Very high | 97.1 | Very high | 79 Ų | 79 | 32.2 Ų | 32.2 | 81% | 0.814 | 20% | 0.195 | S | C | * | . | S | Bend | trans | -64.7 | -37.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | R160 | G155-R160 VanDerWaalsContact C-NH1 3.27Å; G155-R160 PolarHBondContact O-NH1 3.21Å |
| 156 | A | 94.6 | Very high | 97.2 | Very high | 21 Ų | 21 | 27.7 Ų | 27.7 | 17% | 0.174 | 17% | 0.174 | C | C | . | . | S | Bend | trans | -79.8 | 128.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q115 A154 G158 L159 R160 | Q115-A156 HydrophobicContact CG-CB 4.29Å; A154-A156 PolarHBondContact O-N 3.19Å; A156-G158 PolarHBondContact O-N 2.93Å; A156-L159 HydrophobicContact CB-CB 4.47Å; A156-L159 HydrophobicContact CB-CD1 4.14Å; A156-L159 HydrophobicContact CB-CG 4.14Å; A156-L159 PolarHBondContact O-N 3.08Å; A156-L159 VanDerWaalsContact O-N 3.17Å; A156-R160 PolarHBondContact O-N 3.15Å |
| 157 | A | 98 | Very high | 97.3 | Very high | 30 Ų | 30 | 26.3 Ų | 26.3 | 25% | 0.248 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -58.7 | -36.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | L159 R160 W161 C199 V202 | A157-L159 PolarHBondContact O-N 3.27Å; A157-R160 PolarHBondContact O-N 3.13Å; A157-R160 VanDerWaalsContact O-N 3.13Å; A157-W161 PolarHBondContact O-N 2.78Å; A157-C199 HydrophobicContact CB-CB 3.8Å; A157-V202 HydrophobicContact CB-CG2 3.94Å; A157-V202 WeakPolarHBondContact O-CG2 3.39Å |
| 158 | G | 97.8 | Very high | 97.3 | Very high | 13 Ų | 13 | 26.2 Ų | 26.2 | 13% | 0.134 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -53.5 | -37.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | E119 A156 W161 R162 | E119-G158 WeakPolarHBondContact OE1-CA 3.01Å; A156-G158 PolarHBondContact O-N 2.93Å; G158-W161 PolarHBondContact O-NE1 3.06Å; G158-R162 WeakPolarHBondContact O-CD 3.33Å; G158-R162 WeakPolarHBondContact O-CG 3.41Å; G158-R162 PolarHBondContact O-NH1 3.3Å |
| 159 | L | 98.2 | Very high | 97.2 | Very high | 15 Ų | 15 | 27.4 Ų | 27.4 | 8% | 0.079 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -78.3 | -42.2 | 177 | -66.4 | 178.5 | 0 | 0 | 0 | 111.8 | Q115 R118 E119 L122 Y151 A154 A156 A157 R162 A163 | Q115-L159 HydrophobicContact CG-CG 4.47Å; R118-L159 HydrophobicContact CB-CD2 3.74Å; E119-L159 HydrophobicContact CG-CD2 3.72Å; E119-L159 HydrophobicContact CG-CG 4.39Å; L122-L159 HydrophobicContact CD1-CD2 3.83Å; Y151-L159 HydrophobicContact CD1-CB 4.16Å; Y151-L159 HydrophobicContact CD1-CD1 4.36Å; Y151-L159 HydrophobicContact CD1-CD2 4.34Å; Y151-L159 HydrophobicContact CE1-CD1 4.21Å; Y151-L159 HydrophobicContact CE1-CD2 4.21Å; A154-L159 HydrophobicContact CB-CB 3.74Å; A154-L159 HydrophobicContact CB-CD1 4.06Å; A156-L159 HydrophobicContact CB-CB 4.47Å; A156-L159 HydrophobicContact CB-CD1 4.14Å; A156-L159 HydrophobicContact CB-CG 4.14Å; A156-L159 PolarHBondContact O-N 3.08Å; A156-L159 VanDerWaalsContact O-N 3.17Å; A157-L159 PolarHBondContact O-N 3.27Å; L159-R162 PolarHBondContact O-N 3.41Å; L159-A163 WeakPolarHBondContact O-CB 3.47Å; L159-A163 PolarHBondContact O-N 3.25Å |
| 160 | R | 98.5 | Very high | 97.3 | Very high | 29 Ų | 29 | 24.9 Ų | 24.9 | 11% | 0.109 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -62.5 | -47.1 | -178.2 | -66.3 | -164.8 | -60.9 | -82.9 | 3.9 | 112.6 | Y151 L152 A154 G155 A156 A157 A163 A164 D197 V202 | Y151-R160 WeakPolarHBondContact O-CA 3.26Å; L152-R160 WeakPolarHBondContact O-CD 3.29Å; A154-R160 HydrophobicContact CB-CG 4.21Å; A154-R160 WeakPolarHBondContact O-CD 3.43Å; A154-R160 WeakPolarHBondContact O-CG 3.38Å; A154-R160 PolarHBondContact O-NH1 2.65Å; G155-R160 VanDerWaalsContact C-NH1 3.27Å; G155-R160 PolarHBondContact O-NH1 3.21Å; A156-R160 PolarHBondContact O-N 3.15Å; A157-R160 PolarHBondContact O-N 3.13Å; A157-R160 VanDerWaalsContact O-N 3.13Å; R160-A163 PolarHBondContact O-N 3.45Å; R160-A164 PolarHBondContact O-N 3.4Å; R160-D197 IonicContact CZ-OD1 3.03Å; R160-D197 IonicContact CZ-OD2 3.8Å; R160-D197 IonicContact NE-OD2 3.79Å; R160-D197 PolarHBondContact NE-OD2 3.1Å; R160-D197 IonicContact NH2-OD1 3.21Å; R160-D197 PolarHBondContact NH2-OD1 3.44Å; R160-D197 IonicContact NH2-OD2 2.78Å; R160-D197 PolarHBondContact NH2-OD2 3.28Å; R160-V202 HydrophobicContact CB-CG1 3.96Å; R160-V202 HydrophobicContact CB-CG2 4.06Å |
| 161 | W | 98.7 | Very high | 97.3 | Very high | 50 Ų | 50 | 21.3 Ų | 21.3 | 19% | 0.189 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -69.8 | -34.9 | -177.1 | 74.5 | -107.9 | 0 | 0 | 0 | 112 | A157 G158 A164 Q165 T201 V202 K205 | A157-W161 PolarHBondContact O-N 2.78Å; G158-W161 PolarHBondContact O-NE1 3.06Å; W161-A164 PolarHBondContact O-N 3.32Å; W161-Q165 VanDerWaalsContact CZ3-OE1 3.25Å; W161-Q165 WeakPolarHBondContact O-CB 3.49Å; W161-Q165 PolarHBondContact O-N 3.45Å; W161-T201 HydrophobicContact CB-CG2 4.05Å; W161-T201 HydrophobicContact CD2-CG2 3.95Å; W161-T201 HydrophobicContact CG-CG2 3.74Å; W161-V202 HydrophobicContact CB-CB 4.28Å; W161-V202 HydrophobicContact CB-CG2 3.83Å; W161-K205 HydrophobicContact CB-CB 4.19Å; W161-K205 HydrophobicContact CB-CG 4.11Å; W161-K205 HydrophobicContact CE3-CG 4.11Å; W161-K205 WeakPolarHBondContact O-CB 3.27Å |
| 162 | R | 98.6 | Very high | 97 | Very high | 27 Ų | 27 | 26.2 Ų | 26.2 | 10% | 0.102 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -67.8 | -40.2 | 175.5 | -74.2 | 179.5 | 179.9 | 96.6 | -13.8 | 111.8 | E119 L122 E123 G158 L159 Q165 L166 | E119-R162 WeakPolarHBondContact O-CD 3.48Å; E119-R162 IonicContact OE1-NH1 3.06Å; E119-R162 IonicContact OE2-CZ 3.65Å; E119-R162 VanDerWaalsContact OE2-CZ 3.25Å; E119-R162 IonicContact OE2-NH1 3.36Å; E119-R162 PolarHBondContact OE2-NH1 2.94Å; E119-R162 IonicContact OE2-NH2 3.96Å; E119-R162 PolarHBondContact OE2-NH2 3.5Å; L122-R162 HydrophobicContact CB-CB 3.78Å; L122-R162 HydrophobicContact CD1-CB 3.88Å; L122-R162 HydrophobicContact CG-CB 4.42Å; E123-R162 VanDerWaalsContact CD-NE 3.33Å; E123-R162 HydrophobicContact CG-CG 4.49Å; E123-R162 IonicContact OE1-CZ 3.08Å; E123-R162 IonicContact OE1-NE 3.03Å; E123-R162 PolarHBondContact OE1-NE 3.03Å; E123-R162 IonicContact OE1-NH2 3.05Å; E123-R162 PolarHBondContact OE1-NH2 3.21Å; G158-R162 WeakPolarHBondContact O-CD 3.33Å; G158-R162 WeakPolarHBondContact O-CG 3.41Å; G158-R162 PolarHBondContact O-NH1 3.3Å; L159-R162 PolarHBondContact O-N 3.41Å; R162-Q165 WeakPolarHBondContact O-CB 3.42Å; R162-Q165 PolarHBondContact O-N 2.97Å; R162-L166 WeakPolarHBondContact O-CB 3.44Å; R162-L166 PolarHBondContact O-N 3.39Å |
| 163 | A | 98.8 | Very high | 96.5 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -62.5 | -44.4 | 173 | 0 | 0 | 0 | 0 | 0 | 112.1 | L147 L152 L159 R160 L166 I167 | L147-A163 HydrophobicContact CD2-CB 4.22Å; L152-A163 HydrophobicContact CD2-CB 4.19Å; L159-A163 WeakPolarHBondContact O-CB 3.47Å; L159-A163 PolarHBondContact O-N 3.25Å; R160-A163 PolarHBondContact O-N 3.45Å; A163-L166 PolarHBondContact O-N 2.92Å; A163-I167 VanDerWaalsContact O-CG1 3.32Å; A163-I167 WeakPolarHBondContact O-CG1 3.19Å; A163-I167 PolarHBondContact O-N 2.95Å |
| 164 | A | 98.9 | Very high | 96.4 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.5 | -42.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L152 R160 W161 I167 G168 L190 K205 A209 | L152-A164 HydrophobicContact CD2-CB 4.11Å; R160-A164 PolarHBondContact O-N 3.4Å; W161-A164 PolarHBondContact O-N 3.32Å; A164-I167 PolarHBondContact O-N 2.89Å; A164-G168 PolarHBondContact O-N 3.11Å; A164-L190 HydrophobicContact CB-CD2 4.04Å; A164-K205 HydrophobicContact CB-CB 4.04Å; A164-A209 WeakPolarHBondContact O-CB 3.44Å |
| 165 | Q | 98.7 | Very high | 96.4 | Very high | 44 Ų | 44 | 29.8 Ų | 29.8 | 21% | 0.206 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -56.7 | -53.3 | 174.3 | 174.1 | 166.6 | -29.2 | 0 | 0 | 111.5 | W161 R162 I167 G168 T169 K205 | W161-Q165 VanDerWaalsContact CZ3-OE1 3.25Å; W161-Q165 WeakPolarHBondContact O-CB 3.49Å; W161-Q165 PolarHBondContact O-N 3.45Å; R162-Q165 WeakPolarHBondContact O-CB 3.42Å; R162-Q165 PolarHBondContact O-N 2.97Å; Q165-I167 VanDerWaalsContact C-N 3.33Å; Q165-I167 PolarHBondContact O-N 2.99Å; Q165-G168 CarbonylContact O-C 3.58Å; Q165-G168 WeakPolarHBondContact O-CA 3.16Å; Q165-G168 PolarHBondContact O-N 3.43Å; Q165-T169 PolarHBondContact O-N 3.46Å; Q165-T169 PolarHBondContact O-OG1 3.22Å; Q165-K205 HydrophobicContact CB-CD 4.05Å |
| 166 | L | 98.6 | Very high | 96.5 | Very high | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -61.7 | -40.6 | -177.1 | 176.2 | 54.7 | 0 | 0 | 0 | 111.8 | L122 L125 A126 C129 F138 L147 R162 A163 G168 T169 C170 | L122-L166 HydrophobicContact CD2-CD2 4.31Å; L125-L166 HydrophobicContact CB-CD1 4.29Å; L125-L166 HydrophobicContact CB-CD2 3.63Å; L125-L166 HydrophobicContact CD1-CD2 4.16Å; A126-L166 HydrophobicContact CB-CD1 4.39Å; C129-L166 HydrophobicContact CB-CD1 3.85Å; F138-L166 HydrophobicContact CE1-CD2 4.32Å; F138-L166 HydrophobicContact CE1-CG 4.43Å; F138-L166 HydrophobicContact CE2-CD2 4.38Å; F138-L166 HydrophobicContact CZ-CD2 3.84Å; F138-L166 HydrophobicContact CZ-CG 4.44Å; L147-L166 HydrophobicContact CD1-CB 4.02Å; L147-L166 HydrophobicContact CD1-CD2 3.54Å; L147-L166 HydrophobicContact CD1-CG 3.54Å; L147-L166 HydrophobicContact CD2-CD2 3.98Å; L147-L166 HydrophobicContact CG-CD2 4.33Å; R162-L166 WeakPolarHBondContact O-CB 3.44Å; R162-L166 PolarHBondContact O-N 3.39Å; A163-L166 PolarHBondContact O-N 2.92Å; L166-G168 VanDerWaalsContact C-N 3.31Å; L166-G168 PolarHBondContact O-N 3.04Å; L166-T169 PolarHBondContact O-N 3.01Å; L166-C170 PolarHBondContact O-N 3.05Å; L166-C170 PolarHBondContact O-SG 2.94Å |
| 167 | I | 98.7 | Very high | 96.5 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -57.3 | -46.9 | 172.2 | -71.7 | 169 | 0 | 0 | 0 | 110.9 | M144 L147 V148 L152 A163 A164 Q165 S171 V181 L190 A209 L213 | M144-I167 HydrophobicContact SD-CG1 4.11Å; L147-I167 HydrophobicContact CB-CD1 4.07Å; L147-I167 HydrophobicContact CB-CG1 4.1Å; L147-I167 HydrophobicContact CD1-CG1 3.86Å; V148-I167 HydrophobicContact CG2-CD1 3.88Å; L152-I167 HydrophobicContact CD1-CD1 3.72Å; L152-I167 HydrophobicContact CD2-CD1 3.91Å; L152-I167 HydrophobicContact CG-CD1 3.87Å; A163-I167 VanDerWaalsContact O-CG1 3.32Å; A163-I167 WeakPolarHBondContact O-CG1 3.19Å; A163-I167 PolarHBondContact O-N 2.95Å; A164-I167 PolarHBondContact O-N 2.89Å; Q165-I167 VanDerWaalsContact C-N 3.33Å; Q165-I167 PolarHBondContact O-N 2.99Å; I167-S171 WeakPolarHBondContact O-CB 3.45Å; I167-S171 PolarHBondContact O-N 2.93Å; I167-S171 PolarHBondContact O-OG 2.95Å; I167-V181 HydrophobicContact CG2-CG1 3.75Å; I167-L190 HydrophobicContact CG2-CD1 4.47Å; I167-A209 HydrophobicContact CG2-CB 4.3Å; I167-L213 HydrophobicContact CG2-CD1 4.4Å |
| 168 | G | 98.1 | Very high | 96.5 | Very high | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -63.6 | -41.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | A164 Q165 L166 S171 Q172 C212 | A164-G168 PolarHBondContact O-N 3.11Å; Q165-G168 CarbonylContact O-C 3.58Å; Q165-G168 WeakPolarHBondContact O-CA 3.16Å; Q165-G168 PolarHBondContact O-N 3.43Å; L166-G168 VanDerWaalsContact C-N 3.31Å; L166-G168 PolarHBondContact O-N 3.04Å; G168-S171 PolarHBondContact O-N 3.36Å; G168-Q172 PolarHBondContact O-N 3.41Å; G168-C212 PolarHBondContact O-SG 3.06Å |
| 169 | T | 97.6 | Very high | 96.4 | Very high | 28 Ų | 28 | 32.3 Ų | 32.3 | 17% | 0.172 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -61.4 | -52.3 | 177 | -61.2 | 0 | 0 | 0 | 0 | 111 | C129 E130 Q165 L166 S171 Q172 | C129-T169 HydrophobicContact CB-CG2 4.5Å; E130-T169 HydrophobicContact CG-CG2 4.13Å; Q165-T169 PolarHBondContact O-N 3.46Å; Q165-T169 PolarHBondContact O-OG1 3.22Å; L166-T169 PolarHBondContact O-N 3.01Å; T169-S171 VanDerWaalsContact C-N 3.26Å; T169-S171 PolarHBondContact O-N 2.9Å; T169-Q172 PolarHBondContact O-N 3.43Å |
| 170 | C | 97.2 | Very high | 96.3 | Very high | 1 Ų | 1 | 34.7 Ų | 34.7 | 1% | 0.007 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -66.6 | -28.9 | -179.2 | -62 | 0 | 0 | 0 | 0 | 113.4 | C129 A135 M144 L166 I177 | C129-C170 WeakPolarHBondContact CB-SG 3.3Å; A135-C170 HydrophobicContact CB-CB 3.98Å; M144-C170 HydrophobicContact CE-CB 3.12Å; M144-C170 WeakPolarHBondContact CE-SG 3.34Å; L166-C170 PolarHBondContact O-N 3.05Å; L166-C170 PolarHBondContact O-SG 2.94Å; C170-I177 HydrophobicContact CB-CG2 4.15Å; C170-I177 WeakPolarHBondContact O-CD1 3.31Å; C170-I177 WeakPolarHBondContact O-CG2 3.31Å |
| 171 | S | 95.8 | Very high | 96.2 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -92 | -4.3 | -173.5 | -55 | 0 | 0 | 0 | 0 | 113.4 | I167 G168 T169 N173 Q178 | I167-S171 WeakPolarHBondContact O-CB 3.45Å; I167-S171 PolarHBondContact O-N 2.93Å; I167-S171 PolarHBondContact O-OG 2.95Å; G168-S171 PolarHBondContact O-N 3.36Å; T169-S171 VanDerWaalsContact C-N 3.26Å; T169-S171 PolarHBondContact O-N 2.9Å; S171-N173 PolarHBondContact O-N 2.9Å; S171-Q178 WeakPolarHBondContact O-CG 3.31Å; S171-Q178 PolarHBondContact O-NE2 3.36Å |
| 172 | Q | 92.4 | Very high | 96.2 | Very high | 106 Ų | 106 | 31.4 Ų | 31.4 | 50% | 0.495 | 18% | 0.175 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.9 | 107.5 | -175.7 | -174.3 | 175.2 | 102 | 0 | 0 | 111 | G168 T169 V174 | G168-Q172 PolarHBondContact O-N 3.41Å; T169-Q172 PolarHBondContact O-N 3.43Å; Q172-V174 PolarHBondContact O-N 2.9Å |
| 173 | N | 87.9 | Confident | 96.1 | Very high | 95 Ų | 95 | 33.4 Ų | 33.4 | 51% | 0.508 | 20% | 0.204 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 57.5 | 31 | 178.3 | -56.3 | -13.5 | 0 | 0 | 0 | 114.1 | S171 | S171-N173 PolarHBondContact O-N 2.9Š|
| 174 | V | 91.9 | Very high | 96.1 | Very high | 33 Ų | 33 | 35.7 Ų | 35.7 | 20% | 0.2 | 22% | 0.216 | C | C | . | . | trans | -121.1 | 91.7 | 175.7 | -171.9 | 0 | 0 | 0 | 0 | 110.2 | M132 Q172 A176 I177 Q178 | M132-V174 HydrophobicContact CG-CG2 4.34Å; M132-V174 HydrophobicContact SD-CG2 4.37Å; Q172-V174 PolarHBondContact O-N 2.9Å; V174-A176 VanDerWaalsContact C-N 3.34Å; V174-A176 PolarHBondContact O-N 3.3Å; V174-I177 HydrophobicContact CB-CB 4.19Å; V174-I177 HydrophobicContact CB-CD1 4.21Å; V174-I177 HydrophobicContact CB-CG1 4.3Å; V174-I177 HydrophobicContact CG1-CB 4.01Å; V174-I177 HydrophobicContact CG1-CD1 3.73Å; V174-I177 HydrophobicContact CG1-CG1 3.67Å; V174-I177 PolarHBondContact O-N 3.42Å; V174-Q178 WeakPolarHBondContact O-CG 3.19Å; V174-Q178 PolarHBondContact O-N 3.13Å | ||
| 175 | A | 94.1 | Very high | 96 | Very high | 54 Ų | 54 | 36.9 Ų | 36.9 | 45% | 0.446 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -49.4 | -48.4 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | I177 Q178 E179 | A175-I177 VanDerWaalsContact C-N 3.32Å; A175-I177 PolarHBondContact O-N 3.24Å; A175-Q178 VanDerWaalsContact CA-OE1 3.31Å; A175-Q178 PolarHBondContact O-N 3.12Å; A175-E179 WeakPolarHBondContact O-CG 3.46Å; A175-E179 PolarHBondContact O-N 3.05Å |
| 176 | A | 93.5 | Very high | 96 | Very high | 71 Ų | 71 | 34.8 Ų | 34.8 | 59% | 0.587 | 22% | 0.218 | S | C | * | . | H | α-helix | trans | -61.5 | -38.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113 | V174 Q180 | V174-A176 VanDerWaalsContact C-N 3.34Å; V174-A176 PolarHBondContact O-N 3.3Å; A176-Q180 PolarHBondContact O-N 2.93Å |
| 177 | I | 95.4 | Very high | 96 | Very high | 6 Ų | 6 | 34.8 Ų | 34.8 | 3% | 0.031 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -73.6 | -42.6 | 177.4 | -63.3 | 179.2 | 0 | 0 | 0 | 109.8 | A135 M144 C170 V174 A175 E179 Q180 V181 | A135-I177 HydrophobicContact CB-CD1 3.87Å; M144-I177 HydrophobicContact CE-CG2 4.38Å; C170-I177 HydrophobicContact CB-CG2 4.15Å; C170-I177 WeakPolarHBondContact O-CD1 3.31Å; C170-I177 WeakPolarHBondContact O-CG2 3.31Å; V174-I177 HydrophobicContact CB-CB 4.19Å; V174-I177 HydrophobicContact CB-CD1 4.21Å; V174-I177 HydrophobicContact CB-CG1 4.3Å; V174-I177 HydrophobicContact CG1-CB 4.01Å; V174-I177 HydrophobicContact CG1-CD1 3.73Å; V174-I177 HydrophobicContact CG1-CG1 3.67Å; V174-I177 PolarHBondContact O-N 3.42Å; A175-I177 VanDerWaalsContact C-N 3.32Å; A175-I177 PolarHBondContact O-N 3.24Å; I177-E179 VanDerWaalsContact C-N 3.34Å; I177-E179 PolarHBondContact O-N 3.49Å; I177-Q180 PolarHBondContact O-N 2.99Å; I177-V181 HydrophobicContact CG2-CG2 4.08Å; I177-V181 WeakPolarHBondContact O-CB 3.42Å; I177-V181 VanDerWaalsContact O-CG2 3.27Å; I177-V181 WeakPolarHBondContact O-CG2 3.26Å; I177-V181 PolarHBondContact O-N 3.1Å |
| 178 | Q | 97.3 | Very high | 96 | Very high | 4 Ų | 4 | 42.1 Ų | 42.1 | 2% | 0.019 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -56.1 | -48.8 | 175.4 | -66.6 | 166.6 | -32.8 | 0 | 0 | 110.9 | S171 V174 A175 Q180 V181 L182 C212 L213 Q217 | S171-Q178 WeakPolarHBondContact O-CG 3.31Å; S171-Q178 PolarHBondContact O-NE2 3.36Å; V174-Q178 WeakPolarHBondContact O-CG 3.19Å; V174-Q178 PolarHBondContact O-N 3.13Å; A175-Q178 VanDerWaalsContact CA-OE1 3.31Å; A175-Q178 PolarHBondContact O-N 3.12Å; Q178-Q180 PolarHBondContact O-N 3.05Å; Q178-V181 PolarHBondContact O-N 2.81Å; Q178-L182 VanDerWaalsContact O-CB 3.32Å; Q178-L182 WeakPolarHBondContact O-CB 3.42Å; Q178-L182 WeakPolarHBondContact O-CD1 3.48Å; Q178-L182 WeakPolarHBondContact O-CG 3.38Å; Q178-L182 PolarHBondContact O-N 3.35Å; Q178-C212 PolarHBondContact NE2-O 3.07Å; Q178-L213 HydrophobicContact CB-CD2 4.27Å; Q178-L213 HydrophobicContact CG-CD2 4.33Å; Q178-Q217 HydrophobicContact CB-CG 4Å |
| 179 | E | 96 | Very high | 96 | Very high | 115 Ų | 115 | 44.2 Ų | 44.2 | 54% | 0.537 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -58.6 | -46 | 177.9 | -74.2 | 177.5 | -172.1 | 0 | 0 | 112.4 | A175 I177 L182 G183 | A175-E179 WeakPolarHBondContact O-CG 3.46Å; A175-E179 PolarHBondContact O-N 3.05Å; I177-E179 VanDerWaalsContact C-N 3.34Å; I177-E179 PolarHBondContact O-N 3.49Å; E179-L182 PolarHBondContact O-N 3.31Å; E179-G183 PolarHBondContact O-N 3.49Å |
| 180 | Q | 95.4 | Very high | 96 | Very high | 65 Ų | 65 | 42.9 Ų | 42.9 | 30% | 0.304 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -59.3 | -50.3 | 176.6 | -178.1 | -178.2 | -8.9 | 0 | 0 | 111 | A176 I177 Q178 L182 G183 L184 | A176-Q180 PolarHBondContact O-N 2.93Å; I177-Q180 PolarHBondContact O-N 2.99Å; Q178-Q180 PolarHBondContact O-N 3.05Å; Q180-L182 VanDerWaalsContact C-N 3.35Å; Q180-L182 PolarHBondContact O-N 3.01Å; Q180-G183 PolarHBondContact O-N 3Å; Q180-G183 VanDerWaalsContact O-N 3.16Å; Q180-L184 WeakPolarHBondContact O-CG 3.49Å; Q180-L184 PolarHBondContact O-N 2.98Å; Q180-L184 VanDerWaalsContact O-N 3.08Å |
| 181 | V | 97.7 | Very high | 96.1 | Very high | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -64.5 | -39 | -178.2 | 172.2 | 0 | 0 | 0 | 0 | 111.6 | M144 I167 I177 Q178 G183 L184 A186 L213 | M144-V181 HydrophobicContact CB-CG2 4.42Å; M144-V181 HydrophobicContact CE-CG2 4.42Å; M144-V181 HydrophobicContact CG-CG2 3.9Å; M144-V181 HydrophobicContact SD-CG2 3.68Å; I167-V181 HydrophobicContact CG2-CG1 3.75Å; I177-V181 HydrophobicContact CG2-CG2 4.08Å; I177-V181 WeakPolarHBondContact O-CB 3.42Å; I177-V181 VanDerWaalsContact O-CG2 3.27Å; I177-V181 WeakPolarHBondContact O-CG2 3.26Å; I177-V181 PolarHBondContact O-N 3.1Å; Q178-V181 PolarHBondContact O-N 2.81Å; V181-G183 VanDerWaalsContact C-N 3.34Å; V181-L184 PolarHBondContact O-N 2.99Å; V181-A186 HydrophobicContact CG1-CB 3.46Å; V181-A186 VanDerWaalsContact CG1-CB 3.46Å; V181-A186 VanDerWaalsContact O-CB 3.26Å; V181-A186 WeakPolarHBondContact O-CB 3.32Å; V181-A186 PolarHBondContact O-N 3.47Å; V181-L213 HydrophobicContact CB-CD2 3.97Å; V181-L213 HydrophobicContact CG1-CD1 3.93Å; V181-L213 HydrophobicContact CG1-CD2 3.72Å; V181-L213 HydrophobicContact CG1-CG 4.47Å |
| 182 | L | 98 | Very high | 96.2 | Very high | 11 Ų | 11 | 49 Ų | 49 | 6% | 0.058 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.1 | -41.1 | 173.3 | -70.2 | 166.5 | 0 | 0 | 0 | 111.4 | Q178 E179 Q180 L184 G185 L187 L213 Q217 A219 G220 Q223 | Q178-L182 VanDerWaalsContact O-CB 3.32Å; Q178-L182 WeakPolarHBondContact O-CB 3.42Å; Q178-L182 WeakPolarHBondContact O-CD1 3.48Å; Q178-L182 WeakPolarHBondContact O-CG 3.38Å; Q178-L182 PolarHBondContact O-N 3.35Å; E179-L182 PolarHBondContact O-N 3.31Å; Q180-L182 VanDerWaalsContact C-N 3.35Å; Q180-L182 PolarHBondContact O-N 3.01Å; L182-L184 VanDerWaalsContact C-N 3.26Å; L182-L184 PolarHBondContact O-N 3.44Å; L182-G185 PolarHBondContact O-N 3.47Å; L182-L187 HydrophobicContact CD2-CB 4.22Å; L182-L187 HydrophobicContact CD2-CD2 4.12Å; L182-L213 HydrophobicContact CD2-CB 4.32Å; L182-L213 HydrophobicContact CG-CD2 4.42Å; L182-Q217 HydrophobicContact CD1-CG 3.97Å; L182-A219 HydrophobicContact CD1-CB 4.49Å; L182-G220 VanDerWaalsContact CD1-CA 3.43Å; L182-Q223 PolarHBondContact O-NE2 3.02Å |
| 183 | G | 96.8 | Very high | 96.5 | Very high | 69 Ų | 69 | 44.7 Ų | 44.7 | 71% | 0.711 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -62.1 | -29.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | E179 Q180 V181 G185 | E179-G183 PolarHBondContact O-N 3.49Å; Q180-G183 PolarHBondContact O-N 3Å; Q180-G183 VanDerWaalsContact O-N 3.16Å; V181-G183 VanDerWaalsContact C-N 3.34Å; G183-G185 PolarHBondContact O-N 3.21Å |
| 184 | L | 97.6 | Very high | 97.1 | Very high | 47 Ų | 47 | 40.2 Ų | 40.2 | 25% | 0.246 | 23% | 0.226 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | -1.5 | 173.7 | -62.6 | 176 | 0 | 0 | 0 | 113.8 | M144 H145 V148 Q180 V181 L182 A186 | M144-L184 HydrophobicContact CB-CD1 3.8Å; H145-L184 WeakPolarHBondContact CD2-CD2 3.3Å; H145-L184 WeakPolarHBondContact NE2-CD2 3.36Å; V148-L184 HydrophobicContact CB-CB 4.24Å; V148-L184 HydrophobicContact CB-CD1 4.49Å; V148-L184 HydrophobicContact CG1-CB 3.95Å; V148-L184 WeakPolarHBondContact CG1-O 3.27Å; V148-L184 HydrophobicContact CG2-CB 4.26Å; V148-L184 HydrophobicContact CG2-CD1 4.23Å; Q180-L184 WeakPolarHBondContact O-CG 3.49Å; Q180-L184 PolarHBondContact O-N 2.98Å; Q180-L184 VanDerWaalsContact O-N 3.08Å; V181-L184 PolarHBondContact O-N 2.99Å; L182-L184 VanDerWaalsContact C-N 3.26Å; L182-L184 PolarHBondContact O-N 3.44Å; L184-A186 VanDerWaalsContact C-N 3.29Å; L184-A186 PolarHBondContact O-N 3.38Å |
| 185 | G | 97 | Very high | 97.3 | Very high | 25 Ų | 25 | 40.5 Ų | 40.5 | 26% | 0.258 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 72.8 | 21.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | L182 G183 L187 R188 | L182-G185 PolarHBondContact O-N 3.47Å; G183-G185 PolarHBondContact O-N 3.21Å; G185-L187 VanDerWaalsContact C-N 3.28Å; G185-L187 PolarHBondContact O-N 2.88Å; G185-R188 PolarHBondContact O-N 3.43Å |
| 186 | A | 98.4 | Very high | 97.5 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -58.1 | -40 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | V148 V181 L184 R188 K189 L190 | V148-A186 HydrophobicContact CG1-CB 4.01Å; V148-A186 HydrophobicContact CG2-CB 3.69Å; V181-A186 HydrophobicContact CG1-CB 3.46Å; V181-A186 VanDerWaalsContact CG1-CB 3.46Å; V181-A186 VanDerWaalsContact O-CB 3.26Å; V181-A186 WeakPolarHBondContact O-CB 3.32Å; V181-A186 PolarHBondContact O-N 3.47Å; L184-A186 VanDerWaalsContact C-N 3.29Å; L184-A186 PolarHBondContact O-N 3.38Å; A186-R188 VanDerWaalsContact C-N 3.32Å; A186-R188 PolarHBondContact O-N 3.18Å; A186-K189 PolarHBondContact O-N 3.45Å; A186-L190 HydrophobicContact CB-CD1 4.39Å; A186-L190 WeakPolarHBondContact O-CG 3.14Å; A186-L190 PolarHBondContact O-N 3Å |
| 187 | L | 98.6 | Very high | 97.7 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59.2 | -39.8 | -174.5 | -166.8 | 63.7 | 0 | 0 | 0 | 112.9 | L182 G185 K189 L190 L191 I210 V214 Q223 F224 L227 | L182-L187 HydrophobicContact CD2-CB 4.22Å; L182-L187 HydrophobicContact CD2-CD2 4.12Å; G185-L187 VanDerWaalsContact C-N 3.28Å; G185-L187 PolarHBondContact O-N 2.88Å; L187-K189 PolarHBondContact O-N 3.03Å; L187-L190 PolarHBondContact O-N 2.76Å; L187-L191 HydrophobicContact CG-CD1 4.25Å; L187-L191 WeakPolarHBondContact O-CB 3.47Å; L187-L191 WeakPolarHBondContact O-CG 3.21Å; L187-L191 PolarHBondContact O-N 3.2Å; L187-I210 HydrophobicContact CD1-CB 4.48Å; L187-I210 HydrophobicContact CD1-CG1 4.12Å; L187-I210 HydrophobicContact CD1-CG2 4.18Å; L187-V214 HydrophobicContact CD1-CG1 4.11Å; L187-Q223 HydrophobicContact CD2-CB 3.73Å; L187-Q223 HydrophobicContact CD2-CG 3.86Å; L187-F224 HydrophobicContact CD2-CB 3.96Å; L187-L227 HydrophobicContact CB-CD1 4.23Å; L187-L227 HydrophobicContact CD2-CD1 4.2Å; L187-L227 HydrophobicContact CG-CD1 4.14Å |
| 188 | R | 98.6 | Very high | 97.7 | Very high | 154 Ų | 154 | 49.9 Ų | 49.9 | 58% | 0.581 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -63.6 | -40.9 | 175.9 | -178.7 | -178.3 | -74.3 | 141.4 | -5 | 111.8 | G185 A186 R192 L227 | G185-R188 PolarHBondContact O-N 3.43Å; A186-R188 VanDerWaalsContact C-N 3.32Å; A186-R188 PolarHBondContact O-N 3.18Å; R188-R192 PolarHBondContact O-N 3.43Å; R188-R192 VanDerWaalsContact O-N 3.16Å; R188-L227 HydrophobicContact CB-CD1 3.97Å; R188-L227 HydrophobicContact CB-CD2 4.27Å; R188-L227 HydrophobicContact CG-CD2 4.31Å |
| 189 | K | 98.7 | Very high | 97.8 | Very high | 45 Ų | 45 | 51.2 Ų | 51.2 | 20% | 0.196 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -68.5 | -44.4 | 178 | -65.4 | 179.4 | -173.6 | -81.5 | 0 | 110.5 | V148 L152 E153 A186 L187 R192 L193 | V148-K189 HydrophobicContact CG1-CD 4.09Å; V148-K189 VanDerWaalsContact O-CD 3.26Å; V148-K189 WeakPolarHBondContact O-CD 3.43Å; V148-K189 VanDerWaalsContact O-CE 3.29Å; V148-K189 WeakPolarHBondContact O-CE 3.45Å; L152-K189 HydrophobicContact CB-CD 4.45Å; L152-K189 HydrophobicContact CD1-CB 3.93Å; L152-K189 HydrophobicContact CD1-CD 4.33Å; E153-K189 IonicContact OE1-NZ 3.11Å; E153-K189 PolarHBondContact OE1-NZ 3.14Å; E153-K189 IonicContact OE2-NZ 2.95Å; E153-K189 PolarHBondContact OE2-NZ 3.37Å; A186-K189 PolarHBondContact O-N 3.45Å; L187-K189 PolarHBondContact O-N 3.03Å; K189-R192 WeakPolarHBondContact O-CB 3.44Å; K189-R192 PolarHBondContact O-N 2.89Å; K189-L193 WeakPolarHBondContact O-CG 3.2Å; K189-L193 PolarHBondContact O-N 2.96Å |
| 190 | L | 98.9 | Very high | 97.8 | Very high | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62.9 | -43 | 178 | -66.7 | 168.5 | 0 | 0 | 0 | 112.3 | L152 A164 I167 A186 L187 R192 L193 L194 A206 A209 I210 L213 | L152-L190 HydrophobicContact CD1-CD2 4.06Å; L152-L190 HydrophobicContact CD1-CG 4.16Å; L152-L190 HydrophobicContact CD2-CD2 3.81Å; A164-L190 HydrophobicContact CB-CD2 4.04Å; I167-L190 HydrophobicContact CG2-CD1 4.47Å; A186-L190 HydrophobicContact CB-CD1 4.39Å; A186-L190 WeakPolarHBondContact O-CG 3.14Å; A186-L190 PolarHBondContact O-N 3Å; L187-L190 PolarHBondContact O-N 2.76Å; L190-R192 VanDerWaalsContact C-N 3.31Å; L190-R192 PolarHBondContact O-N 2.77Å; L190-L193 PolarHBondContact O-N 2.69Å; L190-L194 WeakPolarHBondContact O-CB 3.47Å; L190-L194 PolarHBondContact O-N 2.97Å; L190-A206 HydrophobicContact CD2-CB 4.31Å; L190-A209 HydrophobicContact CD1-CB 3.73Å; L190-A209 HydrophobicContact CD2-CB 3.84Å; L190-A209 HydrophobicContact CG-CB 4.41Å; L190-I210 HydrophobicContact CB-CD1 4.06Å; L190-I210 HydrophobicContact CB-CG1 3.71Å; L190-I210 HydrophobicContact CD1-CG1 4.45Å; L190-L213 HydrophobicContact CD1-CD1 3.59Å |
| 191 | L | 98.8 | Very high | 98 | Very high | 8 Ų | 8 | 49.5 Ų | 49.5 | 4% | 0.042 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.5 | -39.7 | 174.6 | -77.1 | 169.2 | 0 | 0 | 0 | 111.7 | L187 L194 D195 I210 F224 L227 V232 | L187-L191 HydrophobicContact CG-CD1 4.25Å; L187-L191 WeakPolarHBondContact O-CB 3.47Å; L187-L191 WeakPolarHBondContact O-CG 3.21Å; L187-L191 PolarHBondContact O-N 3.2Å; L191-L194 PolarHBondContact O-N 3.21Å; L191-D195 VanDerWaalsContact O-CB 3.3Å; L191-D195 WeakPolarHBondContact O-CB 3.31Å; L191-D195 PolarHBondContact O-N 3.16Å; L191-I210 HydrophobicContact CD2-CD1 3.88Å; L191-I210 HydrophobicContact CG-CD1 4.19Å; L191-F224 HydrophobicContact CD1-CD2 4.49Å; L191-F224 HydrophobicContact CD2-CD2 4.16Å; L191-F224 HydrophobicContact CD2-CE2 3.92Å; L191-L227 HydrophobicContact CD1-CB 3.55Å; L191-L227 HydrophobicContact CD1-CD1 3.94Å; L191-L227 HydrophobicContact CD1-CG 4.41Å; L191-V232 HydrophobicContact CD2-CB 4.04Å; L191-V232 HydrophobicContact CD2-CG1 4.04Å; L191-V232 HydrophobicContact CD2-CG2 4.22Å |
| 192 | R | 98.5 | Very high | 98 | Very high | 121 Ų | 121 | 49.5 Ų | 49.5 | 46% | 0.457 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -62.7 | -42.6 | 174.3 | -172.3 | -169.5 | -63.9 | 157.5 | -2.7 | 111.8 | E153 R188 K189 L190 D195 R196 | E153-R192 IonicContact OE1-NH1 2.93Å; E153-R192 PolarHBondContact OE1-NH1 3.03Å; R188-R192 PolarHBondContact O-N 3.43Å; R188-R192 VanDerWaalsContact O-N 3.16Å; K189-R192 WeakPolarHBondContact O-CB 3.44Å; K189-R192 PolarHBondContact O-N 2.89Å; L190-R192 VanDerWaalsContact C-N 3.31Å; L190-R192 PolarHBondContact O-N 2.77Å; R192-D195 PolarHBondContact O-N 2.87Å; R192-R196 WeakPolarHBondContact O-CB 3.43Å; R192-R196 PolarHBondContact O-N 3.02Å |
| 193 | L | 98.7 | Very high | 98.1 | Very high | 16 Ų | 16 | 49.9 Ų | 49.9 | 8% | 0.084 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.9 | -46 | 177 | -69 | 177.1 | 0 | 0 | 0 | 111.5 | L152 K189 L190 D195 D197 V202 A206 | L152-L193 HydrophobicContact CB-CD1 4.39Å; L152-L193 HydrophobicContact CD2-CD1 3.93Å; K189-L193 WeakPolarHBondContact O-CG 3.2Å; K189-L193 PolarHBondContact O-N 2.96Å; L190-L193 PolarHBondContact O-N 2.69Å; L193-D195 VanDerWaalsContact C-N 3.28Å; L193-D195 PolarHBondContact O-N 3.41Å; L193-D197 HydrophobicContact CD2-CB 4.41Å; L193-D197 WeakPolarHBondContact CD2-OD2 3.35Å; L193-D197 WeakPolarHBondContact O-CB 3.3Å; L193-D197 PolarHBondContact O-N 3.26Å; L193-V202 HydrophobicContact CB-CG1 4.19Å; L193-V202 HydrophobicContact CD1-CG1 4.22Å; L193-V202 HydrophobicContact CD2-CG1 4.09Å; L193-V202 HydrophobicContact CG-CG1 4.4Å; L193-A206 HydrophobicContact CB-CB 3.82Å |
| 194 | L | 98.7 | Very high | 98.1 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -55.8 | -44.2 | 175.6 | 173.7 | 55.2 | 0 | 0 | 0 | 112 | L190 L191 R203 A206 L207 I210 V232 L233 A236 L244 | L190-L194 WeakPolarHBondContact O-CB 3.47Å; L190-L194 PolarHBondContact O-N 2.97Å; L191-L194 PolarHBondContact O-N 3.21Å; L194-R203 HydrophobicContact CD1-CB 4.5Å; L194-R203 PolarHBondContact O-NE 2.91Å; L194-R203 PolarHBondContact O-NH2 2.75Å; L194-A206 HydrophobicContact CB-CB 4.4Å; L194-L207 HydrophobicContact CD1-CB 4.02Å; L194-L207 HydrophobicContact CD2-CB 4.42Å; L194-L207 HydrophobicContact CD2-CD1 3.99Å; L194-I210 HydrophobicContact CB-CD1 4.11Å; L194-I210 HydrophobicContact CD2-CD1 3.65Å; L194-V232 HydrophobicContact CB-CG1 4.22Å; L194-V232 HydrophobicContact CD2-CG1 3.72Å; L194-V232 HydrophobicContact CG-CG1 3.76Å; L194-L233 HydrophobicContact CD2-CD2 4.17Å; L194-A236 HydrophobicContact CD1-CB 3.98Å; L194-A236 HydrophobicContact CG-CB 4.44Å; L194-L244 HydrophobicContact CD1-CD1 3.62Å |
| 195 | D | 97.8 | Very high | 98.2 | Very high | 40 Ų | 40 | 47.4 Ų | 47.4 | 21% | 0.214 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -79 | -37.9 | -173.9 | -163.5 | 38.9 | 0 | 0 | 0 | 113.3 | L191 R192 L193 V232 R235 | L191-D195 VanDerWaalsContact O-CB 3.3Å; L191-D195 WeakPolarHBondContact O-CB 3.31Å; L191-D195 PolarHBondContact O-N 3.16Å; R192-D195 PolarHBondContact O-N 2.87Å; L193-D195 VanDerWaalsContact C-N 3.28Å; L193-D195 PolarHBondContact O-N 3.41Å; D195-V232 HydrophobicContact CB-CG1 3.88Å; D195-R235 VanDerWaalsContact CG-NH2 3.25Å; D195-R235 IonicContact OD1-CZ 2.66Å; D195-R235 IonicContact OD1-NE 3.99Å; D195-R235 PolarHBondContact OD1-NE 3.19Å; D195-R235 IonicContact OD1-NH2 3.19Å; D195-R235 PolarHBondContact OD1-NH2 2.89Å; D195-R235 VanDerWaalsContact OD1-NH2 3.08Å; D195-R235 IonicContact OD2-CZ 3.1Å; D195-R235 IonicContact OD2-NE 3.34Å; D195-R235 IonicContact OD2-NH2 3.25Å; D195-R235 PolarHBondContact OD2-NH2 3.48Å |
| 196 | R | 96.9 | Very high | 98.3 | Very high | 193 Ų | 193 | 46.2 Ų | 46.2 | 73% | 0.728 | 22% | 0.22 | S | C | * | . | H | α-helix | trans | -127.3 | -9.6 | -163.1 | -56 | -175.3 | -174.9 | -172.6 | -1.8 | 116.1 | R192 | R192-R196 WeakPolarHBondContact O-CB 3.43Å; R192-R196 PolarHBondContact O-N 3.02Å |
| 197 | D | 98.1 | Very high | 98.3 | Very high | 19 Ų | 19 | 46.3 Ų | 46.3 | 10% | 0.102 | 22% | 0.22 | C | C | . | . | trans | -67.6 | 140.2 | 178.6 | -155.1 | -70.9 | 0 | 0 | 0 | 110.4 | R160 L193 C199 V202 R203 | R160-D197 IonicContact CZ-OD1 3.03Å; R160-D197 IonicContact CZ-OD2 3.8Å; R160-D197 IonicContact NE-OD2 3.79Å; R160-D197 PolarHBondContact NE-OD2 3.1Å; R160-D197 IonicContact NH2-OD1 3.21Å; R160-D197 PolarHBondContact NH2-OD1 3.44Å; R160-D197 IonicContact NH2-OD2 2.78Å; R160-D197 PolarHBondContact NH2-OD2 3.28Å; L193-D197 HydrophobicContact CD2-CB 4.41Å; L193-D197 WeakPolarHBondContact CD2-OD2 3.35Å; L193-D197 WeakPolarHBondContact O-CB 3.3Å; L193-D197 PolarHBondContact O-N 3.26Å; D197-C199 VanDerWaalsContact C-N 3.31Å; D197-C199 WeakPolarHBondContact OD1-CB 3.4Å; D197-C199 PolarHBondContact OD1-N 3.05Å; D197-V202 HydrophobicContact CB-CB 4.22Å; D197-V202 HydrophobicContact CB-CG1 3.99Å; D197-V202 WeakPolarHBondContact OD2-CG1 3.42Å; D197-R203 HydrophobicContact CB-CG 4.1Å; D197-R203 VanDerWaalsContact O-CD 3.32Å; D197-R203 WeakPolarHBondContact O-CD 3.48Å | ||
| 198 | S | 96.2 | Very high | 98.3 | Very high | 115 Ų | 115 | 48.7 Ų | 48.7 | 80% | 0.804 | 23% | 0.231 | S | C | * | . | S | Bend | trans | -77.9 | -18.2 | 178.9 | 56.4 | 0 | 0 | 0 | 0 | 113 | ||
| 199 | C | 97.7 | Very high | 98.3 | Very high | 33 Ų | 33 | 41.4 Ų | 41.4 | 22% | 0.223 | 20% | 0.203 | C | C | . | . | trans | -94.8 | 116.3 | -179.2 | -179.1 | 0 | 0 | 0 | 0 | 111.3 | A157 D197 T201 V202 R203 | A157-C199 HydrophobicContact CB-CB 3.8Å; D197-C199 VanDerWaalsContact C-N 3.31Å; D197-C199 WeakPolarHBondContact OD1-CB 3.4Å; D197-C199 PolarHBondContact OD1-N 3.05Å; C199-T201 PolarHBondContact O-N 3.23Å; C199-V202 HydrophobicContact CB-CB 4.18Å; C199-V202 HydrophobicContact CB-CG2 3.71Å; C199-V202 WeakPolarHBondContact O-CB 3.45Å; C199-V202 PolarHBondContact O-N 2.85Å; C199-R203 WeakPolarHBondContact O-CG 3.34Å; C199-R203 PolarHBondContact O-N 3.3Å; C199-R203 VanDerWaalsContact O-N 3.11Å | ||
| 200 | D | 97.9 | Very high | 98.3 | Very high | 76 Ų | 76 | 39.2 Ų | 39.2 | 41% | 0.406 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -58.4 | -35.4 | -179.3 | -67.6 | -27.7 | 0 | 0 | 0 | 113.4 | V202 R203 V204 V241 | D200-V202 VanDerWaalsContact C-N 3.33Å; D200-V202 PolarHBondContact O-N 3.26Å; D200-R203 PolarHBondContact O-N 3.09Å; D200-R203 IonicContact OD1-NH1 2.84Å; D200-V204 WeakPolarHBondContact O-CB 3.48Å; D200-V204 VanDerWaalsContact O-CG2 3.31Å; D200-V204 WeakPolarHBondContact O-CG2 3.47Å; D200-V204 PolarHBondContact O-N 2.87Å; D200-V241 HydrophobicContact CB-CG1 4.24Å; D200-V241 HydrophobicContact CB-CG2 4.27Å; D200-V241 VanDerWaalsContact CG-CG2 3.41Å; D200-V241 WeakPolarHBondContact OD1-CG2 3.26Å; D200-V241 WeakPolarHBondContact OD2-CG2 3.1Å |
| 201 | T | 98.1 | Very high | 98.3 | Very high | 68 Ų | 68 | 40 Ų | 40 | 42% | 0.417 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -61.4 | -42 | 175 | -53.7 | 0 | 0 | 0 | 0 | 111.4 | W161 C199 V204 K205 | W161-T201 HydrophobicContact CB-CG2 4.05Å; W161-T201 HydrophobicContact CD2-CG2 3.95Å; W161-T201 HydrophobicContact CG-CG2 3.74Å; C199-T201 PolarHBondContact O-N 3.23Å; T201-V204 PolarHBondContact O-N 3.5Å; T201-K205 HydrophobicContact CG2-CG 4.5Å; T201-K205 WeakPolarHBondContact O-CB 3.28Å; T201-K205 WeakPolarHBondContact O-CG 3.33Å; T201-K205 PolarHBondContact O-N 3.27Å |
| 202 | V | 98.8 | Very high | 98.2 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.3 | -46.8 | 175.6 | 179.4 | 0 | 0 | 0 | 0 | 110.1 | A157 R160 W161 L193 D197 C199 D200 V204 K205 A206 | A157-V202 HydrophobicContact CB-CG2 3.94Å; A157-V202 WeakPolarHBondContact O-CG2 3.39Å; R160-V202 HydrophobicContact CB-CG1 3.96Å; R160-V202 HydrophobicContact CB-CG2 4.06Å; W161-V202 HydrophobicContact CB-CB 4.28Å; W161-V202 HydrophobicContact CB-CG2 3.83Å; L193-V202 HydrophobicContact CB-CG1 4.19Å; L193-V202 HydrophobicContact CD1-CG1 4.22Å; L193-V202 HydrophobicContact CD2-CG1 4.09Å; L193-V202 HydrophobicContact CG-CG1 4.4Å; D197-V202 HydrophobicContact CB-CB 4.22Å; D197-V202 HydrophobicContact CB-CG1 3.99Å; D197-V202 WeakPolarHBondContact OD2-CG1 3.42Å; C199-V202 HydrophobicContact CB-CB 4.18Å; C199-V202 HydrophobicContact CB-CG2 3.71Å; C199-V202 WeakPolarHBondContact O-CB 3.45Å; C199-V202 PolarHBondContact O-N 2.85Å; D200-V202 VanDerWaalsContact C-N 3.33Å; D200-V202 PolarHBondContact O-N 3.26Å; V202-V204 PolarHBondContact O-N 3.26Å; V202-K205 PolarHBondContact O-N 3.13Å; V202-A206 VanDerWaalsContact O-CB 3.27Å; V202-A206 WeakPolarHBondContact O-CB 3.47Å; V202-A206 PolarHBondContact O-N 3.41Å |
| 203 | R | 98.7 | Very high | 98.2 | Very high | 19 Ų | 19 | 34.3 Ų | 34.3 | 7% | 0.072 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -59.8 | -45.5 | 179.2 | -58.1 | 174.9 | 76.8 | 178.2 | 9.5 | 111.9 | L194 D197 C199 D200 A206 L207 L244 | L194-R203 HydrophobicContact CD1-CB 4.5Å; L194-R203 PolarHBondContact O-NE 2.91Å; L194-R203 PolarHBondContact O-NH2 2.75Å; D197-R203 HydrophobicContact CB-CG 4.1Å; D197-R203 VanDerWaalsContact O-CD 3.32Å; D197-R203 WeakPolarHBondContact O-CD 3.48Å; C199-R203 WeakPolarHBondContact O-CG 3.34Å; C199-R203 PolarHBondContact O-N 3.3Å; C199-R203 VanDerWaalsContact O-N 3.11Å; D200-R203 PolarHBondContact O-N 3.09Å; D200-R203 IonicContact OD1-NH1 2.84Å; R203-A206 PolarHBondContact O-N 3.21Å; R203-L207 WeakPolarHBondContact O-CB 3.33Å; R203-L207 PolarHBondContact O-N 2.79Å; R203-L244 HydrophobicContact CB-CD1 4.29Å |
| 204 | V | 98.5 | Very high | 98.1 | Very high | 11 Ų | 11 | 33.6 Ų | 33.6 | 7% | 0.067 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -64.6 | -42.2 | 178.9 | 168.1 | 0 | 0 | 0 | 0 | 111.7 | D200 T201 V202 L207 F208 K243 L244 K247 | D200-V204 WeakPolarHBondContact O-CB 3.48Å; D200-V204 VanDerWaalsContact O-CG2 3.31Å; D200-V204 WeakPolarHBondContact O-CG2 3.47Å; D200-V204 PolarHBondContact O-N 2.87Å; T201-V204 PolarHBondContact O-N 3.5Å; V202-V204 PolarHBondContact O-N 3.26Å; V204-L207 PolarHBondContact O-N 3.17Å; V204-F208 PolarHBondContact O-N 3.29Å; V204-K243 HydrophobicContact CG1-CD 3.82Å; V204-K243 HydrophobicContact CG1-CG 3.98Å; V204-K243 HydrophobicContact CG2-CB 4.33Å; V204-K243 HydrophobicContact CG2-CD 4.42Å; V204-K243 HydrophobicContact CG2-CG 4.21Å; V204-L244 HydrophobicContact CG2-CB 4.43Å; V204-L244 HydrophobicContact CG2-CD1 4.22Å; V204-K247 HydrophobicContact CG1-CD 4.37Å |
| 205 | K | 98.6 | Very high | 97.9 | Very high | 52 Ų | 52 | 36.7 Ų | 36.7 | 23% | 0.226 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -72.9 | -33 | 178 | -66.4 | -64.4 | -173.1 | 163.8 | 0 | 112.1 | W161 A164 Q165 T201 V202 F208 A209 | W161-K205 HydrophobicContact CB-CB 4.19Å; W161-K205 HydrophobicContact CB-CG 4.11Å; W161-K205 HydrophobicContact CE3-CG 4.11Å; W161-K205 WeakPolarHBondContact O-CB 3.27Å; A164-K205 HydrophobicContact CB-CB 4.04Å; Q165-K205 HydrophobicContact CB-CD 4.05Å; T201-K205 HydrophobicContact CG2-CG 4.5Å; T201-K205 WeakPolarHBondContact O-CB 3.28Å; T201-K205 WeakPolarHBondContact O-CG 3.33Å; T201-K205 PolarHBondContact O-N 3.27Å; V202-K205 PolarHBondContact O-N 3.13Å; K205-F208 WeakPolarHBondContact O-CB 3.37Å; K205-F208 PolarHBondContact O-N 3.04Å; K205-A209 PolarHBondContact O-N 3.47Å |
| 206 | A | 98.8 | Very high | 97.5 | Very high | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.1 | -43.9 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | L190 L193 L194 V202 R203 F208 A209 I210 | L190-A206 HydrophobicContact CD2-CB 4.31Å; L193-A206 HydrophobicContact CB-CB 3.82Å; L194-A206 HydrophobicContact CB-CB 4.4Å; V202-A206 VanDerWaalsContact O-CB 3.27Å; V202-A206 WeakPolarHBondContact O-CB 3.47Å; V202-A206 PolarHBondContact O-N 3.41Å; R203-A206 PolarHBondContact O-N 3.21Å; A206-F208 VanDerWaalsContact C-N 3.34Å; A206-F208 PolarHBondContact O-N 3.46Å; A206-A209 PolarHBondContact O-N 3.33Å; A206-I210 WeakPolarHBondContact O-CD1 3.4Å; A206-I210 VanDerWaalsContact O-CG1 3.25Å; A206-I210 WeakPolarHBondContact O-CG1 3.32Å; A206-I210 PolarHBondContact O-N 3.05Å |
| 207 | L | 98.7 | Very high | 97.3 | Very high | 2 Ų | 2 | 33.4 Ų | 33.4 | 1% | 0.01 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.1 | -41.4 | 174 | 178.5 | 60.5 | 0 | 0 | 0 | 112.4 | L194 R203 V204 I210 S211 L233 L244 K247 S248 L251 | L194-L207 HydrophobicContact CD1-CB 4.02Å; L194-L207 HydrophobicContact CD2-CB 4.42Å; L194-L207 HydrophobicContact CD2-CD1 3.99Å; R203-L207 WeakPolarHBondContact O-CB 3.33Å; R203-L207 PolarHBondContact O-N 2.79Å; V204-L207 PolarHBondContact O-N 3.17Å; L207-I210 PolarHBondContact O-N 2.84Å; L207-S211 WeakPolarHBondContact O-CB 3.4Å; L207-S211 PolarHBondContact O-N 3.29Å; L207-L233 HydrophobicContact CD1-CD2 3.47Å; L207-L233 VanDerWaalsContact CD1-CD2 3.47Å; L207-L244 HydrophobicContact CB-CD1 4.44Å; L207-L244 HydrophobicContact CD2-CD1 3.86Å; L207-K247 HydrophobicContact CD2-CB 3.48Å; L207-K247 VanDerWaalsContact CD2-CB 3.48Å; L207-K247 HydrophobicContact CG-CB 4.34Å; L207-S248 VanDerWaalsContact CD2-OG 3.26Å; L207-S248 WeakPolarHBondContact CD2-OG 3.17Å; L207-L251 HydrophobicContact CD1-CD2 3.84Å |
| 208 | F | 98.5 | Very high | 96.9 | Very high | 51 Ų | 51 | 39 Ų | 39 | 22% | 0.224 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -58.6 | -48.6 | 174 | 168.6 | -111.3 | 0 | 0 | 0 | 111.5 | V204 K205 A206 I210 S211 C212 | V204-F208 PolarHBondContact O-N 3.29Å; K205-F208 WeakPolarHBondContact O-CB 3.37Å; K205-F208 PolarHBondContact O-N 3.04Å; A206-F208 VanDerWaalsContact C-N 3.34Å; A206-F208 PolarHBondContact O-N 3.46Å; F208-I210 PolarHBondContact O-N 3.05Å; F208-S211 WeakPolarHBondContact O-CB 3.18Å; F208-S211 PolarHBondContact O-N 3.26Å; F208-C212 PolarHBondContact O-N 3.28Å; F208-C212 PolarHBondContact O-SG 2.76Å |
| 209 | A | 98.8 | Very high | 96.8 | Very high | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -61.5 | -43.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | A164 I167 L190 K205 A206 S211 C212 L213 | A164-A209 WeakPolarHBondContact O-CB 3.44Å; I167-A209 HydrophobicContact CG2-CB 4.3Å; L190-A209 HydrophobicContact CD1-CB 3.73Å; L190-A209 HydrophobicContact CD2-CB 3.84Å; L190-A209 HydrophobicContact CG-CB 4.41Å; K205-A209 PolarHBondContact O-N 3.47Å; A206-A209 PolarHBondContact O-N 3.33Å; A209-S211 VanDerWaalsContact C-N 3.33Å; A209-S211 PolarHBondContact O-N 3.27Å; A209-C212 PolarHBondContact O-N 3.27Å; A209-L213 VanDerWaalsContact O-CG 3.29Å; A209-L213 WeakPolarHBondContact O-CG 3.24Å; A209-L213 PolarHBondContact O-N 3.25Å |
| 210 | I | 98.8 | Very high | 96.7 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -56.8 | -49.5 | 174.2 | -68.8 | 159.1 | 0 | 0 | 0 | 109.7 | L187 L190 L191 L194 A206 L207 F208 C212 L213 V214 F224 L251 | L187-I210 HydrophobicContact CD1-CB 4.48Å; L187-I210 HydrophobicContact CD1-CG1 4.12Å; L187-I210 HydrophobicContact CD1-CG2 4.18Å; L190-I210 HydrophobicContact CB-CD1 4.06Å; L190-I210 HydrophobicContact CB-CG1 3.71Å; L190-I210 HydrophobicContact CD1-CG1 4.45Å; L191-I210 HydrophobicContact CD2-CD1 3.88Å; L191-I210 HydrophobicContact CG-CD1 4.19Å; L194-I210 HydrophobicContact CB-CD1 4.11Å; L194-I210 HydrophobicContact CD2-CD1 3.65Å; A206-I210 WeakPolarHBondContact O-CD1 3.4Å; A206-I210 VanDerWaalsContact O-CG1 3.25Å; A206-I210 WeakPolarHBondContact O-CG1 3.32Å; A206-I210 PolarHBondContact O-N 3.05Å; L207-I210 PolarHBondContact O-N 2.84Å; F208-I210 PolarHBondContact O-N 3.05Å; I210-C212 VanDerWaalsContact C-N 3.3Å; I210-C212 PolarHBondContact O-N 3.27Å; I210-L213 PolarHBondContact O-N 3.29Å; I210-V214 HydrophobicContact CG2-CG1 4.16Å; I210-V214 HydrophobicContact CG2-CG2 4.43Å; I210-V214 WeakPolarHBondContact O-CG1 3.43Å; I210-V214 WeakPolarHBondContact O-CG2 3.44Å; I210-V214 PolarHBondContact O-N 2.98Å; I210-F224 HydrophobicContact CG2-CD2 3.97Å; I210-F224 HydrophobicContact CG2-CE2 3.93Å; I210-L251 HydrophobicContact CG2-CD2 4.23Å |
| 211 | S | 98 | Very high | 96.6 | Very high | 17 Ų | 17 | 30.9 Ų | 30.9 | 12% | 0.119 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -56.2 | -43.1 | 178.8 | -176.5 | 0 | 0 | 0 | 0 | 112.2 | L207 F208 A209 L213 R215 | L207-S211 WeakPolarHBondContact O-CB 3.4Å; L207-S211 PolarHBondContact O-N 3.29Å; F208-S211 WeakPolarHBondContact O-CB 3.18Å; F208-S211 PolarHBondContact O-N 3.26Å; A209-S211 VanDerWaalsContact C-N 3.33Å; A209-S211 PolarHBondContact O-N 3.27Å; S211-L213 VanDerWaalsContact C-N 3.27Å; S211-L213 PolarHBondContact O-N 3.46Å; S211-R215 VanDerWaalsContact O-CB 3.32Å; S211-R215 WeakPolarHBondContact O-CB 3.43Å; S211-R215 VanDerWaalsContact O-CG 3.24Å; S211-R215 WeakPolarHBondContact O-CG 3.44Å; S211-R215 PolarHBondContact O-N 2.98Å; S211-R215 WeakPolarHBondContact OG-CD 3.25Å |
| 212 | C | 97.8 | Very high | 96.3 | Very high | 9 Ų | 9 | 30.9 Ų | 30.9 | 6% | 0.061 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -67.9 | -24.8 | 176.3 | -67.2 | 0 | 0 | 0 | 0 | 113.2 | G168 Q178 F208 A209 I210 | G168-C212 PolarHBondContact O-SG 3.06Å; Q178-C212 PolarHBondContact NE2-O 3.07Å; F208-C212 PolarHBondContact O-N 3.28Å; F208-C212 PolarHBondContact O-SG 2.76Å; A209-C212 PolarHBondContact O-N 3.27Å; I210-C212 VanDerWaalsContact C-N 3.3Å; I210-C212 PolarHBondContact O-N 3.27Å |
| 213 | L | 98.1 | Very high | 96.2 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -90.6 | -20.3 | -178 | -70.6 | 171.6 | 0 | 0 | 0 | 114.1 | I167 Q178 V181 L182 L190 A209 I210 S211 G220 | I167-L213 HydrophobicContact CG2-CD1 4.4Å; Q178-L213 HydrophobicContact CB-CD2 4.27Å; Q178-L213 HydrophobicContact CG-CD2 4.33Å; V181-L213 HydrophobicContact CB-CD2 3.97Å; V181-L213 HydrophobicContact CG1-CD1 3.93Å; V181-L213 HydrophobicContact CG1-CD2 3.72Å; V181-L213 HydrophobicContact CG1-CG 4.47Å; L182-L213 HydrophobicContact CD2-CB 4.32Å; L182-L213 HydrophobicContact CG-CD2 4.42Å; L190-L213 HydrophobicContact CD1-CD1 3.59Å; A209-L213 VanDerWaalsContact O-CG 3.29Å; A209-L213 WeakPolarHBondContact O-CG 3.24Å; A209-L213 PolarHBondContact O-N 3.25Å; I210-L213 PolarHBondContact O-N 3.29Å; S211-L213 VanDerWaalsContact C-N 3.27Å; S211-L213 PolarHBondContact O-N 3.46Å; L213-G220 WeakPolarHBondContact O-CA 3.32Å |
| 214 | V | 96.1 | Very high | 96.2 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -111.5 | -22.4 | -174.2 | -53.8 | 0 | 0 | 0 | 0 | 113.8 | L187 I210 F224 L251 L255 | L187-V214 HydrophobicContact CD1-CG1 4.11Å; I210-V214 HydrophobicContact CG2-CG1 4.16Å; I210-V214 HydrophobicContact CG2-CG2 4.43Å; I210-V214 WeakPolarHBondContact O-CG1 3.43Å; I210-V214 WeakPolarHBondContact O-CG2 3.44Å; I210-V214 PolarHBondContact O-N 2.98Å; V214-F224 HydrophobicContact CG1-CB 3.75Å; V214-F224 HydrophobicContact CG1-CD2 4.05Å; V214-F224 HydrophobicContact CG1-CG 4.09Å; V214-L251 HydrophobicContact CG2-CD1 3.88Å; V214-L251 HydrophobicContact CG2-CD2 4.45Å; V214-L255 HydrophobicContact CG2-CD1 4.34Å; V214-L255 HydrophobicContact CG2-CD2 4.12Å |
| 215 | R | 94.3 | Very high | 95.9 | Very high | 66 Ų | 66 | 33.7 Ų | 33.7 | 25% | 0.249 | 17% | 0.167 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.9 | 133.6 | 175.6 | -68.7 | 175.1 | 70 | -121.8 | 0.4 | 109.1 | S211 Q217 L251 N254 | S211-R215 VanDerWaalsContact O-CB 3.32Å; S211-R215 WeakPolarHBondContact O-CB 3.43Å; S211-R215 VanDerWaalsContact O-CG 3.24Å; S211-R215 WeakPolarHBondContact O-CG 3.44Å; S211-R215 PolarHBondContact O-N 2.98Å; S211-R215 WeakPolarHBondContact OG-CD 3.25Å; R215-Q217 PolarHBondContact O-N 3.35Å; R215-L251 HydrophobicContact CG-CD1 3.85Å; R215-N254 PolarHBondContact NE-OD1 3.01Å; R215-N254 PolarHBondContact NH2-OD1 2.94Å |
| 216 | E | 89.4 | Confident | 95.7 | Very high | 146 Ų | 146 | 39.8 Ų | 39.8 | 68% | 0.682 | 19% | 0.189 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 55.3 | 24.4 | 178.9 | -59.5 | 172.7 | -141.1 | 0 | 0 | 113.4 | ||
| 217 | Q | 92.4 | Very high | 95.6 | Very high | 18 Ų | 18 | 41.7 Ų | 41.7 | 8% | 0.084 | 20% | 0.199 | C | C | . | . | trans | -141.4 | 95.4 | -179.7 | 177.4 | 48.9 | -65.4 | 0 | 0 | 110.4 | Q178 L182 R215 A219 G220 L221 | Q178-Q217 HydrophobicContact CB-CG 4Å; L182-Q217 HydrophobicContact CD1-CG 3.97Å; R215-Q217 PolarHBondContact O-N 3.35Å; Q217-A219 VanDerWaalsContact C-N 3.35Å; Q217-A219 PolarHBondContact O-N 3.25Å; Q217-G220 WeakPolarHBondContact O-CA 3.42Å; Q217-G220 PolarHBondContact O-N 2.91Å; Q217-L221 PolarHBondContact O-N 3.33Å | ||
| 218 | E | 91.4 | Very high | 95.4 | Very high | 137 Ų | 137 | 45.3 Ų | 45.3 | 64% | 0.64 | 22% | 0.218 | S | C | * | . | H | α-helix | trans | -57.8 | -43.7 | -174.3 | -172.8 | -177.7 | 173.3 | 0 | 0 | 112.4 | G220 L221 L222 | E218-G220 PolarHBondContact O-N 3.39Å; E218-L221 PolarHBondContact O-N 3.46Å; E218-L222 HydrophobicContact CG-CD1 4.23Å; E218-L222 HydrophobicContact CG-CG 4.45Å; E218-L222 WeakPolarHBondContact O-CG 3.41Å; E218-L222 PolarHBondContact O-N 2.63Å |
| 219 | A | 93.2 | Very high | 95.3 | Very high | 48 Ų | 48 | 42.9 Ų | 42.9 | 40% | 0.397 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -61.3 | -36.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | L182 Q217 Q223 | L182-A219 HydrophobicContact CD1-CB 4.49Å; Q217-A219 VanDerWaalsContact C-N 3.35Å; Q217-A219 PolarHBondContact O-N 3.25Å; A219-Q223 WeakPolarHBondContact O-CB 3.31Å; A219-Q223 PolarHBondContact O-N 2.84Å; A219-Q223 VanDerWaalsContact O-N 3.09Å |
| 220 | G | 96.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -69.5 | -45.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L182 L213 Q217 E218 Q223 F224 | L182-G220 VanDerWaalsContact CD1-CA 3.43Å; L213-G220 WeakPolarHBondContact O-CA 3.32Å; Q217-G220 WeakPolarHBondContact O-CA 3.42Å; Q217-G220 PolarHBondContact O-N 2.91Å; E218-G220 PolarHBondContact O-N 3.39Å; G220-Q223 PolarHBondContact O-N 3.39Å; G220-F224 WeakPolarHBondContact O-CB 3.48Å; G220-F224 PolarHBondContact O-N 2.66Å |
| 221 | L | 94.2 | Very high | 94.8 | Very high | 4 Ų | 4 | 44.5 Ų | 44.5 | 2% | 0.021 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.2 | -46.8 | 174.8 | 179.6 | 56.8 | 0 | 0 | 0 | 112 | Q217 E218 Q223 F224 L225 L255 H259 | Q217-L221 PolarHBondContact O-N 3.33Å; E218-L221 PolarHBondContact O-N 3.46Å; L221-Q223 VanDerWaalsContact C-N 3.26Å; L221-Q223 PolarHBondContact O-N 3.37Å; L221-F224 HydrophobicContact CD1-CD1 4.21Å; L221-F224 WeakPolarHBondContact O-CA 3.41Å; L221-F224 VanDerWaalsContact O-CB 3.31Å; L221-F224 WeakPolarHBondContact O-CB 3.47Å; L221-F224 PolarHBondContact O-N 3.19Å; L221-L225 HydrophobicContact CD1-CG 4.35Å; L221-L225 HydrophobicContact CG-CD1 4.38Å; L221-L225 WeakPolarHBondContact O-CG 3.36Å; L221-L225 PolarHBondContact O-N 3.47Å; L221-L255 HydrophobicContact CD1-CD1 4.21Å; L221-L255 HydrophobicContact CD1-CD2 3.84Å; L221-L255 HydrophobicContact CD2-CD2 4.5Å; L221-H259 HydrophobicContact CD2-CB 3.93Å; L221-H259 WeakPolarHBondContact CD2-CD2 3.47Å; L221-H259 WeakPolarHBondContact CD2-NE2 3.4Å |
| 222 | L | 93.4 | Very high | 94.7 | Very high | 69 Ų | 69 | 44.2 Ų | 44.2 | 36% | 0.361 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -59.8 | -38.9 | 176.8 | -70.2 | 175.8 | 0 | 0 | 0 | 111.8 | E218 L225 R226 | E218-L222 HydrophobicContact CG-CD1 4.23Å; E218-L222 HydrophobicContact CG-CG 4.45Å; E218-L222 WeakPolarHBondContact O-CG 3.41Å; E218-L222 PolarHBondContact O-N 2.63Å; L222-L225 HydrophobicContact CD2-CD1 4.44Å; L222-R226 WeakPolarHBondContact O-CG 3.48Å; L222-R226 PolarHBondContact O-N 3.26Å; L222-R226 VanDerWaalsContact O-N 3.12Å |
| 223 | Q | 96.9 | Very high | 94.6 | Very high | 40 Ų | 40 | 43.8 Ų | 43.8 | 19% | 0.187 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -67.7 | -39.1 | 174.4 | -164.8 | -175.6 | 57.3 | 0 | 0 | 111.8 | L182 L187 A219 G220 L221 L225 R226 L227 | L182-Q223 PolarHBondContact O-NE2 3.02Å; L187-Q223 HydrophobicContact CD2-CB 3.73Å; L187-Q223 HydrophobicContact CD2-CG 3.86Å; A219-Q223 WeakPolarHBondContact O-CB 3.31Å; A219-Q223 PolarHBondContact O-N 2.84Å; A219-Q223 VanDerWaalsContact O-N 3.09Å; G220-Q223 PolarHBondContact O-N 3.39Å; L221-Q223 VanDerWaalsContact C-N 3.26Å; L221-Q223 PolarHBondContact O-N 3.37Å; Q223-L225 PolarHBondContact O-N 3.3Å; Q223-R226 PolarHBondContact O-N 3.29Å; Q223-L227 HydrophobicContact CG-CD1 4.01Å; Q223-L227 WeakPolarHBondContact O-CB 3.47Å; Q223-L227 VanDerWaalsContact O-CG 3.25Å; Q223-L227 WeakPolarHBondContact O-CG 3.47Å; Q223-L227 PolarHBondContact O-N 3.05Å; Q223-L227 VanDerWaalsContact O-N 3.1Å |
| 224 | F | 96.9 | Very high | 94.4 | Very high | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59.5 | -44.7 | 175.9 | 175.4 | -93.2 | 0 | 0 | 0 | 111.6 | L187 L191 I210 V214 G220 L221 L227 D228 G229 F230 L233 L255 | L187-F224 HydrophobicContact CD2-CB 3.96Å; L191-F224 HydrophobicContact CD1-CD2 4.49Å; L191-F224 HydrophobicContact CD2-CD2 4.16Å; L191-F224 HydrophobicContact CD2-CE2 3.92Å; I210-F224 HydrophobicContact CG2-CD2 3.97Å; I210-F224 HydrophobicContact CG2-CE2 3.93Å; V214-F224 HydrophobicContact CG1-CB 3.75Å; V214-F224 HydrophobicContact CG1-CD2 4.05Å; V214-F224 HydrophobicContact CG1-CG 4.09Å; G220-F224 WeakPolarHBondContact O-CB 3.48Å; G220-F224 PolarHBondContact O-N 2.66Å; L221-F224 HydrophobicContact CD1-CD1 4.21Å; L221-F224 WeakPolarHBondContact O-CA 3.41Å; L221-F224 VanDerWaalsContact O-CB 3.31Å; L221-F224 WeakPolarHBondContact O-CB 3.47Å; L221-F224 PolarHBondContact O-N 3.19Å; F224-L227 CarbonylContact O-C 3.58Å; F224-L227 PolarHBondContact O-N 2.75Å; F224-D228 PolarHBondContact O-N 3.18Å; F224-G229 VanDerWaalsContact CE1-C 3.47Å; F224-G229 VanDerWaalsContact CE2-CA 3.48Å; F224-G229 VanDerWaalsContact CZ-CA 3.41Å; F224-G229 WeakPolarHBondContact CZ-O 3.48Å; F224-G229 WeakPolarHBondContact O-CA 3.33Å; F224-G229 PolarHBondContact O-N 3.22Å; F224-F230 AromaticContact CE1-CD1 3.86Å; F224-F230 HydrophobicContact CE1-CD1 3.86Å; F224-F230 HydrophobicContact CE1-CD2 4.22Å; F224-F230 HydrophobicContact CE1-CE1 4.05Å; F224-F230 HydrophobicContact CE1-CE2 4.44Å; F224-F230 AromaticContact CE1-CG 3.93Å; F224-F230 HydrophobicContact CE1-CG 3.93Å; F224-F230 HydrophobicContact CE1-CZ 4.33Å; F224-F230 HydrophobicContact CZ-CD1 4.39Å; F224-L233 HydrophobicContact CE1-CD1 4.36Å; F224-L233 HydrophobicContact CE2-CD1 4.27Å; F224-L233 HydrophobicContact CE2-CG 4.3Å; F224-L233 HydrophobicContact CZ-CD1 3.51Å; F224-L233 HydrophobicContact CZ-CG 3.8Å; F224-L255 HydrophobicContact CD1-CD1 4.5Å; F224-L255 HydrophobicContact CE1-CD1 4.08Å; F224-L255 HydrophobicContact CZ-CD1 4.47Å |
| 225 | L | 93.1 | Very high | 94.3 | Very high | 48 Ų | 48 | 49 Ų | 49 | 25% | 0.251 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -62.6 | -47.9 | 175.9 | -64.1 | 170 | 0 | 0 | 0 | 112.1 | L221 L222 Q223 L227 D228 F230 H262 | L221-L225 HydrophobicContact CD1-CG 4.35Å; L221-L225 HydrophobicContact CG-CD1 4.38Å; L221-L225 WeakPolarHBondContact O-CG 3.36Å; L221-L225 PolarHBondContact O-N 3.47Å; L222-L225 HydrophobicContact CD2-CD1 4.44Å; Q223-L225 PolarHBondContact O-N 3.3Å; L225-L227 PolarHBondContact O-N 3.46Å; L225-L227 VanDerWaalsContact O-N 3.13Å; L225-D228 PolarHBondContact O-N 2.98Å; L225-F230 HydrophobicContact CD2-CD2 3.6Å; L225-F230 HydrophobicContact CD2-CE2 3.25Å; L225-F230 HydrophobicContact CD2-CZ 4.28Å; L225-H262 WeakPolarHBondContact CD1-CE1 3.25Å; L225-H262 VanDerWaalsContact CD1-NE2 3.34Å; L225-H262 WeakPolarHBondContact CD1-NE2 3.36Å |
| 226 | R | 94.9 | Very high | 94.3 | Very high | 180 Ų | 180 | 46 Ų | 46 | 68% | 0.679 | 22% | 0.222 | S | C | * | . | H | α-helix | trans | -60.2 | -24 | 177.6 | -74.5 | -171.3 | -60.3 | -106.1 | 0.2 | 113.2 | L222 Q223 | L222-R226 WeakPolarHBondContact O-CG 3.48Å; L222-R226 PolarHBondContact O-N 3.26Å; L222-R226 VanDerWaalsContact O-N 3.12Å; Q223-R226 PolarHBondContact O-N 3.29Å |
| 227 | L | 96.8 | Very high | 94.5 | Very high | 41 Ų | 41 | 39 Ų | 39 | 22% | 0.215 | 19% | 0.19 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -96.3 | 13.9 | 178.6 | -65.9 | 172.6 | 0 | 0 | 0 | 112.9 | L187 R188 L191 Q223 F224 L225 G229 | L187-L227 HydrophobicContact CB-CD1 4.23Å; L187-L227 HydrophobicContact CD2-CD1 4.2Å; L187-L227 HydrophobicContact CG-CD1 4.14Å; R188-L227 HydrophobicContact CB-CD1 3.97Å; R188-L227 HydrophobicContact CB-CD2 4.27Å; R188-L227 HydrophobicContact CG-CD2 4.31Å; L191-L227 HydrophobicContact CD1-CB 3.55Å; L191-L227 HydrophobicContact CD1-CD1 3.94Å; L191-L227 HydrophobicContact CD1-CG 4.41Å; Q223-L227 HydrophobicContact CG-CD1 4.01Å; Q223-L227 WeakPolarHBondContact O-CB 3.47Å; Q223-L227 VanDerWaalsContact O-CG 3.25Å; Q223-L227 WeakPolarHBondContact O-CG 3.47Å; Q223-L227 PolarHBondContact O-N 3.05Å; Q223-L227 VanDerWaalsContact O-N 3.1Å; F224-L227 CarbonylContact O-C 3.58Å; F224-L227 PolarHBondContact O-N 2.75Å; L225-L227 PolarHBondContact O-N 3.46Å; L225-L227 VanDerWaalsContact O-N 3.13Å; L227-G229 PolarHBondContact O-N 3.46Å |
| 228 | D | 94.1 | Very high | 94.5 | Very high | 78 Ų | 78 | 42.1 Ų | 42.1 | 42% | 0.417 | 20% | 0.204 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.2 | 39.1 | -178.5 | -170.5 | 32.8 | 0 | 0 | 0 | 112.4 | F224 L225 F230 S231 V232 | F224-D228 PolarHBondContact O-N 3.18Å; L225-D228 PolarHBondContact O-N 2.98Å; D228-F230 VanDerWaalsContact C-N 3.27Å; D228-F230 PolarHBondContact O-N 2.87Å; D228-S231 VanDerWaalsContact CG-CB 3.47Å; D228-S231 PolarHBondContact O-N 3.23Å; D228-S231 VanDerWaalsContact OD1-CB 3.31Å; D228-S231 WeakPolarHBondContact OD1-CB 3.47Å; D228-S231 PolarHBondContact OD1-OG 3.35Å; D228-S231 WeakPolarHBondContact OD2-CB 3.38Å; D228-S231 PolarHBondContact OD2-OG 3.41Å; D228-S231 VanDerWaalsContact OD2-OG 3.1Å; D228-V232 PolarHBondContact O-N 2.99Å |
| 229 | G | 96.2 | Very high | 94.5 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.1 | -31.8 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | F224 L227 V232 L233 | F224-G229 VanDerWaalsContact CE1-C 3.47Å; F224-G229 VanDerWaalsContact CE2-CA 3.48Å; F224-G229 VanDerWaalsContact CZ-CA 3.41Å; F224-G229 WeakPolarHBondContact CZ-O 3.48Å; F224-G229 WeakPolarHBondContact O-CA 3.33Å; F224-G229 PolarHBondContact O-N 3.22Å; L227-G229 PolarHBondContact O-N 3.46Å; G229-V232 WeakPolarHBondContact O-CB 3.41Å; G229-V232 PolarHBondContact O-N 3.29Å; G229-L233 PolarHBondContact O-N 3.41Å |
| 230 | F | 93.9 | Very high | 94.3 | Very high | 9 Ų | 9 | 44.1 Ų | 44.1 | 4% | 0.039 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -64.5 | -40.7 | 177 | -78.1 | -57.1 | 0 | 0 | 0 | 112.3 | F224 L225 D228 V232 L233 M234 L252 L255 L266 M271 | F224-F230 AromaticContact CE1-CD1 3.86Å; F224-F230 HydrophobicContact CE1-CD1 3.86Å; F224-F230 HydrophobicContact CE1-CD2 4.22Å; F224-F230 HydrophobicContact CE1-CE1 4.05Å; F224-F230 HydrophobicContact CE1-CE2 4.44Å; F224-F230 AromaticContact CE1-CG 3.93Å; F224-F230 HydrophobicContact CE1-CG 3.93Å; F224-F230 HydrophobicContact CE1-CZ 4.33Å; F224-F230 HydrophobicContact CZ-CD1 4.39Å; L225-F230 HydrophobicContact CD2-CD2 3.6Å; L225-F230 HydrophobicContact CD2-CE2 3.25Å; L225-F230 HydrophobicContact CD2-CZ 4.28Å; D228-F230 VanDerWaalsContact C-N 3.27Å; D228-F230 PolarHBondContact O-N 2.87Å; F230-V232 VanDerWaalsContact C-N 3.26Å; F230-V232 PolarHBondContact O-N 3.47Å; F230-L233 HydrophobicContact CD1-CD1 4.39Å; F230-L233 PolarHBondContact O-N 3.01Å; F230-L233 VanDerWaalsContact O-N 3.14Å; F230-M234 WeakPolarHBondContact O-CG 3.45Å; F230-M234 PolarHBondContact O-N 2.88Å; F230-L252 HydrophobicContact CD1-CD1 3.75Å; F230-L252 HydrophobicContact CE1-CD1 3.57Å; F230-L255 HydrophobicContact CE1-CB 4.31Å; F230-L255 HydrophobicContact CE1-CD1 3.91Å; F230-L255 HydrophobicContact CZ-CB 4.32Å; F230-L255 HydrophobicContact CZ-CD1 4.22Å; F230-L266 HydrophobicContact CB-CD2 3.81Å; F230-L266 HydrophobicContact CD1-CD2 3.95Å; F230-L266 HydrophobicContact CD2-CD1 4.34Å; F230-L266 HydrophobicContact CD2-CD2 3.29Å; F230-L266 HydrophobicContact CD2-CG 4.11Å; F230-L266 HydrophobicContact CE1-CD1 4.14Å; F230-L266 HydrophobicContact CE1-CD2 4.34Å; F230-L266 HydrophobicContact CE2-CD1 3.85Å; F230-L266 HydrophobicContact CE2-CD2 3.67Å; F230-L266 HydrophobicContact CE2-CG 3.98Å; F230-L266 HydrophobicContact CG-CD2 3.44Å; F230-L266 VanDerWaalsContact CG-CD2 3.44Å; F230-L266 HydrophobicContact CZ-CD1 3.78Å; F230-L266 HydrophobicContact CZ-CD2 4.21Å; F230-L266 HydrophobicContact CZ-CG 4.4Å; F230-M271 HydrophobicContact CB-CE 4.42Å |
| 231 | S | 93.4 | Very high | 94.1 | Very high | 25 Ų | 25 | 45.6 Ų | 45.6 | 18% | 0.175 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -62.5 | -36.5 | 175.2 | -60.6 | 0 | 0 | 0 | 0 | 111.8 | D228 M234 R235 M269 | D228-S231 VanDerWaalsContact CG-CB 3.47Å; D228-S231 PolarHBondContact O-N 3.23Å; D228-S231 VanDerWaalsContact OD1-CB 3.31Å; D228-S231 WeakPolarHBondContact OD1-CB 3.47Å; D228-S231 PolarHBondContact OD1-OG 3.35Å; D228-S231 WeakPolarHBondContact OD2-CB 3.38Å; D228-S231 PolarHBondContact OD2-OG 3.41Å; D228-S231 VanDerWaalsContact OD2-OG 3.1Å; S231-M234 PolarHBondContact O-N 3.41Å; S231-R235 WeakPolarHBondContact O-CG 3.45Å; S231-R235 PolarHBondContact O-N 2.99Å; S231-R235 VanDerWaalsContact O-N 3.11Å; S231-R235 PolarHBondContact O-NH1 3.44Å; S231-M269 VanDerWaalsContact OG-CE 3.25Å; S231-M269 WeakPolarHBondContact OG-CE 3.49Å |
| 232 | V | 96.6 | Very high | 94 | Very high | 10 Ų | 10 | 50 Ų | 50 | 6% | 0.061 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -64.9 | -44.3 | 173 | 179.5 | 0 | 0 | 0 | 0 | 111.1 | L191 L194 D195 D228 G229 F230 M234 R235 A236 | L191-V232 HydrophobicContact CD2-CB 4.04Å; L191-V232 HydrophobicContact CD2-CG1 4.04Å; L191-V232 HydrophobicContact CD2-CG2 4.22Å; L194-V232 HydrophobicContact CB-CG1 4.22Å; L194-V232 HydrophobicContact CD2-CG1 3.72Å; L194-V232 HydrophobicContact CG-CG1 3.76Å; D195-V232 HydrophobicContact CB-CG1 3.88Å; D228-V232 PolarHBondContact O-N 2.99Å; G229-V232 WeakPolarHBondContact O-CB 3.41Å; G229-V232 PolarHBondContact O-N 3.29Å; F230-V232 VanDerWaalsContact C-N 3.26Å; F230-V232 PolarHBondContact O-N 3.47Å; V232-M234 VanDerWaalsContact C-N 3.33Å; V232-M234 PolarHBondContact O-N 2.84Å; V232-R235 PolarHBondContact O-N 3.31Å; V232-A236 WeakPolarHBondContact O-CB 3.18Å; V232-A236 PolarHBondContact O-N 3.41Å |
| 233 | L | 95.6 | Very high | 94 | Very high | 1 Ų | 1 | 52.7 Ų | 52.7 | 1% | 0.005 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -61.8 | -40.2 | 175.6 | -72.8 | -177.2 | 0 | 0 | 0 | 112.4 | L194 L207 F224 G229 F230 A236 M237 L251 | L194-L233 HydrophobicContact CD2-CD2 4.17Å; L207-L233 HydrophobicContact CD1-CD2 3.47Å; L207-L233 VanDerWaalsContact CD1-CD2 3.47Å; F224-L233 HydrophobicContact CE1-CD1 4.36Å; F224-L233 HydrophobicContact CE2-CD1 4.27Å; F224-L233 HydrophobicContact CE2-CG 4.3Å; F224-L233 HydrophobicContact CZ-CD1 3.51Å; F224-L233 HydrophobicContact CZ-CG 3.8Å; G229-L233 PolarHBondContact O-N 3.41Å; F230-L233 HydrophobicContact CD1-CD1 4.39Å; F230-L233 PolarHBondContact O-N 3.01Å; F230-L233 VanDerWaalsContact O-N 3.14Å; L233-A236 WeakPolarHBondContact O-CB 3.2Å; L233-A236 PolarHBondContact O-N 2.72Å; L233-M237 WeakPolarHBondContact O-CG 3.47Å; L233-M237 PolarHBondContact O-N 3.06Å; L233-L251 HydrophobicContact CD1-CD2 3.96Å; L233-L251 HydrophobicContact CD1-CG 4.08Å; L233-L251 HydrophobicContact CD2-CD2 3.96Å |
| 234 | M | 92.4 | Very high | 93.9 | Very high | 17 Ų | 17 | 50.9 Ų | 50.9 | 8% | 0.084 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60.1 | -48.6 | 176.8 | -73.5 | -53.5 | -54.7 | 0 | 0 | 111.8 | F230 S231 V232 A236 M237 Q238 L252 M271 Q274 L278 | F230-M234 WeakPolarHBondContact O-CG 3.45Å; F230-M234 PolarHBondContact O-N 2.88Å; S231-M234 PolarHBondContact O-N 3.41Å; V232-M234 VanDerWaalsContact C-N 3.33Å; V232-M234 PolarHBondContact O-N 2.84Å; M234-A236 VanDerWaalsContact C-N 3.27Å; M234-A236 PolarHBondContact O-N 3.04Å; M234-M237 HydrophobicContact CE-CE 3.97Å; M234-M237 HydrophobicContact CG-CE 4.42Å; M234-M237 PolarHBondContact O-N 3.3Å; M234-M237 HydrophobicContact SD-CE 3.16Å; M234-M237 WeakPolarHBondContact SD-CE 3.4Å; M234-Q238 WeakPolarHBondContact O-CG 3.41Å; M234-Q238 PolarHBondContact O-N 3.05Å; M234-L252 HydrophobicContact SD-CD2 4.44Å; M234-M271 HydrophobicContact CE-SD 4.26Å; M234-M271 HydrophobicContact CG-CE 3.79Å; M234-M271 HydrophobicContact CG-SD 4.16Å; M234-M271 HydrophobicContact SD-CE 3.65Å; M234-M271 HydrophobicContact SD-SD 3.27Å; M234-Q274 HydrophobicContact CE-CB 3.29Å; M234-Q274 HydrophobicContact CE-CG 4.05Å; M234-L278 HydrophobicContact CE-CD1 4.01Å |
| 235 | R | 94 | Very high | 93.8 | Very high | 92 Ų | 92 | 51.8 Ų | 51.8 | 35% | 0.347 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.9 | -36.6 | 176.1 | -70.7 | -170.2 | -61.5 | -86.8 | 9 | 112 | D195 S231 V232 Q238 Q239 | D195-R235 VanDerWaalsContact CG-NH2 3.25Å; D195-R235 IonicContact OD1-CZ 2.66Å; D195-R235 IonicContact OD1-NE 3.99Å; D195-R235 PolarHBondContact OD1-NE 3.19Å; D195-R235 IonicContact OD1-NH2 3.19Å; D195-R235 PolarHBondContact OD1-NH2 2.89Å; D195-R235 VanDerWaalsContact OD1-NH2 3.08Å; D195-R235 IonicContact OD2-CZ 3.1Å; D195-R235 IonicContact OD2-NE 3.34Å; D195-R235 IonicContact OD2-NH2 3.25Å; D195-R235 PolarHBondContact OD2-NH2 3.48Å; S231-R235 WeakPolarHBondContact O-CG 3.45Å; S231-R235 PolarHBondContact O-N 2.99Å; S231-R235 VanDerWaalsContact O-N 3.11Å; S231-R235 PolarHBondContact O-NH1 3.44Å; V232-R235 PolarHBondContact O-N 3.31Å; R235-Q238 PolarHBondContact O-N 3.18Å; R235-Q239 WeakPolarHBondContact O-CG 3.35Å; R235-Q239 PolarHBondContact O-NE2 3.02Å |
| 236 | A | 95.7 | Very high | 93.9 | Very high | 2 Ų | 2 | 51.5 Ų | 51.5 | 2% | 0.017 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.8 | -39.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | L194 V232 L233 M234 Q238 Q239 L244 S248 | L194-A236 HydrophobicContact CD1-CB 3.98Å; L194-A236 HydrophobicContact CG-CB 4.44Å; V232-A236 WeakPolarHBondContact O-CB 3.18Å; V232-A236 PolarHBondContact O-N 3.41Å; L233-A236 WeakPolarHBondContact O-CB 3.2Å; L233-A236 PolarHBondContact O-N 2.72Å; M234-A236 VanDerWaalsContact C-N 3.27Å; M234-A236 PolarHBondContact O-N 3.04Å; A236-Q238 PolarHBondContact O-N 2.95Å; A236-Q239 WeakPolarHBondContact O-CB 3.29Å; A236-Q239 WeakPolarHBondContact O-CG 3.48Å; A236-Q239 PolarHBondContact O-N 3.46Å; A236-L244 HydrophobicContact CB-CD1 4.48Å; A236-L244 HydrophobicContact CB-CD2 4.05Å; A236-L244 HydrophobicContact CB-CG 4.02Å; A236-S248 WeakPolarHBondContact CB-OG 3.32Å |
| 237 | M | 93.4 | Very high | 94 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -67.2 | -22.8 | 174 | -70.4 | -169.5 | -69.2 | 0 | 0 | 113.9 | L233 M234 Q239 K245 A249 L252 L275 L278 F286 | L233-M237 WeakPolarHBondContact O-CG 3.47Å; L233-M237 PolarHBondContact O-N 3.06Å; M234-M237 HydrophobicContact CE-CE 3.97Å; M234-M237 HydrophobicContact CG-CE 4.42Å; M234-M237 PolarHBondContact O-N 3.3Å; M234-M237 HydrophobicContact SD-CE 3.16Å; M234-M237 WeakPolarHBondContact SD-CE 3.4Å; M237-Q239 VanDerWaalsContact C-N 3.33Å; M237-K245 WeakPolarHBondContact O-CE 3.32Å; M237-K245 WeakPolarHBondContact O-CG 3.35Å; M237-A249 WeakPolarHBondContact SD-CA 3.46Å; M237-A249 HydrophobicContact SD-CB 3.65Å; M237-A249 PolarHBondContact SD-N 3.46Å; M237-L252 HydrophobicContact CE-CD2 3.66Å; M237-L252 HydrophobicContact SD-CD2 4.42Å; M237-L275 HydrophobicContact CE-CD2 4.42Å; M237-L278 HydrophobicContact CB-CD1 4.19Å; M237-L278 HydrophobicContact CE-CD1 4.28Å; M237-L278 HydrophobicContact SD-CD1 4.46Å; M237-F286 HydrophobicContact CB-CE2 3.94Å; M237-F286 HydrophobicContact CB-CZ 4.02Å; M237-F286 HydrophobicContact CG-CE2 3.81Å; M237-F286 HydrophobicContact CG-CZ 4.33Å; M237-F286 HydrophobicContact SD-CE2 3.8Å; M237-F286 HydrophobicContact SD-CZ 4.23Å |
| 238 | Q | 92 | Very high | 94 | Very high | 84 Ų | 84 | 45 Ų | 45 | 39% | 0.393 | 21% | 0.214 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -87.6 | -0.2 | 178.8 | -68.8 | 171.2 | -9.9 | 0 | 0 | 113.4 | M234 R235 A236 L278 | M234-Q238 WeakPolarHBondContact O-CG 3.41Å; M234-Q238 PolarHBondContact O-N 3.05Å; R235-Q238 PolarHBondContact O-N 3.18Å; A236-Q238 PolarHBondContact O-N 2.95Å; Q238-L278 HydrophobicContact CG-CD2 4.11Å |
| 239 | Q | 91.5 | Very high | 94 | Very high | 65 Ų | 65 | 41.3 Ų | 41.3 | 30% | 0.304 | 19% | 0.194 | S | C | . | . | S | Bend | trans | -79.6 | 163 | 177.7 | -55.4 | -60.9 | -73.2 | 0 | 0 | 112.2 | R235 A236 M237 V241 L244 K245 | R235-Q239 WeakPolarHBondContact O-CG 3.35Å; R235-Q239 PolarHBondContact O-NE2 3.02Å; A236-Q239 WeakPolarHBondContact O-CB 3.29Å; A236-Q239 WeakPolarHBondContact O-CG 3.48Å; A236-Q239 PolarHBondContact O-N 3.46Å; M237-Q239 VanDerWaalsContact C-N 3.33Å; Q239-V241 PolarHBondContact O-N 2.94Å; Q239-L244 HydrophobicContact CB-CD2 4.16Å; Q239-L244 HydrophobicContact CG-CD2 3.94Å; Q239-K245 WeakPolarHBondContact O-CD 3.41Å; Q239-K245 WeakPolarHBondContact O-CE 3.46Å; Q239-K245 WeakPolarHBondContact O-CG 3.48Å; Q239-K245 PolarHBondContact O-NZ 3Å |
| 240 | Q | 90 | Very high | 94 | Very high | 161 Ų | 161 | 45 Ų | 45 | 75% | 0.752 | 21% | 0.21 | S | C | * | . | S | Bend | trans | -80.7 | 0.6 | 177 | -60.3 | -57.9 | -20.2 | 0 | 0 | 114.2 | Q242 | Q240-Q242 PolarHBondContact O-N 2.98Š|
| 241 | V | 91.6 | Very high | 94.2 | Very high | 31 Ų | 31 | 44.6 Ų | 44.6 | 19% | 0.188 | 21% | 0.209 | C | C | . | . | trans | -87.7 | 101.7 | -177.1 | -175.2 | 0 | 0 | 0 | 0 | 110.1 | D200 Q239 K243 L244 K245 | D200-V241 HydrophobicContact CB-CG1 4.24Å; D200-V241 HydrophobicContact CB-CG2 4.27Å; D200-V241 VanDerWaalsContact CG-CG2 3.41Å; D200-V241 WeakPolarHBondContact OD1-CG2 3.26Å; D200-V241 WeakPolarHBondContact OD2-CG2 3.1Å; Q239-V241 PolarHBondContact O-N 2.94Å; V241-K243 VanDerWaalsContact C-N 3.33Å; V241-K243 PolarHBondContact O-N 2.92Å; V241-L244 HydrophobicContact CB-CB 3.88Å; V241-L244 HydrophobicContact CG1-CB 3.94Å; V241-L244 WeakPolarHBondContact O-CA 3.48Å; V241-L244 VanDerWaalsContact O-CB 3.27Å; V241-L244 WeakPolarHBondContact O-CB 3.47Å; V241-L244 PolarHBondContact O-N 3.27Å; V241-K245 PolarHBondContact O-N 3.35Å | ||
| 242 | Q | 92.3 | Very high | 94.3 | Very high | 98 Ų | 98 | 43.5 Ų | 43.5 | 46% | 0.458 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -53.1 | -45 | -174 | -68.2 | -61.3 | -20.9 | 0 | 0 | 114 | Q240 L244 K245 V246 | Q240-Q242 PolarHBondContact O-N 2.98Å; Q242-L244 PolarHBondContact O-N 3.42Å; Q242-K245 PolarHBondContact O-N 3.02Å; Q242-V246 WeakPolarHBondContact O-CG2 3.37Å; Q242-V246 PolarHBondContact O-N 3.23Å |
| 243 | K | 93.9 | Very high | 94.2 | Very high | 125 Ų | 125 | 44.3 Ų | 44.3 | 54% | 0.543 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -61.3 | -32.7 | 178.6 | -170.9 | 168.8 | -175.7 | 173.9 | 0 | 112.6 | V204 V241 K247 | V204-K243 HydrophobicContact CG1-CD 3.82Å; V204-K243 HydrophobicContact CG1-CG 3.98Å; V204-K243 HydrophobicContact CG2-CB 4.33Å; V204-K243 HydrophobicContact CG2-CD 4.42Å; V204-K243 HydrophobicContact CG2-CG 4.21Å; V241-K243 VanDerWaalsContact C-N 3.33Å; V241-K243 PolarHBondContact O-N 2.92Å; K243-K247 HydrophobicContact CG-CD 4.23Å; K243-K247 WeakPolarHBondContact O-CB 3.32Å; K243-K247 VanDerWaalsContact O-CG 3.31Å; K243-K247 WeakPolarHBondContact O-CG 3.4Å; K243-K247 PolarHBondContact O-N 2.9Å |
| 244 | L | 94.3 | Very high | 94.2 | Very high | 1 Ų | 1 | 46.5 Ų | 46.5 | 1% | 0.005 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -72.2 | -46.8 | 176.7 | -166 | 65.8 | 0 | 0 | 0 | 110.3 | L194 R203 V204 L207 A236 Q239 V241 Q242 K247 S248 | L194-L244 HydrophobicContact CD1-CD1 3.62Å; R203-L244 HydrophobicContact CB-CD1 4.29Å; V204-L244 HydrophobicContact CG2-CB 4.43Å; V204-L244 HydrophobicContact CG2-CD1 4.22Å; L207-L244 HydrophobicContact CB-CD1 4.44Å; L207-L244 HydrophobicContact CD2-CD1 3.86Å; A236-L244 HydrophobicContact CB-CD1 4.48Å; A236-L244 HydrophobicContact CB-CD2 4.05Å; A236-L244 HydrophobicContact CB-CG 4.02Å; Q239-L244 HydrophobicContact CB-CD2 4.16Å; Q239-L244 HydrophobicContact CG-CD2 3.94Å; V241-L244 HydrophobicContact CB-CB 3.88Å; V241-L244 HydrophobicContact CG1-CB 3.94Å; V241-L244 WeakPolarHBondContact O-CA 3.48Å; V241-L244 VanDerWaalsContact O-CB 3.27Å; V241-L244 WeakPolarHBondContact O-CB 3.47Å; V241-L244 PolarHBondContact O-N 3.27Å; Q242-L244 PolarHBondContact O-N 3.42Å; L244-K247 PolarHBondContact O-N 3.27Å; L244-S248 VanDerWaalsContact O-CB 3.29Å; L244-S248 WeakPolarHBondContact O-CB 3.17Å; L244-S248 PolarHBondContact O-N 2.88Å; L244-S248 PolarHBondContact O-OG 2.89Å; L244-S248 VanDerWaalsContact O-OG 3.08Å |
| 245 | K | 94.9 | Very high | 94.3 | Very high | 20 Ų | 20 | 45.9 Ų | 45.9 | 9% | 0.087 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -54.6 | -58.3 | 177.9 | -61.3 | -179.9 | 117.2 | 162 | 0 | 111.7 | M237 Q239 V241 Q242 K247 S248 A249 F286 | M237-K245 WeakPolarHBondContact O-CE 3.32Å; M237-K245 WeakPolarHBondContact O-CG 3.35Å; Q239-K245 WeakPolarHBondContact O-CD 3.41Å; Q239-K245 WeakPolarHBondContact O-CE 3.46Å; Q239-K245 WeakPolarHBondContact O-CG 3.48Å; Q239-K245 PolarHBondContact O-NZ 3Å; V241-K245 PolarHBondContact O-N 3.35Å; Q242-K245 PolarHBondContact O-N 3.02Å; K245-K247 PolarHBondContact O-N 3.23Å; K245-S248 PolarHBondContact O-N 3.36Å; K245-A249 PolarHBondContact O-N 3.07Å; K245-F286 HydrophobicContact CB-CD2 3.72Å; K245-F286 HydrophobicContact CB-CE2 3.96Å; K245-F286 HydrophobicContact CB-CG 4.14Å; K245-F286 VanDerWaalsContact O-CD2 3.23Å; K245-F286 WeakPolarHBondContact O-CD2 3.48Å; K245-F286 WeakPolarHBondContact O-CE2 3.39Å |
| 246 | V | 95.2 | Very high | 94.2 | Very high | 41 Ų | 41 | 41.6 Ų | 41.6 | 25% | 0.248 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -57.2 | -49.9 | -177.4 | 175.6 | 0 | 0 | 0 | 0 | 110.8 | Q242 S248 A249 F250 F286 | Q242-V246 WeakPolarHBondContact O-CG2 3.37Å; Q242-V246 PolarHBondContact O-N 3.23Å; V246-S248 VanDerWaalsContact C-N 3.33Å; V246-S248 PolarHBondContact O-N 2.86Å; V246-A249 PolarHBondContact O-N 2.98Å; V246-F250 WeakPolarHBondContact O-CB 3.41Å; V246-F250 PolarHBondContact O-N 3.08Å; V246-F286 HydrophobicContact CG2-CB 3.9Å |
| 247 | K | 95.9 | Very high | 93.9 | Very high | 84 Ų | 84 | 46.1 Ų | 46.1 | 37% | 0.365 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -66.6 | -33.8 | -178.5 | -73.3 | -175.3 | 171.8 | -64.6 | 0 | 113.1 | V204 L207 K243 L244 K245 L251 | V204-K247 HydrophobicContact CG1-CD 4.37Å; L207-K247 HydrophobicContact CD2-CB 3.48Å; L207-K247 VanDerWaalsContact CD2-CB 3.48Å; L207-K247 HydrophobicContact CG-CB 4.34Å; K243-K247 HydrophobicContact CG-CD 4.23Å; K243-K247 WeakPolarHBondContact O-CB 3.32Å; K243-K247 VanDerWaalsContact O-CG 3.31Å; K243-K247 WeakPolarHBondContact O-CG 3.4Å; K243-K247 PolarHBondContact O-N 2.9Å; L244-K247 PolarHBondContact O-N 3.27Å; K245-K247 PolarHBondContact O-N 3.23Å; K247-L251 WeakPolarHBondContact O-CB 3.4Å; K247-L251 PolarHBondContact O-N 3.3Å |
| 248 | S | 96.6 | Very high | 93.7 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -71.5 | -41.2 | 177.7 | -70.9 | 0 | 0 | 0 | 0 | 111.5 | L207 A236 L244 K245 V246 L251 L252 | L207-S248 VanDerWaalsContact CD2-OG 3.26Å; L207-S248 WeakPolarHBondContact CD2-OG 3.17Å; A236-S248 WeakPolarHBondContact CB-OG 3.32Å; L244-S248 VanDerWaalsContact O-CB 3.29Å; L244-S248 WeakPolarHBondContact O-CB 3.17Å; L244-S248 PolarHBondContact O-N 2.88Å; L244-S248 PolarHBondContact O-OG 2.89Å; L244-S248 VanDerWaalsContact O-OG 3.08Å; K245-S248 PolarHBondContact O-N 3.36Å; V246-S248 VanDerWaalsContact C-N 3.33Å; V246-S248 PolarHBondContact O-N 2.86Å; S248-L251 PolarHBondContact O-N 3.02Å; S248-L252 WeakPolarHBondContact O-CB 3.45Å; S248-L252 PolarHBondContact O-N 3.16Å |
| 249 | A | 95.7 | Very high | 93.5 | Very high | 1 Ų | 1 | 46.2 Ų | 46.2 | 1% | 0.008 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.2 | -43.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | M237 K245 V246 L251 L252 Q253 F286 H289 V290 | M237-A249 WeakPolarHBondContact SD-CA 3.46Å; M237-A249 HydrophobicContact SD-CB 3.65Å; M237-A249 PolarHBondContact SD-N 3.46Å; K245-A249 PolarHBondContact O-N 3.07Å; V246-A249 PolarHBondContact O-N 2.98Å; A249-L251 VanDerWaalsContact C-N 3.29Å; A249-L251 PolarHBondContact O-N 3.43Å; A249-L252 PolarHBondContact O-N 2.84Å; A249-Q253 WeakPolarHBondContact O-CB 3.41Å; A249-Q253 PolarHBondContact O-N 3.27Å; A249-F286 HydrophobicContact CB-CD2 3.54Å; A249-F286 HydrophobicContact CB-CE2 3.5Å; A249-F286 VanDerWaalsContact CB-CE2 3.5Å; A249-H289 HydrophobicContact CB-CB 3.5Å; A249-H289 VanDerWaalsContact CB-CB 3.5Å; A249-V290 HydrophobicContact CB-CG2 4.09Å |
| 250 | F | 95.9 | Very high | 93.3 | Very high | 77 Ų | 77 | 46.2 Ų | 46.2 | 34% | 0.338 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -55.3 | -45.5 | 174.4 | 172 | -95.6 | 0 | 0 | 0 | 111.8 | V246 Q253 N254 | V246-F250 WeakPolarHBondContact O-CB 3.41Å; V246-F250 PolarHBondContact O-N 3.08Å; F250-Q253 PolarHBondContact O-N 3.44Å; F250-N254 VanDerWaalsContact CE2-ND2 3.26Å; F250-N254 WeakPolarHBondContact CE2-ND2 3.41Å; F250-N254 WeakPolarHBondContact CZ-ND2 3.32Å; F250-N254 WeakPolarHBondContact O-CB 3.4Å; F250-N254 PolarHBondContact O-N 2.94Å; F250-N254 PolarHBondContact O-ND2 3.07Å |
| 251 | L | 96.7 | Very high | 93.3 | Very high | 1 Ų | 1 | 44.3 Ų | 44.3 | 1% | 0.005 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -65.2 | -45 | 177.7 | 179.5 | 57.9 | 0 | 0 | 0 | 111.4 | L207 I210 V214 R215 L233 K247 S248 A249 Q253 N254 L255 | L207-L251 HydrophobicContact CD1-CD2 3.84Å; I210-L251 HydrophobicContact CG2-CD2 4.23Å; V214-L251 HydrophobicContact CG2-CD1 3.88Å; V214-L251 HydrophobicContact CG2-CD2 4.45Å; R215-L251 HydrophobicContact CG-CD1 3.85Å; L233-L251 HydrophobicContact CD1-CD2 3.96Å; L233-L251 HydrophobicContact CD1-CG 4.08Å; L233-L251 HydrophobicContact CD2-CD2 3.96Å; K247-L251 WeakPolarHBondContact O-CB 3.4Å; K247-L251 PolarHBondContact O-N 3.3Å; S248-L251 PolarHBondContact O-N 3.02Å; A249-L251 VanDerWaalsContact C-N 3.29Å; A249-L251 PolarHBondContact O-N 3.43Å; L251-Q253 PolarHBondContact O-N 3.47Å; L251-N254 PolarHBondContact O-N 3.29Å; L251-L255 HydrophobicContact CD1-CD1 4.16Å; L251-L255 HydrophobicContact CD1-CG 4.05Å; L251-L255 HydrophobicContact CG-CD1 4.15Å; L251-L255 HydrophobicContact CG-CG 4.43Å; L251-L255 VanDerWaalsContact O-CG 3.3Å; L251-L255 WeakPolarHBondContact O-CG 3.34Å; L251-L255 PolarHBondContact O-N 3.01Å |
| 252 | L | 95.8 | Very high | 93.1 | Very high | 2 Ų | 2 | 44.2 Ų | 44.2 | 1% | 0.01 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -58.2 | -47.9 | 176.7 | 173.9 | 62 | 0 | 0 | 0 | 111.5 | F230 M234 M237 S248 A249 L255 L256 M271 L275 A293 | F230-L252 HydrophobicContact CD1-CD1 3.75Å; F230-L252 HydrophobicContact CE1-CD1 3.57Å; M234-L252 HydrophobicContact SD-CD2 4.44Å; M237-L252 HydrophobicContact CE-CD2 3.66Å; M237-L252 HydrophobicContact SD-CD2 4.42Å; S248-L252 WeakPolarHBondContact O-CB 3.45Å; S248-L252 PolarHBondContact O-N 3.16Å; A249-L252 PolarHBondContact O-N 2.84Å; L252-L255 PolarHBondContact O-N 3.3Å; L252-L256 HydrophobicContact CD1-CD1 3.84Å; L252-L256 HydrophobicContact CD1-CG 4.14Å; L252-L256 HydrophobicContact CG-CD1 3.95Å; L252-L256 WeakPolarHBondContact O-CB 3.27Å; L252-L256 WeakPolarHBondContact O-CG 3.44Å; L252-L256 PolarHBondContact O-N 3.41Å; L252-M271 HydrophobicContact CD1-CE 4.19Å; L252-M271 HydrophobicContact CD2-CE 4.41Å; L252-M271 HydrophobicContact CD2-SD 3.9Å; L252-L275 HydrophobicContact CD2-CD1 4.47Å; L252-L275 HydrophobicContact CD2-CD2 3.75Å; L252-A293 HydrophobicContact CD2-CB 4.29Å; L252-A293 HydrophobicContact CG-CB 4.27Å |
| 253 | Q | 95.1 | Very high | 93 | Very high | 27 Ų | 27 | 40.4 Ų | 40.4 | 13% | 0.126 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.2 | -48.1 | 177 | -175.9 | -173.8 | 10 | 0 | 0 | 111 | A249 F250 L251 L255 L256 V257 H289 A293 | A249-Q253 WeakPolarHBondContact O-CB 3.41Å; A249-Q253 PolarHBondContact O-N 3.27Å; F250-Q253 PolarHBondContact O-N 3.44Å; L251-Q253 PolarHBondContact O-N 3.47Å; Q253-L255 VanDerWaalsContact C-N 3.32Å; Q253-L255 PolarHBondContact O-N 2.96Å; Q253-L256 PolarHBondContact O-N 3.32Å; Q253-V257 HydrophobicContact CG-CG2 4.44Å; Q253-V257 VanDerWaalsContact O-CG2 3.3Å; Q253-V257 WeakPolarHBondContact O-CG2 3.42Å; Q253-V257 PolarHBondContact O-N 3.45Å; Q253-H289 PolarHBondContact OE1-ND1 3.42Å; Q253-H289 VanDerWaalsContact OE1-ND1 3.16Å; Q253-A293 HydrophobicContact CB-CB 4.33Å |
| 254 | N | 94.5 | Very high | 92.8 | Very high | 47 Ų | 47 | 35.5 Ų | 35.5 | 25% | 0.251 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -56.3 | -46 | 176.9 | -95 | -113.4 | 0 | 0 | 0 | 111.8 | R215 F250 L251 V257 G258 | R215-N254 PolarHBondContact NE-OD1 3.01Å; R215-N254 PolarHBondContact NH2-OD1 2.94Å; F250-N254 VanDerWaalsContact CE2-ND2 3.26Å; F250-N254 WeakPolarHBondContact CE2-ND2 3.41Å; F250-N254 WeakPolarHBondContact CZ-ND2 3.32Å; F250-N254 WeakPolarHBondContact O-CB 3.4Å; F250-N254 PolarHBondContact O-N 2.94Å; F250-N254 PolarHBondContact O-ND2 3.07Å; L251-N254 PolarHBondContact O-N 3.29Å; N254-V257 PolarHBondContact O-N 2.96Å; N254-G258 PolarHBondContact O-N 3.41Å |
| 255 | L | 94.4 | Very high | 92.5 | Very high | 5 Ų | 5 | 39.4 Ų | 39.4 | 3% | 0.026 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -66.4 | -39.6 | -179.7 | -69.4 | 179.8 | 0 | 0 | 0 | 112 | V214 L221 F224 F230 L251 L252 Q253 H259 | V214-L255 HydrophobicContact CG2-CD1 4.34Å; V214-L255 HydrophobicContact CG2-CD2 4.12Å; L221-L255 HydrophobicContact CD1-CD1 4.21Å; L221-L255 HydrophobicContact CD1-CD2 3.84Å; L221-L255 HydrophobicContact CD2-CD2 4.5Å; F224-L255 HydrophobicContact CD1-CD1 4.5Å; F224-L255 HydrophobicContact CE1-CD1 4.08Å; F224-L255 HydrophobicContact CZ-CD1 4.47Å; F230-L255 HydrophobicContact CE1-CB 4.31Å; F230-L255 HydrophobicContact CE1-CD1 3.91Å; F230-L255 HydrophobicContact CZ-CB 4.32Å; F230-L255 HydrophobicContact CZ-CD1 4.22Å; L251-L255 HydrophobicContact CD1-CD1 4.16Å; L251-L255 HydrophobicContact CD1-CG 4.05Å; L251-L255 HydrophobicContact CG-CD1 4.15Å; L251-L255 HydrophobicContact CG-CG 4.43Å; L251-L255 VanDerWaalsContact O-CG 3.3Å; L251-L255 WeakPolarHBondContact O-CG 3.34Å; L251-L255 PolarHBondContact O-N 3.01Å; L252-L255 PolarHBondContact O-N 3.3Å; Q253-L255 VanDerWaalsContact C-N 3.32Å; Q253-L255 PolarHBondContact O-N 2.96Å; L255-H259 WeakPolarHBondContact O-CB 3.45Å; L255-H259 PolarHBondContact O-N 3.24Å |
| 256 | L | 92 | Very high | 92.3 | Very high | 1 Ų | 1 | 38.4 Ų | 38.4 | 1% | 0.005 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -69.1 | -36.1 | 178 | -82.6 | 170.7 | 0 | 0 | 0 | 113.5 | L252 Q253 K263 L266 A293 L297 | L252-L256 HydrophobicContact CD1-CD1 3.84Å; L252-L256 HydrophobicContact CD1-CG 4.14Å; L252-L256 HydrophobicContact CG-CD1 3.95Å; L252-L256 WeakPolarHBondContact O-CB 3.27Å; L252-L256 WeakPolarHBondContact O-CG 3.44Å; L252-L256 PolarHBondContact O-N 3.41Å; Q253-L256 PolarHBondContact O-N 3.32Å; L256-K263 HydrophobicContact CD2-CG 4.24Å; L256-L266 HydrophobicContact CD2-CD1 3.35Å; L256-L266 HydrophobicContact CG-CD1 4.03Å; L256-A293 HydrophobicContact CD1-CB 3.79Å; L256-L297 HydrophobicContact CD1-CD1 4.39Å; L256-L297 HydrophobicContact CD1-CD2 4.26Å; L256-L297 HydrophobicContact CD1-CG 3.99Å; L256-L297 HydrophobicContact CD2-CD2 3.6Å; L256-L297 HydrophobicContact CD2-CG 4.19Å |
| 257 | V | 91 | Very high | 92.2 | Very high | 97 Ų | 97 | 36.6 Ų | 36.6 | 59% | 0.588 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -69.4 | -45.6 | 175.3 | 171.9 | 0 | 0 | 0 | 0 | 110.5 | Q253 N254 S296 | Q253-V257 HydrophobicContact CG-CG2 4.44Å; Q253-V257 VanDerWaalsContact O-CG2 3.3Å; Q253-V257 WeakPolarHBondContact O-CG2 3.42Å; Q253-V257 PolarHBondContact O-N 3.45Å; N254-V257 PolarHBondContact O-N 2.96Å; V257-S296 WeakPolarHBondContact CG2-OG 3.19Å |
| 258 | G | 88.3 | Confident | 91.9 | Very high | 47 Ų | 47 | 37 Ų | 37 | 49% | 0.485 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -74.5 | -27.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | N254 | N254-G258 PolarHBondContact O-N 3.41Å |
| 259 | H | 88.7 | Confident | 91.5 | Very high | 39 Ų | 39 | 41.2 Ų | 41.2 | 18% | 0.181 | 24% | 0.241 | C | C | . | . | trans | -133.6 | 71.3 | -170.4 | -61.3 | -79.7 | 0 | 0 | 0 | 112.3 | L221 L255 E261 H262 | L221-H259 HydrophobicContact CD2-CB 3.93Å; L221-H259 WeakPolarHBondContact CD2-CD2 3.47Å; L221-H259 WeakPolarHBondContact CD2-NE2 3.4Å; L255-H259 WeakPolarHBondContact O-CB 3.45Å; L255-H259 PolarHBondContact O-N 3.24Å; H259-E261 VanDerWaalsContact CA-OE2 3.31Å; H259-E261 WeakPolarHBondContact CA-OE2 3.29Å; H259-E261 WeakPolarHBondContact CB-OE1 3.26Å; H259-E261 IonicContact CG-OE1 3.95Å; H259-E261 IonicContact ND1-OE1 2.75Å; H259-E261 PolarHBondContact ND1-OE1 3.47Å; H259-E261 PolarHBondContact O-N 3.39Å; H259-E261 VanDerWaalsContact O-N 3.13Å; H259-H262 PolarHBondContact O-N 3.05Å | ||
| 260 | P | 87.4 | Confident | 91.3 | Very high | 66 Ų | 66 | 42.1 Ų | 42.1 | 43% | 0.429 | 25% | 0.251 | S | S | . | . | G | 310 helix | trans | -61.6 | -19.9 | -178.2 | 27.1 | -36.1 | 0 | 0 | 0 | 113.8 | H262 K263 | P260-H262 PolarHBondContact O-N 3.15Å; P260-H262 VanDerWaalsContact O-N 3.15Å; P260-K263 HydrophobicContact CB-CD 4.25Å; P260-K263 WeakPolarHBondContact O-CB 3.34Å; P260-K263 WeakPolarHBondContact O-CG 3.49Å; P260-K263 PolarHBondContact O-N 2.93Å; P260-K263 VanDerWaalsContact O-N 3.16Å |
| 261 | E | 89 | Confident | 91.2 | Very high | 121 Ų | 121 | 38.8 Ų | 38.8 | 57% | 0.565 | 24% | 0.236 | S | C | * | . | G | 310 helix | trans | -58.8 | -22.6 | 175.3 | 61 | -87.9 | -159.9 | 0 | 0 | 113.5 | H259 | H259-E261 VanDerWaalsContact CA-OE2 3.31Å; H259-E261 WeakPolarHBondContact CA-OE2 3.29Å; H259-E261 WeakPolarHBondContact CB-OE1 3.26Å; H259-E261 IonicContact CG-OE1 3.95Å; H259-E261 IonicContact ND1-OE1 2.75Å; H259-E261 PolarHBondContact ND1-OE1 3.47Å; H259-E261 PolarHBondContact O-N 3.39Å; H259-E261 VanDerWaalsContact O-N 3.13Å |
| 262 | H | 87.1 | Confident | 91.2 | Very high | 29 Ų | 29 | 38.7 Ų | 38.7 | 13% | 0.134 | 24% | 0.236 | C | C | . | . | G | 310 helix | trans | -90.6 | -5.7 | -179.3 | -60.7 | -38.6 | 0 | 0 | 0 | 114.2 | L225 H259 P260 G264 T265 L266 | L225-H262 WeakPolarHBondContact CD1-CE1 3.25Å; L225-H262 VanDerWaalsContact CD1-NE2 3.34Å; L225-H262 WeakPolarHBondContact CD1-NE2 3.36Å; H259-H262 PolarHBondContact O-N 3.05Å; P260-H262 PolarHBondContact O-N 3.15Å; P260-H262 VanDerWaalsContact O-N 3.15Å; H262-G264 VanDerWaalsContact C-N 3.28Å; H262-G264 PolarHBondContact O-N 3.38Å; H262-T265 PolarHBondContact O-N 2.77Å; H262-L266 WeakPolarHBondContact O-CG 3.17Å; H262-L266 PolarHBondContact O-N 3.5Å |
| 263 | K | 91.1 | Very high | 91.2 | Very high | 18 Ų | 18 | 41.5 Ų | 41.5 | 8% | 0.078 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -54.8 | -42.6 | 180 | -68.2 | 176.9 | -171.8 | -173.7 | 0 | 112.4 | L256 P260 L266 C267 S296 L297 T299 F301 | L256-K263 HydrophobicContact CD2-CG 4.24Å; P260-K263 HydrophobicContact CB-CD 4.25Å; P260-K263 WeakPolarHBondContact O-CB 3.34Å; P260-K263 WeakPolarHBondContact O-CG 3.49Å; P260-K263 PolarHBondContact O-N 2.93Å; P260-K263 VanDerWaalsContact O-N 3.16Å; K263-L266 PolarHBondContact O-N 3.36Å; K263-C267 WeakPolarHBondContact O-CB 3.47Å; K263-C267 PolarHBondContact O-N 3.32Å; K263-C267 PolarHBondContact O-SG 3.44Å; K263-S296 WeakPolarHBondContact CE-O 3.32Å; K263-S296 PolarHBondContact NZ-O 3.15Å; K263-L297 HydrophobicContact CB-CD2 4.25Å; K263-L297 HydrophobicContact CG-CD2 4.22Å; K263-T299 PolarHBondContact NZ-O 3.09Å; K263-F301 HydrophobicContact CB-CD1 3.98Å; K263-F301 HydrophobicContact CB-CD2 4.26Å; K263-F301 HydrophobicContact CB-CE1 4.03Å; K263-F301 HydrophobicContact CB-CE2 4.31Å; K263-F301 HydrophobicContact CB-CG 4.12Å; K263-F301 HydrophobicContact CB-CZ 4.21Å; K263-F301 HydrophobicContact CD-CB 3.98Å; K263-F301 HydrophobicContact CD-CD1 4.47Å; K263-F301 HydrophobicContact CD-CD2 4.47Å; K263-F301 HydrophobicContact CD-CG 4.06Å |
| 264 | G | 90 | Very high | 91.2 | Very high | 21 Ų | 21 | 44.1 Ų | 44.1 | 22% | 0.216 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.8 | -44.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | H262 L266 S268 | H262-G264 VanDerWaalsContact C-N 3.28Å; H262-G264 PolarHBondContact O-N 3.38Å; G264-L266 VanDerWaalsContact C-N 3.34Å; G264-L266 PolarHBondContact O-N 2.95Å; G264-S268 WeakPolarHBondContact O-CB 3.5Å; G264-S268 PolarHBondContact O-N 3.39Å; G264-S268 PolarHBondContact O-OG 3.48Å |
| 265 | T | 87.9 | Confident | 91.2 | Very high | 83 Ų | 83 | 41.9 Ų | 41.9 | 51% | 0.509 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61.5 | -44.9 | 174.8 | -54.9 | 0 | 0 | 0 | 0 | 110.6 | H262 S268 M269 | H262-T265 PolarHBondContact O-N 2.77Å; T265-S268 WeakPolarHBondContact O-CB 3.44Å; T265-S268 PolarHBondContact O-N 2.89Å; T265-M269 HydrophobicContact CG2-SD 4.15Å; T265-M269 VanDerWaalsContact O-CG 3.28Å; T265-M269 WeakPolarHBondContact O-CG 3.43Å; T265-M269 PolarHBondContact O-N 2.94Å |
| 266 | L | 90 | Very high | 91.3 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.3 | -44.2 | -179 | -73 | 175.5 | 0 | 0 | 0 | 112.8 | F230 L256 H262 K263 G264 S268 M269 G270 M271 L297 | F230-L266 HydrophobicContact CB-CD2 3.81Å; F230-L266 HydrophobicContact CD1-CD2 3.95Å; F230-L266 HydrophobicContact CD2-CD1 4.34Å; F230-L266 HydrophobicContact CD2-CD2 3.29Å; F230-L266 HydrophobicContact CD2-CG 4.11Å; F230-L266 HydrophobicContact CE1-CD1 4.14Å; F230-L266 HydrophobicContact CE1-CD2 4.34Å; F230-L266 HydrophobicContact CE2-CD1 3.85Å; F230-L266 HydrophobicContact CE2-CD2 3.67Å; F230-L266 HydrophobicContact CE2-CG 3.98Å; F230-L266 HydrophobicContact CG-CD2 3.44Å; F230-L266 VanDerWaalsContact CG-CD2 3.44Å; F230-L266 HydrophobicContact CZ-CD1 3.78Å; F230-L266 HydrophobicContact CZ-CD2 4.21Å; F230-L266 HydrophobicContact CZ-CG 4.4Å; L256-L266 HydrophobicContact CD2-CD1 3.35Å; L256-L266 HydrophobicContact CG-CD1 4.03Å; H262-L266 WeakPolarHBondContact O-CG 3.17Å; H262-L266 PolarHBondContact O-N 3.5Å; K263-L266 PolarHBondContact O-N 3.36Å; G264-L266 VanDerWaalsContact C-N 3.34Å; G264-L266 PolarHBondContact O-N 2.95Å; L266-S268 VanDerWaalsContact C-N 3.31Å; L266-S268 PolarHBondContact O-N 3.46Å; L266-M269 HydrophobicContact CD2-SD 4.47Å; L266-M269 WeakPolarHBondContact O-CB 3.25Å; L266-M269 PolarHBondContact O-N 3.01Å; L266-M269 VanDerWaalsContact O-N 3.09Å; L266-G270 PolarHBondContact O-N 3.09Å; L266-M271 HydrophobicContact CB-CB 3.98Å; L266-M271 HydrophobicContact CB-CG 4.25Å; L266-M271 HydrophobicContact CD2-CE 3.48Å; L266-M271 VanDerWaalsContact CD2-CE 3.48Å; L266-M271 HydrophobicContact CG-CE 4.47Å; L266-M271 WeakPolarHBondContact O-CB 3.49Å; L266-M271 PolarHBondContact O-N 3.06Å; L266-L297 HydrophobicContact CB-CD2 4.43Å |
| 267 | C | 92.3 | Very high | 91.5 | Very high | 3 Ų | 3 | 44.2 Ų | 44.2 | 2% | 0.02 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.5 | -41.9 | 174.5 | -67 | 0 | 0 | 0 | 0 | 111.2 | K263 M269 G270 F301 Q303 E307 | K263-C267 WeakPolarHBondContact O-CB 3.47Å; K263-C267 PolarHBondContact O-N 3.32Å; K263-C267 PolarHBondContact O-SG 3.44Å; C267-M269 PolarHBondContact O-N 3.48Å; C267-M269 VanDerWaalsContact O-N 3.14Å; C267-G270 PolarHBondContact O-N 3.29Å; C267-F301 HydrophobicContact CB-CE1 4.25Å; C267-F301 VanDerWaalsContact SG-CE1 3.59Å; C267-Q303 HydrophobicContact CB-CG 4.2Å; C267-Q303 VanDerWaalsContact CB-NE2 3.35Å; C267-E307 WeakPolarHBondContact CB-OE1 3.43Å |
| 268 | S | 90.2 | Very high | 91.6 | Very high | 92 Ų | 92 | 40 Ų | 40 | 64% | 0.643 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -62.7 | -22.5 | 175 | -54.1 | 0 | 0 | 0 | 0 | 113.8 | G264 T265 L266 G270 | G264-S268 WeakPolarHBondContact O-CB 3.5Å; G264-S268 PolarHBondContact O-N 3.39Å; G264-S268 PolarHBondContact O-OG 3.48Å; T265-S268 WeakPolarHBondContact O-CB 3.44Å; T265-S268 PolarHBondContact O-N 2.89Å; L266-S268 VanDerWaalsContact C-N 3.31Å; L266-S268 PolarHBondContact O-N 3.46Å; S268-G270 VanDerWaalsContact C-N 3.29Å |
| 269 | M | 88.7 | Confident | 92 | Very high | 88 Ų | 88 | 37.8 Ų | 37.8 | 43% | 0.433 | 22% | 0.22 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.4 | 3.7 | 173.7 | -67 | 173.2 | 73.8 | 0 | 0 | 113.2 | S231 T265 L266 C267 | S231-M269 VanDerWaalsContact OG-CE 3.25Å; S231-M269 WeakPolarHBondContact OG-CE 3.49Å; T265-M269 HydrophobicContact CG2-SD 4.15Å; T265-M269 VanDerWaalsContact O-CG 3.28Å; T265-M269 WeakPolarHBondContact O-CG 3.43Å; T265-M269 PolarHBondContact O-N 2.94Å; L266-M269 HydrophobicContact CD2-SD 4.47Å; L266-M269 WeakPolarHBondContact O-CB 3.25Å; L266-M269 PolarHBondContact O-N 3.01Å; L266-M269 VanDerWaalsContact O-N 3.09Å; C267-M269 PolarHBondContact O-N 3.48Å; C267-M269 VanDerWaalsContact O-N 3.14Å |
| 270 | G | 91.9 | Very high | 92.2 | Very high | 21 Ų | 21 | 42.4 Ų | 42.4 | 22% | 0.216 | 24% | 0.236 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 76.6 | 24.8 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | L266 C267 S268 V272 Q273 Q274 | L266-G270 PolarHBondContact O-N 3.09Å; C267-G270 PolarHBondContact O-N 3.29Å; S268-G270 VanDerWaalsContact C-N 3.29Å; G270-V272 VanDerWaalsContact C-N 3.3Å; G270-V272 PolarHBondContact O-N 2.95Å; G270-Q273 PolarHBondContact O-N 2.81Å; G270-Q273 PolarHBondContact O-OE1 3.04Å; G270-Q274 VanDerWaalsContact O-CG 3.29Å; G270-Q274 WeakPolarHBondContact O-CG 3.44Å; G270-Q274 PolarHBondContact O-N 3.11Å; G270-Q274 VanDerWaalsContact O-N 3.14Å |
| 271 | M | 93.9 | Very high | 92.5 | Very high | 6 Ų | 6 | 41.9 Ų | 41.9 | 3% | 0.03 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -58.8 | -40.6 | -176.5 | -178.5 | 62.4 | 71.3 | 0 | 0 | 112.2 | F230 M234 L252 L266 Q273 Q274 L275 L297 | F230-M271 HydrophobicContact CB-CE 4.42Å; M234-M271 HydrophobicContact CE-SD 4.26Å; M234-M271 HydrophobicContact CG-CE 3.79Å; M234-M271 HydrophobicContact CG-SD 4.16Å; M234-M271 HydrophobicContact SD-CE 3.65Å; M234-M271 HydrophobicContact SD-SD 3.27Å; L252-M271 HydrophobicContact CD1-CE 4.19Å; L252-M271 HydrophobicContact CD2-CE 4.41Å; L252-M271 HydrophobicContact CD2-SD 3.9Å; L266-M271 HydrophobicContact CB-CB 3.98Å; L266-M271 HydrophobicContact CB-CG 4.25Å; L266-M271 HydrophobicContact CD2-CE 3.48Å; L266-M271 VanDerWaalsContact CD2-CE 3.48Å; L266-M271 HydrophobicContact CG-CE 4.47Å; L266-M271 WeakPolarHBondContact O-CB 3.49Å; L266-M271 PolarHBondContact O-N 3.06Å; M271-Q273 PolarHBondContact O-N 2.66Å; M271-Q274 PolarHBondContact O-N 3.35Å; M271-L275 HydrophobicContact CG-CD1 3.84Å; M271-L275 HydrophobicContact CG-CG 4.19Å; M271-L275 VanDerWaalsContact O-CG 3.3Å; M271-L275 WeakPolarHBondContact O-CG 3.48Å; M271-L275 PolarHBondContact O-N 3.18Å; M271-L275 HydrophobicContact SD-CD1 4.14Å; M271-L275 HydrophobicContact SD-CD2 4.3Å; M271-L275 HydrophobicContact SD-CG 4Å; M271-L297 HydrophobicContact CB-CD1 4.47Å; M271-L297 HydrophobicContact CG-CD1 3.85Å |
| 272 | V | 95.6 | Very high | 92.4 | Very high | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59.1 | -50.9 | -179.8 | 173.4 | 0 | 0 | 0 | 0 | 110.5 | G270 Q274 L275 V276 L294 L297 E307 C308 L313 | G270-V272 VanDerWaalsContact C-N 3.3Å; G270-V272 PolarHBondContact O-N 2.95Å; V272-Q274 VanDerWaalsContact C-N 3.28Å; V272-Q274 PolarHBondContact O-N 3.11Å; V272-L275 PolarHBondContact O-N 3.42Å; V272-V276 HydrophobicContact CG1-CG2 4.39Å; V272-V276 WeakPolarHBondContact O-CG2 3.22Å; V272-V276 PolarHBondContact O-N 3.3Å; V272-L294 HydrophobicContact CG1-CD2 4.27Å; V272-L297 HydrophobicContact CG2-CD1 4.08Å; V272-E307 HydrophobicContact CB-CB 4.09Å; V272-E307 HydrophobicContact CG1-CB 4.04Å; V272-E307 HydrophobicContact CG2-CB 4.07Å; V272-C308 VanDerWaalsContact CG1-SG 3.57Å; V272-L313 HydrophobicContact CG1-CD1 4.04Å |
| 273 | Q | 95.8 | Very high | 92.5 | Very high | 61 Ų | 61 | 45.2 Ų | 45.2 | 29% | 0.285 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.2 | -40.4 | -178.2 | -58.8 | 74.3 | 8.1 | 0 | 0 | 110.4 | G270 M271 A277 E307 L313 | G270-Q273 PolarHBondContact O-N 2.81Å; G270-Q273 PolarHBondContact O-OE1 3.04Å; M271-Q273 PolarHBondContact O-N 2.66Å; Q273-A277 WeakPolarHBondContact O-CB 3.42Å; Q273-A277 PolarHBondContact O-N 3.43Å; Q273-E307 PolarHBondContact NE2-OE2 3.28Å; Q273-L313 HydrophobicContact CB-CD2 4.06Å; Q273-L313 HydrophobicContact CG-CD1 4.31Å; Q273-L313 HydrophobicContact CG-CD2 3.99Å |
| 274 | Q | 94.8 | Very high | 92.4 | Very high | 82 Ų | 82 | 45.3 Ų | 45.3 | 38% | 0.383 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -68.2 | -41.8 | 176.9 | -62.3 | -67.2 | -43.2 | 0 | 0 | 112.7 | M234 G270 M271 V272 A277 L278 | M234-Q274 HydrophobicContact CE-CB 3.29Å; M234-Q274 HydrophobicContact CE-CG 4.05Å; G270-Q274 VanDerWaalsContact O-CG 3.29Å; G270-Q274 WeakPolarHBondContact O-CG 3.44Å; G270-Q274 PolarHBondContact O-N 3.11Å; G270-Q274 VanDerWaalsContact O-N 3.14Å; M271-Q274 PolarHBondContact O-N 3.35Å; V272-Q274 VanDerWaalsContact C-N 3.28Å; V272-Q274 PolarHBondContact O-N 3.11Å; Q274-A277 PolarHBondContact O-N 2.89Å; Q274-L278 WeakPolarHBondContact O-CG 3.22Å; Q274-L278 PolarHBondContact O-N 2.94Å |
| 275 | L | 95.9 | Very high | 92.3 | Very high | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -65.8 | -41.9 | 176.4 | -68.2 | 173.8 | 0 | 0 | 0 | 111.1 | M237 L252 M271 V272 A277 L278 V279 V290 A293 L294 L297 | M237-L275 HydrophobicContact CE-CD2 4.42Å; L252-L275 HydrophobicContact CD2-CD1 4.47Å; L252-L275 HydrophobicContact CD2-CD2 3.75Å; M271-L275 HydrophobicContact CG-CD1 3.84Å; M271-L275 HydrophobicContact CG-CG 4.19Å; M271-L275 VanDerWaalsContact O-CG 3.3Å; M271-L275 WeakPolarHBondContact O-CG 3.48Å; M271-L275 PolarHBondContact O-N 3.18Å; M271-L275 HydrophobicContact SD-CD1 4.14Å; M271-L275 HydrophobicContact SD-CD2 4.3Å; M271-L275 HydrophobicContact SD-CG 4Å; V272-L275 PolarHBondContact O-N 3.42Å; L275-A277 VanDerWaalsContact C-N 3.32Å; L275-A277 PolarHBondContact O-N 3.36Å; L275-L278 HydrophobicContact CD2-CD1 4.32Å; L275-L278 WeakPolarHBondContact O-CA 3.33Å; L275-L278 WeakPolarHBondContact O-CB 3.31Å; L275-L278 PolarHBondContact O-N 2.81Å; L275-L278 VanDerWaalsContact O-N 3.08Å; L275-V279 WeakPolarHBondContact O-CG2 3.49Å; L275-V279 PolarHBondContact O-N 2.91Å; L275-V290 HydrophobicContact CB-CG1 4.02Å; L275-V290 HydrophobicContact CD2-CG1 3.91Å; L275-V290 WeakPolarHBondContact O-CG1 3.44Å; L275-A293 HydrophobicContact CD1-CB 4.06Å; L275-L294 HydrophobicContact CB-CD1 4.15Å; L275-L294 HydrophobicContact CB-CD2 3.75Å; L275-L294 HydrophobicContact CB-CG 3.79Å; L275-L294 HydrophobicContact CD1-CD2 3.95Å; L275-L294 HydrophobicContact CD1-CG 4.01Å; L275-L297 HydrophobicContact CD1-CD1 3.63Å |
| 276 | V | 96.6 | Very high | 92.4 | Very high | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.006 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.6 | -41.6 | 174.6 | 175.4 | 0 | 0 | 0 | 0 | 111.3 | V272 L278 V279 R280 L294 L313 L315 L318 | V272-V276 HydrophobicContact CG1-CG2 4.39Å; V272-V276 WeakPolarHBondContact O-CG2 3.22Å; V272-V276 PolarHBondContact O-N 3.3Å; V276-L278 VanDerWaalsContact C-N 3.25Å; V276-L278 PolarHBondContact O-N 3.32Å; V276-V279 PolarHBondContact O-N 3.11Å; V276-V279 VanDerWaalsContact O-N 3.17Å; V276-R280 WeakPolarHBondContact O-CG 3.27Å; V276-R280 PolarHBondContact O-N 3.45Å; V276-L294 HydrophobicContact CG2-CD1 4.27Å; V276-L294 HydrophobicContact CG2-CD2 4.38Å; V276-L313 HydrophobicContact CB-CD2 4.42Å; V276-L313 HydrophobicContact CG1-CB 4.18Å; V276-L313 HydrophobicContact CG1-CD2 4.41Å; V276-L313 HydrophobicContact CG2-CD1 4.17Å; V276-L315 HydrophobicContact CG1-CD1 4.16Å; V276-L315 HydrophobicContact CG2-CD1 3.87Å; V276-L315 HydrophobicContact CG2-CD2 4.01Å; V276-L315 HydrophobicContact CG2-CG 4.35Å; V276-L318 HydrophobicContact CG1-CD2 4.19Å |
| 277 | A | 94.7 | Very high | 92.6 | Very high | 53 Ų | 53 | 44 Ų | 44 | 44% | 0.438 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -60.2 | -36.1 | 174 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q273 Q274 L275 R280 | Q273-A277 WeakPolarHBondContact O-CB 3.42Å; Q273-A277 PolarHBondContact O-N 3.43Å; Q274-A277 PolarHBondContact O-N 2.89Å; L275-A277 VanDerWaalsContact C-N 3.32Å; L275-A277 PolarHBondContact O-N 3.36Å; A277-R280 PolarHBondContact O-N 3.35Å |
| 278 | L | 94.5 | Very high | 92.8 | Very high | 10 Ų | 10 | 45.7 Ų | 45.7 | 5% | 0.052 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -68.3 | -39.5 | 174.3 | -70.9 | 166 | 0 | 0 | 0 | 112.2 | M234 M237 Q238 Q274 L275 V276 R280 T281 F286 H287 V290 | M234-L278 HydrophobicContact CE-CD1 4.01Å; M237-L278 HydrophobicContact CB-CD1 4.19Å; M237-L278 HydrophobicContact CE-CD1 4.28Å; M237-L278 HydrophobicContact SD-CD1 4.46Å; Q238-L278 HydrophobicContact CG-CD2 4.11Å; Q274-L278 WeakPolarHBondContact O-CG 3.22Å; Q274-L278 PolarHBondContact O-N 2.94Å; L275-L278 HydrophobicContact CD2-CD1 4.32Å; L275-L278 WeakPolarHBondContact O-CA 3.33Å; L275-L278 WeakPolarHBondContact O-CB 3.31Å; L275-L278 PolarHBondContact O-N 2.81Å; L275-L278 VanDerWaalsContact O-N 3.08Å; V276-L278 VanDerWaalsContact C-N 3.25Å; V276-L278 PolarHBondContact O-N 3.32Å; L278-R280 PolarHBondContact O-N 3.42Å; L278-T281 WeakPolarHBondContact O-CB 3.45Å; L278-T281 WeakPolarHBondContact O-CG2 3.22Å; L278-T281 PolarHBondContact O-N 3.1Å; L278-T281 PolarHBondContact O-OG1 3.38Å; L278-F286 HydrophobicContact CB-CE1 4.07Å; L278-F286 HydrophobicContact CB-CZ 4.22Å; L278-F286 HydrophobicContact CD1-CZ 3.99Å; L278-F286 HydrophobicContact CD2-CE1 4.18Å; L278-F286 HydrophobicContact CD2-CZ 3.99Å; L278-F286 HydrophobicContact CG-CZ 4.28Å; L278-H287 PolarHBondContact O-NE2 3.45Å; L278-V290 HydrophobicContact CB-CG1 4.23Å |
| 279 | V | 94.8 | Very high | 93.1 | Very high | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.9 | -25.7 | 176.6 | 178.6 | 0 | 0 | 0 | 0 | 112.6 | L275 V276 T281 V290 L291 L294 L318 R322 | L275-V279 WeakPolarHBondContact O-CG2 3.49Å; L275-V279 PolarHBondContact O-N 2.91Å; V276-V279 PolarHBondContact O-N 3.11Å; V276-V279 VanDerWaalsContact O-N 3.17Å; V279-T281 PolarHBondContact O-N 2.77Å; V279-V290 HydrophobicContact CG2-CB 4.43Å; V279-V290 HydrophobicContact CG2-CG1 3.54Å; V279-L291 HydrophobicContact CG1-CD2 4.23Å; V279-L291 HydrophobicContact CG2-CD2 3.98Å; V279-L291 HydrophobicContact CG2-CG 4.14Å; V279-L294 HydrophobicContact CG2-CD1 4.05Å; V279-L318 HydrophobicContact CB-CD2 3.91Å; V279-L318 HydrophobicContact CG1-CD1 4.47Å; V279-L318 HydrophobicContact CG1-CD2 3.62Å; V279-L318 HydrophobicContact CG1-CG 3.95Å; V279-R322 PolarHBondContact O-NH2 3.39Å |
| 280 | R | 94.2 | Very high | 93.5 | Very high | 136 Ų | 136 | 38.4 Ų | 38.4 | 51% | 0.513 | 20% | 0.201 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -74.6 | -10.6 | 176.3 | -68.1 | -179.4 | 171.2 | -74.4 | -3 | 114 | V276 A277 L278 L313 G314 L318 | V276-R280 WeakPolarHBondContact O-CG 3.27Å; V276-R280 PolarHBondContact O-N 3.45Å; A277-R280 PolarHBondContact O-N 3.35Å; L278-R280 PolarHBondContact O-N 3.42Å; R280-L313 PolarHBondContact NH2-O 3.44Å; R280-G314 PolarHBondContact NH2-O 3.07Å; R280-L318 HydrophobicContact CG-CD1 4.08Å; R280-L318 HydrophobicContact CG-CD2 3.55Å; R280-L318 HydrophobicContact CG-CG 4.46Å |
| 281 | T | 92.5 | Very high | 93.8 | Very high | 55 Ų | 55 | 37.4 Ų | 37.4 | 34% | 0.337 | 19% | 0.191 | S | C | . | . | S | Bend | trans | -76.2 | 173.2 | 178.6 | 68.9 | 0 | 0 | 0 | 0 | 112 | L278 V279 H283 H287 | L278-T281 WeakPolarHBondContact O-CB 3.45Å; L278-T281 WeakPolarHBondContact O-CG2 3.22Å; L278-T281 PolarHBondContact O-N 3.1Å; L278-T281 PolarHBondContact O-OG1 3.38Å; V279-T281 PolarHBondContact O-N 2.77Å; T281-H283 PolarHBondContact O-N 3.12Å; T281-H287 PolarHBondContact O-NE2 2.89Å; T281-H287 PolarHBondContact OG1-NE2 2.76Å |
| 282 | E | 88.9 | Confident | 93.9 | Very high | 178 Ų | 178 | 37.1 Ų | 37.1 | 83% | 0.832 | 19% | 0.189 | S | C | * | . | P | Polyproline II helix | trans | -59.4 | 131.2 | 178.2 | -173 | -179.5 | -178.7 | 0 | 0 | 111.1 | S284 H287 | E282-S284 PolarHBondContact O-N 2.95Å; E282-H287 PolarHBondContact O-CE1 2.93Å |
| 283 | H | 88.3 | Confident | 94 | Very high | 42 Ų | 42 | 37.1 Ų | 37.1 | 19% | 0.194 | 19% | 0.189 | C | C | . | . | P | Polyproline II helix | trans | -54.9 | 137 | -175.5 | -173.6 | 54.7 | 0 | 0 | 0 | 112.6 | T281 R322 Y332 E335 | T281-H283 PolarHBondContact O-N 3.12Å; H283-R322 PolarHBondContact ND1-NH1 2.92Å; H283-Y332 AromaticContact NE2-CD1 3.69Å; H283-Y332 AromaticContact NE2-CD2 3.97Å; H283-Y332 AromaticContact NE2-CE1 3.41Å; H283-Y332 WeakPolarHBondContact NE2-CE1 3.49Å; H283-Y332 AromaticContact NE2-CE2 3.73Å; H283-Y332 AromaticContact NE2-CG 3.97Å; H283-Y332 AromaticContact NE2-CZ 3.44Å; H283-E335 IonicContact CE1-OE1 3.2Å; H283-E335 PolarHBondContact CE1-OE1 2.77Å; H283-E335 VanDerWaalsContact CE1-OE1 3.25Å; H283-E335 IonicContact CE1-OE2 2.71Å; H283-E335 PolarHBondContact CE1-OE2 3.04Å; H283-E335 IonicContact ND1-OE1 3.85Å; H283-E335 PolarHBondContact ND1-OE1 3.09Å; H283-E335 IonicContact ND1-OE2 3.25Å |
| 284 | S | 89.1 | Confident | 94 | Very high | 19 Ų | 19 | 34.2 Ų | 34.2 | 13% | 0.133 | 18% | 0.176 | C | C | . | . | trans | -163.1 | 163.1 | 176.4 | 52.6 | 0 | 0 | 0 | 0 | 108.9 | E282 F286 H287 | E282-S284 PolarHBondContact O-N 2.95Å; S284-F286 PolarHBondContact O-N 2.52Å; S284-H287 PolarHBondContact N-ND1 3.47Å; S284-H287 VanDerWaalsContact N-ND1 3.14Å; S284-H287 WeakPolarHBondContact O-CB 3.26Å; S284-H287 PolarHBondContact O-N 3.19Å; S284-H287 PolarHBondContact O-ND1 3.42Å; S284-H287 PolarHBondContact OG-ND1 3.35Å | ||
| 285 | P | 87.2 | Confident | 94.1 | Very high | 76 Ų | 76 | 30.4 Ų | 30.4 | 49% | 0.494 | 16% | 0.158 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55 | -17.3 | 179.4 | -27.7 | 35.7 | 0 | 0 | 0 | 115.2 | H287 | P285-H287 PolarHBondContact O-N 2.88Š|
| 286 | F | 91.2 | Very high | 94.1 | Very high | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -57.8 | -30 | 170.3 | 162.1 | -104.4 | 0 | 0 | 0 | 113.7 | M237 K245 V246 A249 L278 S284 H289 V290 | M237-F286 HydrophobicContact CB-CE2 3.94Å; M237-F286 HydrophobicContact CB-CZ 4.02Å; M237-F286 HydrophobicContact CG-CE2 3.81Å; M237-F286 HydrophobicContact CG-CZ 4.33Å; M237-F286 HydrophobicContact SD-CE2 3.8Å; M237-F286 HydrophobicContact SD-CZ 4.23Å; K245-F286 HydrophobicContact CB-CD2 3.72Å; K245-F286 HydrophobicContact CB-CE2 3.96Å; K245-F286 HydrophobicContact CB-CG 4.14Å; K245-F286 VanDerWaalsContact O-CD2 3.23Å; K245-F286 WeakPolarHBondContact O-CD2 3.48Å; K245-F286 WeakPolarHBondContact O-CE2 3.39Å; V246-F286 HydrophobicContact CG2-CB 3.9Å; A249-F286 HydrophobicContact CB-CD2 3.54Å; A249-F286 HydrophobicContact CB-CE2 3.5Å; A249-F286 VanDerWaalsContact CB-CE2 3.5Å; L278-F286 HydrophobicContact CB-CE1 4.07Å; L278-F286 HydrophobicContact CB-CZ 4.22Å; L278-F286 HydrophobicContact CD1-CZ 3.99Å; L278-F286 HydrophobicContact CD2-CE1 4.18Å; L278-F286 HydrophobicContact CD2-CZ 3.99Å; L278-F286 HydrophobicContact CG-CZ 4.28Å; S284-F286 PolarHBondContact O-N 2.52Å; F286-H289 PolarHBondContact O-N 3.07Å; F286-V290 HydrophobicContact CD1-CG2 3.98Å; F286-V290 HydrophobicContact CD2-CG2 4.08Å; F286-V290 HydrophobicContact CE1-CG2 3.49Å; F286-V290 VanDerWaalsContact CE1-CG2 3.49Å; F286-V290 HydrophobicContact CE2-CG2 3.64Å; F286-V290 HydrophobicContact CG-CG2 4.27Å; F286-V290 HydrophobicContact CZ-CG2 3.31Å; F286-V290 WeakPolarHBondContact O-CG2 3.37Å; F286-V290 PolarHBondContact O-N 3.21Å |
| 287 | H | 94.4 | Very high | 94 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -69.1 | -36.2 | -173.3 | -72.3 | 72.7 | 0 | 0 | 0 | 112.9 | L278 T281 E282 S284 P285 H289 V290 L291 E335 | L278-H287 PolarHBondContact O-NE2 3.45Å; T281-H287 PolarHBondContact O-NE2 2.89Å; T281-H287 PolarHBondContact OG1-NE2 2.76Å; E282-H287 PolarHBondContact O-CE1 2.93Å; S284-H287 PolarHBondContact N-ND1 3.47Å; S284-H287 VanDerWaalsContact N-ND1 3.14Å; S284-H287 WeakPolarHBondContact O-CB 3.26Å; S284-H287 PolarHBondContact O-N 3.19Å; S284-H287 PolarHBondContact O-ND1 3.42Å; S284-H287 PolarHBondContact OG-ND1 3.35Å; P285-H287 PolarHBondContact O-N 2.88Å; H287-H289 VanDerWaalsContact C-N 3.3Å; H287-H289 PolarHBondContact O-N 3.29Å; H287-V290 PolarHBondContact O-N 3.06Å; H287-V290 VanDerWaalsContact O-N 3.16Å; H287-L291 WeakPolarHBondContact O-CB 3.45Å; H287-L291 WeakPolarHBondContact O-CG 3.34Å; H287-L291 PolarHBondContact O-N 3.2Å; H287-E335 WeakPolarHBondContact CB-OE1 3.13Å; H287-E335 WeakPolarHBondContact CB-OE2 3.34Å |
| 288 | E | 95.7 | Very high | 94.1 | Very high | 39 Ų | 39 | 28.6 Ų | 28.6 | 18% | 0.182 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -49.8 | -51 | 170.6 | -176.4 | -164.9 | 98.9 | 0 | 0 | 111.2 | V290 L291 G292 E334 E335 F338 | E288-V290 PolarHBondContact O-N 3.48Å; E288-L291 PolarHBondContact O-N 3.32Å; E288-G292 PolarHBondContact O-N 2.89Å; E288-E334 HydrophobicContact CG-CB 4.09Å; E288-E335 HydrophobicContact CB-CB 4.13Å; E288-E335 HydrophobicContact CG-CB 4.38Å; E288-E335 PolarHBondContact N-OE2 3.22Å; E288-F338 HydrophobicContact CG-CD2 4.36Å; E288-F338 HydrophobicContact CG-CE2 4.12Å |
| 289 | H | 96.4 | Very high | 94 | Very high | 27 Ų | 27 | 30 Ų | 30 | 13% | 0.125 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -69 | -34.5 | -179.6 | -58.9 | -36.2 | 0 | 0 | 0 | 113.2 | A249 Q253 F286 H287 A293 | A249-H289 HydrophobicContact CB-CB 3.5Å; A249-H289 VanDerWaalsContact CB-CB 3.5Å; Q253-H289 PolarHBondContact OE1-ND1 3.42Å; Q253-H289 VanDerWaalsContact OE1-ND1 3.16Å; F286-H289 PolarHBondContact O-N 3.07Å; H287-H289 VanDerWaalsContact C-N 3.3Å; H287-H289 PolarHBondContact O-N 3.29Å; H289-A293 WeakPolarHBondContact O-CB 3.38Å; H289-A293 PolarHBondContact O-N 3.42Å |
| 290 | V | 96.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.5 | -44 | 175.7 | 174.9 | 0 | 0 | 0 | 0 | 110.8 | A249 L275 L278 V279 F286 H287 E288 A293 L294 | A249-V290 HydrophobicContact CB-CG2 4.09Å; L275-V290 HydrophobicContact CB-CG1 4.02Å; L275-V290 HydrophobicContact CD2-CG1 3.91Å; L275-V290 WeakPolarHBondContact O-CG1 3.44Å; L278-V290 HydrophobicContact CB-CG1 4.23Å; V279-V290 HydrophobicContact CG2-CB 4.43Å; V279-V290 HydrophobicContact CG2-CG1 3.54Å; F286-V290 HydrophobicContact CD1-CG2 3.98Å; F286-V290 HydrophobicContact CD2-CG2 4.08Å; F286-V290 HydrophobicContact CE1-CG2 3.49Å; F286-V290 VanDerWaalsContact CE1-CG2 3.49Å; F286-V290 HydrophobicContact CE2-CG2 3.64Å; F286-V290 HydrophobicContact CG-CG2 4.27Å; F286-V290 HydrophobicContact CZ-CG2 3.31Å; F286-V290 WeakPolarHBondContact O-CG2 3.37Å; F286-V290 PolarHBondContact O-N 3.21Å; H287-V290 PolarHBondContact O-N 3.06Å; H287-V290 VanDerWaalsContact O-N 3.16Å; E288-V290 PolarHBondContact O-N 3.48Å; V290-A293 WeakPolarHBondContact O-CB 3.39Å; V290-A293 PolarHBondContact O-N 2.91Å; V290-L294 PolarHBondContact O-N 3.21Å |
| 291 | L | 97.6 | Very high | 93.9 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -69.5 | -36.8 | 177 | -73.8 | 162.7 | 0 | 0 | 0 | 111.6 | V279 H287 E288 L294 C295 L319 E335 F338 C339 L342 | V279-L291 HydrophobicContact CG1-CD2 4.23Å; V279-L291 HydrophobicContact CG2-CD2 3.98Å; V279-L291 HydrophobicContact CG2-CG 4.14Å; H287-L291 WeakPolarHBondContact O-CB 3.45Å; H287-L291 WeakPolarHBondContact O-CG 3.34Å; H287-L291 PolarHBondContact O-N 3.2Å; E288-L291 PolarHBondContact O-N 3.32Å; L291-L294 HydrophobicContact CD2-CD1 4.4Å; L291-L294 PolarHBondContact O-N 3.22Å; L291-C295 WeakPolarHBondContact O-CB 3.13Å; L291-C295 PolarHBondContact O-N 3.03Å; L291-L319 HydrophobicContact CD2-CD2 3.59Å; L291-E335 HydrophobicContact CD1-CG 3.39Å; L291-F338 HydrophobicContact CB-CB 3.84Å; L291-C339 WeakPolarHBondContact CD1-SG 3.15Å; L291-L342 HydrophobicContact CD2-CD1 3.69Å |
| 292 | G | 96.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -60.4 | -43.5 | 170 | 0 | 0 | 0 | 0 | 0 | 112.3 | E288 C295 S296 | E288-G292 PolarHBondContact O-N 2.89Å; G292-C295 WeakPolarHBondContact O-CB 3.45Å; G292-C295 PolarHBondContact O-N 3.36Å; G292-S296 PolarHBondContact O-N 2.68Å; G292-S296 PolarHBondContact O-OG 3.49Å; G292-S296 VanDerWaalsContact O-OG 3.11Å |
| 293 | A | 96.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.4 | -42.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112.3 | L252 Q253 L256 L275 H289 V290 S296 L297 | L252-A293 HydrophobicContact CD2-CB 4.29Å; L252-A293 HydrophobicContact CG-CB 4.27Å; Q253-A293 HydrophobicContact CB-CB 4.33Å; L256-A293 HydrophobicContact CD1-CB 3.79Å; L275-A293 HydrophobicContact CD1-CB 4.06Å; H289-A293 WeakPolarHBondContact O-CB 3.38Å; H289-A293 PolarHBondContact O-N 3.42Å; V290-A293 WeakPolarHBondContact O-CB 3.39Å; V290-A293 PolarHBondContact O-N 2.91Å; A293-S296 WeakPolarHBondContact O-CB 3.43Å; A293-S296 PolarHBondContact O-N 2.91Å; A293-L297 WeakPolarHBondContact O-CG 3.5Å; A293-L297 PolarHBondContact O-N 2.95Å |
| 294 | L | 97.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -60.9 | -43.7 | 172.6 | -78.7 | 171.1 | 0 | 0 | 0 | 111.6 | V272 L275 V276 V279 V290 L291 S296 L297 V298 L342 | V272-L294 HydrophobicContact CG1-CD2 4.27Å; L275-L294 HydrophobicContact CB-CD1 4.15Å; L275-L294 HydrophobicContact CB-CD2 3.75Å; L275-L294 HydrophobicContact CB-CG 3.79Å; L275-L294 HydrophobicContact CD1-CD2 3.95Å; L275-L294 HydrophobicContact CD1-CG 4.01Å; V276-L294 HydrophobicContact CG2-CD1 4.27Å; V276-L294 HydrophobicContact CG2-CD2 4.38Å; V279-L294 HydrophobicContact CG2-CD1 4.05Å; V290-L294 PolarHBondContact O-N 3.21Å; L291-L294 HydrophobicContact CD2-CD1 4.4Å; L291-L294 PolarHBondContact O-N 3.22Å; L294-S296 VanDerWaalsContact C-N 3.3Å; L294-S296 PolarHBondContact O-N 3.39Å; L294-L297 WeakPolarHBondContact O-CB 3.48Å; L294-L297 PolarHBondContact O-N 3.35Å; L294-V298 PolarHBondContact O-N 3.22Å; L294-L342 HydrophobicContact CB-CD1 3.97Å; L294-L342 HydrophobicContact CB-CD2 4.05Å |
| 295 | C | 96.8 | Very high | 94.8 | Very high | 3 Ų | 3 | 27 Ų | 27 | 2% | 0.02 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -55.9 | -45.1 | 174 | -85 | 0 | 0 | 0 | 0 | 111.7 | L291 G292 L297 V298 T299 F338 | L291-C295 WeakPolarHBondContact O-CB 3.13Å; L291-C295 PolarHBondContact O-N 3.03Å; G292-C295 WeakPolarHBondContact O-CB 3.45Å; G292-C295 PolarHBondContact O-N 3.36Å; C295-L297 VanDerWaalsContact C-N 3.32Å; C295-L297 PolarHBondContact O-N 3.26Å; C295-V298 VanDerWaalsContact O-CG2 3.32Å; C295-V298 WeakPolarHBondContact O-CG2 3.37Å; C295-V298 PolarHBondContact O-N 3.35Å; C295-T299 WeakPolarHBondContact O-CB 3.43Å; C295-T299 PolarHBondContact O-N 2.89Å; C295-T299 PolarHBondContact O-OG1 3.21Å; C295-F338 HydrophobicContact CB-CD1 3.88Å; C295-F338 HydrophobicContact CB-CE1 4.4Å; C295-F338 WeakPolarHBondContact SG-CD1 3.39Å; C295-F338 PolarHBondContact SG-O 2.71Å; C295-F338 VanDerWaalsContact SG-O 3.34Å |
| 296 | S | 95.5 | Very high | 95.2 | Very high | 14 Ų | 14 | 31.1 Ų | 31.1 | 10% | 0.098 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.8 | -40.2 | 175.5 | -56.6 | 0 | 0 | 0 | 0 | 111.8 | V257 K263 G292 A293 L294 V298 | V257-S296 WeakPolarHBondContact CG2-OG 3.19Å; K263-S296 WeakPolarHBondContact CE-O 3.32Å; K263-S296 PolarHBondContact NZ-O 3.15Å; G292-S296 PolarHBondContact O-N 2.68Å; G292-S296 PolarHBondContact O-OG 3.49Å; G292-S296 VanDerWaalsContact O-OG 3.11Å; A293-S296 WeakPolarHBondContact O-CB 3.43Å; A293-S296 PolarHBondContact O-N 2.91Å; L294-S296 VanDerWaalsContact C-N 3.3Å; L294-S296 PolarHBondContact O-N 3.39Å; S296-V298 VanDerWaalsContact C-N 3.31Å; S296-V298 PolarHBondContact O-N 2.85Å |
| 297 | L | 95.6 | Very high | 95.5 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -67.5 | -26 | 178.4 | -73 | 172 | 0 | 0 | 0 | 113.8 | L256 K263 L266 M271 V272 L275 A293 L294 C295 F301 | L256-L297 HydrophobicContact CD1-CD1 4.39Å; L256-L297 HydrophobicContact CD1-CD2 4.26Å; L256-L297 HydrophobicContact CD1-CG 3.99Å; L256-L297 HydrophobicContact CD2-CD2 3.6Å; L256-L297 HydrophobicContact CD2-CG 4.19Å; K263-L297 HydrophobicContact CB-CD2 4.25Å; K263-L297 HydrophobicContact CG-CD2 4.22Å; L266-L297 HydrophobicContact CB-CD2 4.43Å; M271-L297 HydrophobicContact CB-CD1 4.47Å; M271-L297 HydrophobicContact CG-CD1 3.85Å; V272-L297 HydrophobicContact CG2-CD1 4.08Å; L275-L297 HydrophobicContact CD1-CD1 3.63Å; A293-L297 WeakPolarHBondContact O-CG 3.5Å; A293-L297 PolarHBondContact O-N 2.95Å; L294-L297 WeakPolarHBondContact O-CB 3.48Å; L294-L297 PolarHBondContact O-N 3.35Å; C295-L297 VanDerWaalsContact C-N 3.32Å; C295-L297 PolarHBondContact O-N 3.26Å; L297-F301 WeakPolarHBondContact O-CB 3.44Å; L297-F301 VanDerWaalsContact O-CD1 3.29Å; L297-F301 WeakPolarHBondContact O-CD1 3.24Å |
| 298 | V | 95.2 | Very high | 95.5 | Very high | 1 Ų | 1 | 32.4 Ų | 32.4 | 1% | 0.006 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -95.5 | -24.6 | 179.1 | -57.4 | 0 | 0 | 0 | 0 | 113.5 | L294 C295 S296 D300 F301 V305 C308 L342 T345 | L294-V298 PolarHBondContact O-N 3.22Å; C295-V298 VanDerWaalsContact O-CG2 3.32Å; C295-V298 WeakPolarHBondContact O-CG2 3.37Å; C295-V298 PolarHBondContact O-N 3.35Å; S296-V298 VanDerWaalsContact C-N 3.31Å; S296-V298 PolarHBondContact O-N 2.85Å; V298-D300 PolarHBondContact O-N 3.13Å; V298-F301 PolarHBondContact O-N 2.98Å; V298-V305 HydrophobicContact CB-CG2 4Å; V298-C308 HydrophobicContact CG1-CB 4.34Å; V298-C308 VanDerWaalsContact CG1-SG 3.52Å; V298-L342 HydrophobicContact CG1-CD2 4.07Å; V298-L342 HydrophobicContact CG2-CD2 3.72Å; V298-T345 HydrophobicContact CB-CG2 4.3Å; V298-T345 HydrophobicContact CG2-CG2 4.07Å |
| 299 | T | 94.1 | Very high | 95.5 | Very high | 39 Ų | 39 | 36.6 Ų | 36.6 | 24% | 0.239 | 18% | 0.177 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.5 | 120.4 | -178.1 | -58.8 | 0 | 0 | 0 | 0 | 109.9 | K263 C295 F301 | K263-T299 PolarHBondContact NZ-O 3.09Å; C295-T299 WeakPolarHBondContact O-CB 3.43Å; C295-T299 PolarHBondContact O-N 2.89Å; C295-T299 PolarHBondContact O-OG1 3.21Å; T299-F301 PolarHBondContact O-N 3.4Å; T299-F301 VanDerWaalsContact O-N 3.12Å |
| 300 | D | 91.8 | Very high | 95.4 | Very high | 160 Ų | 160 | 39.9 Ų | 39.9 | 86% | 0.856 | 19% | 0.193 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 52 | 29.2 | -178.2 | -54.2 | -46.1 | 0 | 0 | 0 | 114.2 | V298 | V298-D300 PolarHBondContact O-N 3.13Š|
| 301 | F | 94.3 | Very high | 95.2 | Very high | 43 Ų | 43 | 45.1 Ų | 45.1 | 19% | 0.189 | 23% | 0.227 | C | C | . | . | trans | -138.4 | 93.4 | -175.8 | -167.5 | -113.9 | 0 | 0 | 0 | 112.3 | K263 C267 L297 V298 T299 Q303 G304 V305 | K263-F301 HydrophobicContact CB-CD1 3.98Å; K263-F301 HydrophobicContact CB-CD2 4.26Å; K263-F301 HydrophobicContact CB-CE1 4.03Å; K263-F301 HydrophobicContact CB-CE2 4.31Å; K263-F301 HydrophobicContact CB-CG 4.12Å; K263-F301 HydrophobicContact CB-CZ 4.21Å; K263-F301 HydrophobicContact CD-CB 3.98Å; K263-F301 HydrophobicContact CD-CD1 4.47Å; K263-F301 HydrophobicContact CD-CD2 4.47Å; K263-F301 HydrophobicContact CD-CG 4.06Å; C267-F301 HydrophobicContact CB-CE1 4.25Å; C267-F301 VanDerWaalsContact SG-CE1 3.59Å; L297-F301 WeakPolarHBondContact O-CB 3.44Å; L297-F301 VanDerWaalsContact O-CD1 3.29Å; L297-F301 WeakPolarHBondContact O-CD1 3.24Å; V298-F301 PolarHBondContact O-N 2.98Å; T299-F301 PolarHBondContact O-N 3.4Å; T299-F301 VanDerWaalsContact O-N 3.12Å; F301-Q303 VanDerWaalsContact C-N 3.29Å; F301-Q303 HydrophobicContact CD1-CB 4.26Å; F301-Q303 HydrophobicContact CE1-CB 3.58Å; F301-Q303 HydrophobicContact CE1-CG 4Å; F301-Q303 HydrophobicContact CE2-CB 4.49Å; F301-Q303 HydrophobicContact CZ-CB 3.69Å; F301-Q303 HydrophobicContact CZ-CG 4.24Å; F301-Q303 PolarHBondContact O-N 3.49Å; F301-G304 PolarHBondContact O-N 3.05Å; F301-V305 PolarHBondContact O-N 2.95Å | ||
| 302 | P | 93.2 | Very high | 95 | Very high | 95 Ų | 95 | 53.9 Ų | 53.9 | 62% | 0.617 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -60 | -31.4 | -174 | -27.2 | 35.1 | 0 | 0 | 0 | 115 | V305 R306 | P302-V305 PolarHBondContact O-N 3.36Å; P302-R306 WeakPolarHBondContact O-CG 3.27Å; P302-R306 PolarHBondContact O-N 2.75Å |
| 303 | Q | 94.3 | Very high | 94.9 | Very high | 51 Ų | 51 | 55 Ų | 55 | 24% | 0.238 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64.7 | -43.9 | 175.3 | 171.3 | -179.1 | -5.6 | 0 | 0 | 111.3 | C267 F301 V305 R306 E307 | C267-Q303 HydrophobicContact CB-CG 4.2Å; C267-Q303 VanDerWaalsContact CB-NE2 3.35Å; F301-Q303 VanDerWaalsContact C-N 3.29Å; F301-Q303 HydrophobicContact CD1-CB 4.26Å; F301-Q303 HydrophobicContact CE1-CB 3.58Å; F301-Q303 HydrophobicContact CE1-CG 4Å; F301-Q303 HydrophobicContact CE2-CB 4.49Å; F301-Q303 HydrophobicContact CZ-CB 3.69Å; F301-Q303 HydrophobicContact CZ-CG 4.24Å; F301-Q303 PolarHBondContact O-N 3.49Å; Q303-V305 VanDerWaalsContact C-N 3.3Å; Q303-V305 PolarHBondContact O-N 3.35Å; Q303-R306 PolarHBondContact O-N 3.35Å; Q303-R306 VanDerWaalsContact O-N 3.16Å; Q303-E307 HydrophobicContact CG-CG 4.49Å; Q303-E307 WeakPolarHBondContact CG-OE1 3.34Å; Q303-E307 PolarHBondContact NE2-OE1 2.87Å; Q303-E307 PolarHBondContact O-N 3.21Å |
| 304 | G | 94.8 | Very high | 94.8 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.6 | -39.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | F301 E307 C308 | F301-G304 PolarHBondContact O-N 3.05Å; G304-E307 PolarHBondContact O-N 3.15Å; G304-C308 WeakPolarHBondContact O-CB 3.4Å; G304-C308 PolarHBondContact O-N 3.02Å; G304-C308 PolarHBondContact O-SG 3.41Å |
| 305 | V | 96.3 | Very high | 94.7 | Very high | 19 Ų | 19 | 56.1 Ų | 56.1 | 12% | 0.115 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61.5 | -46.5 | 173.1 | 177.7 | 0 | 0 | 0 | 0 | 111.4 | V298 F301 P302 Q303 C308 R309 T345 | V298-V305 HydrophobicContact CB-CG2 4Å; F301-V305 PolarHBondContact O-N 2.95Å; P302-V305 PolarHBondContact O-N 3.36Å; Q303-V305 VanDerWaalsContact C-N 3.3Å; Q303-V305 PolarHBondContact O-N 3.35Å; V305-C308 PolarHBondContact O-N 2.88Å; V305-R309 VanDerWaalsContact CG1-CZ 3.49Å; V305-R309 VanDerWaalsContact O-CG 3.27Å; V305-R309 WeakPolarHBondContact O-CG 3.31Å; V305-R309 PolarHBondContact O-N 3.21Å; V305-R309 VanDerWaalsContact O-N 3.13Å; V305-T345 HydrophobicContact CG2-CG2 4.18Å |
| 306 | R | 95.3 | Very high | 94.7 | Very high | 162 Ų | 162 | 59.2 Ų | 59.2 | 61% | 0.611 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -60.6 | -47.7 | 177.8 | -73.8 | -174.4 | -61.2 | 178.4 | 3.7 | 111.9 | P302 Q303 C308 R309 E310 | P302-R306 WeakPolarHBondContact O-CG 3.27Å; P302-R306 PolarHBondContact O-N 2.75Å; Q303-R306 PolarHBondContact O-N 3.35Å; Q303-R306 VanDerWaalsContact O-N 3.16Å; R306-C308 VanDerWaalsContact C-N 3.33Å; R306-C308 PolarHBondContact O-N 3.38Å; R306-R309 WeakPolarHBondContact O-CB 3.47Å; R306-R309 PolarHBondContact O-N 3.47Å; R306-R309 VanDerWaalsContact O-N 3.08Å; R306-E310 PolarHBondContact O-N 2.96Å |
| 307 | E | 96 | Very high | 94.7 | Very high | 27 Ų | 27 | 65.9 Ų | 65.9 | 13% | 0.126 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -64.3 | -37.2 | 179.5 | -71.9 | -176 | -146.1 | 0 | 0 | 112.2 | C267 V272 Q273 Q303 G304 R309 E310 L313 | C267-E307 WeakPolarHBondContact CB-OE1 3.43Å; V272-E307 HydrophobicContact CB-CB 4.09Å; V272-E307 HydrophobicContact CG1-CB 4.04Å; V272-E307 HydrophobicContact CG2-CB 4.07Å; Q273-E307 PolarHBondContact NE2-OE2 3.28Å; Q303-E307 HydrophobicContact CG-CG 4.49Å; Q303-E307 WeakPolarHBondContact CG-OE1 3.34Å; Q303-E307 PolarHBondContact NE2-OE1 2.87Å; Q303-E307 PolarHBondContact O-N 3.21Å; G304-E307 PolarHBondContact O-N 3.15Å; E307-R309 PolarHBondContact O-N 2.87Å; E307-E310 WeakPolarHBondContact O-CB 3.45Å; E307-E310 WeakPolarHBondContact O-CG 3.32Å; E307-E310 PolarHBondContact O-N 3.12Å; E307-L313 WeakPolarHBondContact O-CD1 3.46Å |
| 308 | C | 95.9 | Very high | 94.7 | Very high | 0 Ų | 0 | 66.8 Ų | 66.8 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -65.6 | -26.2 | 174.4 | -73.7 | 0 | 0 | 0 | 0 | 113.1 | V272 V298 G304 V305 R306 E310 L315 C346 F347 | V272-C308 VanDerWaalsContact CG1-SG 3.57Å; V298-C308 HydrophobicContact CG1-CB 4.34Å; V298-C308 VanDerWaalsContact CG1-SG 3.52Å; G304-C308 WeakPolarHBondContact O-CB 3.4Å; G304-C308 PolarHBondContact O-N 3.02Å; G304-C308 PolarHBondContact O-SG 3.41Å; V305-C308 PolarHBondContact O-N 2.88Å; R306-C308 VanDerWaalsContact C-N 3.33Å; R306-C308 PolarHBondContact O-N 3.38Å; C308-E310 VanDerWaalsContact C-N 3.33Å; C308-L315 HydrophobicContact CB-CD2 3.77Å; C308-C346 HydrophobicContact CB-CB 4.49Å; C308-F347 WeakPolarHBondContact O-CZ 3.32Å |
| 309 | R | 95.4 | Very high | 94.8 | Very high | 128 Ų | 128 | 66.8 Ų | 66.8 | 48% | 0.483 | 33% | 0.333 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.2 | -5.1 | 178.5 | -73.1 | 171.4 | 178.6 | -178.8 | -0 | 113.8 | V305 R306 E307 C346 F347 | V305-R309 VanDerWaalsContact CG1-CZ 3.49Å; V305-R309 VanDerWaalsContact O-CG 3.27Å; V305-R309 WeakPolarHBondContact O-CG 3.31Å; V305-R309 PolarHBondContact O-N 3.21Å; V305-R309 VanDerWaalsContact O-N 3.13Å; R306-R309 WeakPolarHBondContact O-CB 3.47Å; R306-R309 PolarHBondContact O-N 3.47Å; R306-R309 VanDerWaalsContact O-N 3.08Å; E307-R309 PolarHBondContact O-N 2.87Å; R309-C346 VanDerWaalsContact CZ-O 3.24Å; R309-C346 PolarHBondContact NE-O 2.95Å; R309-C346 PolarHBondContact NH2-O 3.27Å; R309-F347 HydrophobicContact CG-CE1 4.13Å |
| 310 | E | 94.9 | Very high | 94.8 | Very high | 95 Ų | 95 | 70.8 Ų | 70.8 | 44% | 0.444 | 34% | 0.344 | S | S | . | . | trans | -59.1 | 122.6 | 179.6 | -70.2 | -62.2 | 153.3 | 0 | 0 | 110.1 | R306 E307 C308 E312 L313 | R306-E310 PolarHBondContact O-N 2.96Å; E307-E310 WeakPolarHBondContact O-CB 3.45Å; E307-E310 WeakPolarHBondContact O-CG 3.32Å; E307-E310 PolarHBondContact O-N 3.12Å; C308-E310 VanDerWaalsContact C-N 3.33Å; E310-E312 PolarHBondContact O-N 2.97Å; E310-L313 HydrophobicContact CB-CD1 4.36Å; E310-L313 HydrophobicContact CB-CG 4.24Å; E310-L313 WeakPolarHBondContact O-CB 3.39Å; E310-L313 PolarHBondContact O-N 3.39Å | ||
| 311 | P | 91.9 | Very high | 95 | Very high | 111 Ų | 111 | 68.7 Ų | 68.7 | 72% | 0.721 | 33% | 0.328 | S | S | * | . | G | 310 helix | trans | -63.1 | -29.2 | -171.1 | 23.2 | -32.9 | 0 | 0 | 0 | 112.4 | L313 G314 | P311-L313 PolarHBondContact O-N 3.35Å; P311-G314 PolarHBondContact O-N 3.02Å; P311-G314 VanDerWaalsContact O-N 3.11Å |
| 312 | E | 93.7 | Very high | 94.9 | Very high | 183 Ų | 183 | 67.3 Ų | 67.3 | 86% | 0.855 | 32% | 0.322 | S | S | * | . | G | 310 helix | trans | -61.1 | -26.7 | 176.1 | -60.7 | -178.7 | 178.4 | 0 | 0 | 112.8 | E310 | E310-E312 PolarHBondContact O-N 2.97Š|
| 313 | L | 93.8 | Very high | 95 | Very high | 24 Ų | 24 | 63.7 Ų | 63.7 | 13% | 0.126 | 30% | 0.299 | C | S | . | . | G | 310 helix | trans | -77.5 | -22.5 | 178.5 | -67.3 | -174.2 | 0 | 0 | 0 | 112.9 | V272 Q273 V276 R280 E307 E310 P311 L315 | V272-L313 HydrophobicContact CG1-CD1 4.04Å; Q273-L313 HydrophobicContact CB-CD2 4.06Å; Q273-L313 HydrophobicContact CG-CD1 4.31Å; Q273-L313 HydrophobicContact CG-CD2 3.99Å; V276-L313 HydrophobicContact CB-CD2 4.42Å; V276-L313 HydrophobicContact CG1-CB 4.18Å; V276-L313 HydrophobicContact CG1-CD2 4.41Å; V276-L313 HydrophobicContact CG2-CD1 4.17Å; R280-L313 PolarHBondContact NH2-O 3.44Å; E307-L313 WeakPolarHBondContact O-CD1 3.46Å; E310-L313 HydrophobicContact CB-CD1 4.36Å; E310-L313 HydrophobicContact CB-CG 4.24Å; E310-L313 WeakPolarHBondContact O-CB 3.39Å; E310-L313 PolarHBondContact O-N 3.39Å; P311-L313 PolarHBondContact O-N 3.35Å; L313-L315 HydrophobicContact CB-CB 4.5Å; L313-L315 PolarHBondContact O-N 3.41Å; L313-L315 VanDerWaalsContact O-N 3.08Å |
| 314 | G | 94.6 | Very high | 94.9 | Very high | 21 Ų | 21 | 67.8 Ų | 67.8 | 22% | 0.216 | 32% | 0.318 | C | S | . | . | trans | 48.8 | 35.4 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | R280 P311 L318 | R280-G314 PolarHBondContact NH2-O 3.07Å; P311-G314 PolarHBondContact O-N 3.02Å; P311-G314 VanDerWaalsContact O-N 3.11Å; G314-L318 WeakPolarHBondContact O-CB 3.38Å; G314-L318 PolarHBondContact O-N 3.01Å | ||
| 315 | L | 95.9 | Very high | 94.7 | Very high | 3 Ų | 3 | 71 Ų | 71 | 2% | 0.016 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -69.4 | -37.2 | -170 | 178.2 | 60.2 | 0 | 0 | 0 | 111.8 | V276 C308 L313 E317 L318 L319 F347 | V276-L315 HydrophobicContact CG1-CD1 4.16Å; V276-L315 HydrophobicContact CG2-CD1 3.87Å; V276-L315 HydrophobicContact CG2-CD2 4.01Å; V276-L315 HydrophobicContact CG2-CG 4.35Å; C308-L315 HydrophobicContact CB-CD2 3.77Å; L313-L315 HydrophobicContact CB-CB 4.5Å; L313-L315 PolarHBondContact O-N 3.41Å; L313-L315 VanDerWaalsContact O-N 3.08Å; L315-E317 PolarHBondContact O-N 3.17Å; L315-L318 HydrophobicContact CD1-CD2 4.3Å; L315-L318 WeakPolarHBondContact O-CB 3.41Å; L315-L318 PolarHBondContact O-N 3.09Å; L315-L319 HydrophobicContact CD1-CD1 4.01Å; L315-L319 HydrophobicContact CD1-CD2 4.1Å; L315-L319 HydrophobicContact CD1-CG 3.77Å; L315-L319 HydrophobicContact CD2-CD1 4.37Å; L315-L319 HydrophobicContact CG-CD1 3.81Å; L315-L319 HydrophobicContact CG-CG 4.05Å; L315-L319 VanDerWaalsContact O-CG 3.27Å; L315-L319 WeakPolarHBondContact O-CG 3.24Å; L315-L319 PolarHBondContact O-N 2.96Å; L315-F347 HydrophobicContact CB-CE2 4.4Å; L315-F347 HydrophobicContact CB-CZ 4.11Å; L315-F347 HydrophobicContact CD2-CE2 4.33Å; L315-F347 HydrophobicContact CD2-CZ 4.45Å; L315-F347 HydrophobicContact CG-CE2 4.21Å; L315-F347 HydrophobicContact CG-CZ 4.37Å |
| 316 | E | 96.4 | Very high | 94.5 | Very high | 67 Ų | 67 | 70.1 Ų | 70.1 | 31% | 0.313 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -58.2 | -50.9 | 179.7 | -169.6 | -177.3 | 164.5 | 0 | 0 | 112 | L318 L319 R320 L343 F347 | E316-L318 VanDerWaalsContact C-N 3.3Å; E316-L318 PolarHBondContact O-N 3.45Å; E316-L319 PolarHBondContact O-N 3Å; E316-R320 WeakPolarHBondContact O-CG 3.46Å; E316-R320 PolarHBondContact O-N 3.23Å; E316-R320 IonicContact OE1-CZ 3.28Å; E316-R320 VanDerWaalsContact OE1-CZ 3.28Å; E316-R320 IonicContact OE1-NE 2.99Å; E316-R320 PolarHBondContact OE1-NE 2.69Å; E316-R320 IonicContact OE1-NH2 2.75Å; E316-R320 PolarHBondContact OE1-NH2 3.46Å; E316-L343 HydrophobicContact CG-CD2 3.9Å; E316-F347 HydrophobicContact CB-CD1 3.79Å; E316-F347 HydrophobicContact CB-CD2 3.93Å; E316-F347 HydrophobicContact CB-CE1 3.82Å; E316-F347 HydrophobicContact CB-CE2 3.95Å; E316-F347 HydrophobicContact CB-CG 3.85Å; E316-F347 HydrophobicContact CB-CZ 3.9Å; E316-F347 HydrophobicContact CG-CB 3.97Å; E316-F347 HydrophobicContact CG-CD1 4.01Å; E316-F347 HydrophobicContact CG-CD2 3.99Å; E316-F347 HydrophobicContact CG-CG 3.71Å; E316-F347 WeakPolarHBondContact OE2-CD1 3.3Å |
| 317 | E | 95.8 | Very high | 94.1 | Very high | 154 Ų | 154 | 68.5 Ų | 68.5 | 72% | 0.72 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -61.9 | -40.5 | 178 | -64.5 | -180 | 176 | 0 | 0 | 111.5 | L315 R320 H321 | L315-E317 PolarHBondContact O-N 3.17Å; E317-R320 PolarHBondContact O-N 3.1Å; E317-H321 WeakPolarHBondContact O-CB 3.38Å; E317-H321 PolarHBondContact O-N 3.48Å |
| 318 | L | 95.7 | Very high | 93.4 | Very high | 20 Ų | 20 | 76.4 Ų | 76.4 | 11% | 0.105 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -61.7 | -45.3 | 177.7 | -179.6 | 63.1 | 0 | 0 | 0 | 111.9 | V276 V279 R280 G314 L315 E316 R322 | V276-L318 HydrophobicContact CG1-CD2 4.19Å; V279-L318 HydrophobicContact CB-CD2 3.91Å; V279-L318 HydrophobicContact CG1-CD1 4.47Å; V279-L318 HydrophobicContact CG1-CD2 3.62Å; V279-L318 HydrophobicContact CG1-CG 3.95Å; R280-L318 HydrophobicContact CG-CD1 4.08Å; R280-L318 HydrophobicContact CG-CD2 3.55Å; R280-L318 HydrophobicContact CG-CG 4.46Å; G314-L318 WeakPolarHBondContact O-CB 3.38Å; G314-L318 PolarHBondContact O-N 3.01Å; L315-L318 HydrophobicContact CD1-CD2 4.3Å; L315-L318 WeakPolarHBondContact O-CB 3.41Å; L315-L318 PolarHBondContact O-N 3.09Å; E316-L318 VanDerWaalsContact C-N 3.3Å; E316-L318 PolarHBondContact O-N 3.45Å; L318-R322 WeakPolarHBondContact O-CB 3.4Å; L318-R322 PolarHBondContact O-N 3.34Å |
| 319 | L | 96.3 | Very high | 93 | Very high | 0 Ų | 0 | 81.2 Ų | 81.2 | 0% | 0 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -67.2 | -43 | 177.9 | -67.5 | 173.9 | 0 | 0 | 0 | 111.3 | L291 L315 E316 H321 R322 C323 C339 L342 L343 F347 | L291-L319 HydrophobicContact CD2-CD2 3.59Å; L315-L319 HydrophobicContact CD1-CD1 4.01Å; L315-L319 HydrophobicContact CD1-CD2 4.1Å; L315-L319 HydrophobicContact CD1-CG 3.77Å; L315-L319 HydrophobicContact CD2-CD1 4.37Å; L315-L319 HydrophobicContact CG-CD1 3.81Å; L315-L319 HydrophobicContact CG-CG 4.05Å; L315-L319 VanDerWaalsContact O-CG 3.27Å; L315-L319 WeakPolarHBondContact O-CG 3.24Å; L315-L319 PolarHBondContact O-N 2.96Å; E316-L319 PolarHBondContact O-N 3Å; L319-H321 PolarHBondContact O-N 3.22Å; L319-R322 WeakPolarHBondContact O-CB 3.33Å; L319-R322 PolarHBondContact O-N 3.01Å; L319-R322 VanDerWaalsContact O-N 3.14Å; L319-C323 PolarHBondContact O-N 3.29Å; L319-C323 PolarHBondContact O-SG 3.3Å; L319-C339 HydrophobicContact CD2-CB 4.2Å; L319-L342 HydrophobicContact CD1-CB 3.51Å; L319-L342 HydrophobicContact CD1-CD1 4.33Å; L319-L342 HydrophobicContact CD2-CB 4.47Å; L319-L342 HydrophobicContact CD2-CD1 4Å; L319-L343 HydrophobicContact CB-CD1 4.16Å; L319-L343 HydrophobicContact CB-CD2 3.88Å; L319-L343 HydrophobicContact CB-CG 3.85Å; L319-L343 HydrophobicContact CD1-CD2 4.23Å; L319-L343 HydrophobicContact CD1-CG 4.15Å; L319-F347 HydrophobicContact CD1-CE2 4.25Å |
| 320 | R | 95.6 | Very high | 92.6 | Very high | 124 Ų | 124 | 83.5 Ų | 83.5 | 47% | 0.468 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -60.6 | -44.5 | 176.6 | -71.5 | 178.1 | -175.2 | -71.2 | 1 | 111.8 | E316 E317 R322 C323 Q324 L343 | E316-R320 WeakPolarHBondContact O-CG 3.46Å; E316-R320 PolarHBondContact O-N 3.23Å; E316-R320 IonicContact OE1-CZ 3.28Å; E316-R320 VanDerWaalsContact OE1-CZ 3.28Å; E316-R320 IonicContact OE1-NE 2.99Å; E316-R320 PolarHBondContact OE1-NE 2.69Å; E316-R320 IonicContact OE1-NH2 2.75Å; E316-R320 PolarHBondContact OE1-NH2 3.46Å; E317-R320 PolarHBondContact O-N 3.1Å; R320-R322 VanDerWaalsContact C-N 3.33Å; R320-C323 PolarHBondContact O-N 3.21Å; R320-Q324 WeakPolarHBondContact O-CG 3.39Å; R320-Q324 PolarHBondContact O-N 2.83Å; R320-Q324 VanDerWaalsContact O-N 3.15Å; R320-L343 HydrophobicContact CG-CD1 4.16Å; R320-L343 HydrophobicContact CG-CD2 3.97Å |
| 321 | H | 94.5 | Very high | 92.3 | Very high | 115 Ų | 115 | 84.8 Ų | 84.8 | 53% | 0.532 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -63.4 | -40.1 | 174.6 | 179.1 | -91.8 | 0 | 0 | 0 | 111.6 | E317 L319 Q324 L325 | E317-H321 WeakPolarHBondContact O-CB 3.38Å; E317-H321 PolarHBondContact O-N 3.48Å; L319-H321 PolarHBondContact O-N 3.22Å; H321-Q324 PolarHBondContact O-N 3.28Å; H321-L325 PolarHBondContact O-N 2.94Å |
| 322 | R | 93.5 | Very high | 92.2 | Very high | 14 Ų | 14 | 81.7 Ų | 81.7 | 5% | 0.053 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -62.8 | -46 | 176.1 | -171.9 | 63.3 | 63.4 | 173.1 | 5.8 | 111.8 | V279 H283 L318 L319 R320 Q324 L325 L326 E335 | V279-R322 PolarHBondContact O-NH2 3.39Å; H283-R322 PolarHBondContact ND1-NH1 2.92Å; L318-R322 WeakPolarHBondContact O-CB 3.4Å; L318-R322 PolarHBondContact O-N 3.34Å; L319-R322 WeakPolarHBondContact O-CB 3.33Å; L319-R322 PolarHBondContact O-N 3.01Å; L319-R322 VanDerWaalsContact O-N 3.14Å; R320-R322 VanDerWaalsContact C-N 3.33Å; R322-Q324 VanDerWaalsContact C-N 3.29Å; R322-Q324 PolarHBondContact O-N 3.48Å; R322-L325 WeakPolarHBondContact O-CB 3.37Å; R322-L325 PolarHBondContact O-N 3.2Å; R322-L325 VanDerWaalsContact O-N 3.12Å; R322-L326 HydrophobicContact CG-CD1 3.82Å; R322-L326 HydrophobicContact CG-CG 4.27Å; R322-L326 WeakPolarHBondContact O-CG 3.49Å; R322-L326 PolarHBondContact O-N 3.31Å; R322-E335 WeakPolarHBondContact CD-OE1 3.4Å; R322-E335 IonicContact NE-OE1 2.63Å |
| 323 | C | 94.1 | Very high | 92.2 | Very high | 20 Ų | 20 | 77 Ų | 77 | 14% | 0.135 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -56.5 | -42.9 | 175.6 | -69 | 0 | 0 | 0 | 0 | 111.9 | L319 R320 L326 Q327 L336 C339 | L319-C323 PolarHBondContact O-N 3.29Å; L319-C323 PolarHBondContact O-SG 3.3Å; R320-C323 PolarHBondContact O-N 3.21Å; C323-L326 PolarHBondContact O-N 2.91Å; C323-Q327 WeakPolarHBondContact O-CB 3.44Å; C323-Q327 PolarHBondContact O-N 3.31Å; C323-L336 HydrophobicContact CB-CD1 3.87Å; C323-C339 WeakPolarHBondContact SG-CB 3.29Å |
| 324 | Q | 93.5 | Very high | 92.2 | Very high | 136 Ų | 136 | 81.1 Ų | 81.1 | 64% | 0.636 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -64.5 | -39.9 | 176.7 | -70.1 | 172.7 | 1 | 0 | 0 | 112.4 | R320 H321 R322 | R320-Q324 WeakPolarHBondContact O-CG 3.39Å; R320-Q324 PolarHBondContact O-N 2.83Å; R320-Q324 VanDerWaalsContact O-N 3.15Å; H321-Q324 PolarHBondContact O-N 3.28Å; R322-Q324 VanDerWaalsContact C-N 3.29Å; R322-Q324 PolarHBondContact O-N 3.48Å |
| 325 | L | 90.5 | Very high | 92.2 | Very high | 67 Ų | 67 | 80.1 Ų | 80.1 | 35% | 0.351 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -66.5 | -38.7 | 178.6 | 178.4 | 65.6 | 0 | 0 | 0 | 112.7 | H321 R322 | H321-L325 PolarHBondContact O-N 2.94Å; R322-L325 WeakPolarHBondContact O-CB 3.37Å; R322-L325 PolarHBondContact O-N 3.2Å; R322-L325 VanDerWaalsContact O-N 3.12Å |
| 326 | L | 91.1 | Very high | 92.1 | Very high | 1 Ų | 1 | 80.8 Ų | 80.8 | 1% | 0.005 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -88.5 | -7.8 | -176.9 | -58.7 | -178.4 | 0 | 0 | 0 | 113.2 | R322 C323 Q328 R329 Y332 E335 | R322-L326 HydrophobicContact CG-CD1 3.82Å; R322-L326 HydrophobicContact CG-CG 4.27Å; R322-L326 WeakPolarHBondContact O-CG 3.49Å; R322-L326 PolarHBondContact O-N 3.31Å; C323-L326 PolarHBondContact O-N 2.91Å; L326-Q328 PolarHBondContact O-N 3.44Å; L326-R329 WeakPolarHBondContact O-CB 3.45Å; L326-R329 PolarHBondContact O-N 3.37Å; L326-Y332 HydrophobicContact CD2-CD2 3.83Å; L326-Y332 HydrophobicContact CD2-CG 3.89Å; L326-E335 HydrophobicContact CD1-CB 3.87Å; L326-E335 HydrophobicContact CD1-CG 3.59Å |
| 327 | Q | 87.7 | Confident | 92.1 | Very high | 129 Ų | 129 | 82.5 Ų | 82.5 | 60% | 0.603 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.8 | 130.8 | -179.6 | -149.2 | 169.2 | 15.2 | 0 | 0 | 110 | C323 R329 | C323-Q327 WeakPolarHBondContact O-CB 3.44Å; C323-Q327 PolarHBondContact O-N 3.31Å; Q327-R329 VanDerWaalsContact C-N 3.28Å; Q327-R329 PolarHBondContact O-N 3.35Å |
| 328 | Q | 81.5 | Confident | 92.1 | Very high | 192 Ų | 192 | 77.1 Ų | 77.1 | 90% | 0.897 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.6 | 13 | -178.3 | -48.1 | 176.8 | -9.5 | 0 | 0 | 115.8 | L326 | L326-Q328 PolarHBondContact O-N 3.44Š|
| 329 | R | 86.4 | Confident | 92.2 | Very high | 101 Ų | 101 | 76.1 Ų | 76.1 | 38% | 0.381 | 35% | 0.347 | S | S | . | . | trans | -103.9 | 97.1 | 172.3 | -62 | -168.9 | -174.6 | -164.2 | -0.4 | 110.6 | L326 Q327 E331 Y332 | L326-R329 WeakPolarHBondContact O-CB 3.45Å; L326-R329 PolarHBondContact O-N 3.37Å; Q327-R329 VanDerWaalsContact C-N 3.28Å; Q327-R329 PolarHBondContact O-N 3.35Å; R329-E331 PolarHBondContact O-N 2.9Å; R329-Y332 HydrophobicContact CB-CD2 3.77Å; R329-Y332 HydrophobicContact CG-CD2 4.43Å; R329-Y332 PolarHBondContact O-N 3.41Å; R329-Y332 VanDerWaalsContact O-N 3.08Å | ||
| 330 | E | 86.6 | Confident | 92.2 | Very high | 177 Ų | 177 | 81 Ų | 81 | 83% | 0.827 | 37% | 0.37 | S | S | * | . | G | 310 helix | trans | -58.8 | -29.4 | -179 | -65.1 | -175.9 | 173.5 | 0 | 0 | 112.1 | Y332 Q333 | E330-Y332 PolarHBondContact O-N 2.89Å; E330-Q333 WeakPolarHBondContact O-CB 3.42Å; E330-Q333 PolarHBondContact O-N 3.45Å |
| 331 | E | 89 | Confident | 92.2 | Very high | 121 Ų | 121 | 79.3 Ų | 79.3 | 57% | 0.565 | 37% | 0.366 | S | S | * | . | G | 310 helix | trans | -67.9 | -14.5 | 179.1 | 72.7 | -86 | -164.4 | 0 | 0 | 114.4 | R329 | R329-E331 PolarHBondContact O-N 2.9Š|
| 332 | Y | 91.1 | Very high | 92.3 | Very high | 47 Ų | 47 | 73.8 Ų | 73.8 | 18% | 0.184 | 34% | 0.341 | C | S | . | . | G | 310 helix | trans | -119.3 | 22.7 | 180 | -56.8 | -62.7 | 0 | 0 | 0 | 112.7 | H283 L326 R329 E330 E334 E335 L336 | H283-Y332 AromaticContact NE2-CD1 3.69Å; H283-Y332 AromaticContact NE2-CD2 3.97Å; H283-Y332 AromaticContact NE2-CE1 3.41Å; H283-Y332 WeakPolarHBondContact NE2-CE1 3.49Å; H283-Y332 AromaticContact NE2-CE2 3.73Å; H283-Y332 AromaticContact NE2-CG 3.97Å; H283-Y332 AromaticContact NE2-CZ 3.44Å; L326-Y332 HydrophobicContact CD2-CD2 3.83Å; L326-Y332 HydrophobicContact CD2-CG 3.89Å; R329-Y332 HydrophobicContact CB-CD2 3.77Å; R329-Y332 HydrophobicContact CG-CD2 4.43Å; R329-Y332 PolarHBondContact O-N 3.41Å; R329-Y332 VanDerWaalsContact O-N 3.08Å; E330-Y332 PolarHBondContact O-N 2.89Å; Y332-E334 VanDerWaalsContact C-N 3.33Å; Y332-E334 PolarHBondContact O-N 2.86Å; Y332-E335 WeakPolarHBondContact O-CB 3.26Å; Y332-E335 PolarHBondContact O-N 3.49Å; Y332-E335 VanDerWaalsContact O-N 3.14Å; Y332-L336 PolarHBondContact O-N 3.28Å |
| 333 | Q | 91.9 | Very high | 92.5 | Very high | 85 Ų | 85 | 74.2 Ų | 74.2 | 40% | 0.397 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -58.8 | -42.2 | -176.5 | -177.6 | 58.4 | 30 | 0 | 0 | 112.5 | E330 E335 L336 E337 | E330-Q333 WeakPolarHBondContact O-CB 3.42Å; E330-Q333 PolarHBondContact O-N 3.45Å; Q333-E335 VanDerWaalsContact C-N 3.34Å; Q333-E335 PolarHBondContact O-N 3.47Å; Q333-L336 WeakPolarHBondContact O-CB 3.25Å; Q333-L336 PolarHBondContact O-N 2.93Å; Q333-E337 PolarHBondContact NE2-OE1 3.04Å; Q333-E337 WeakPolarHBondContact O-CG 3.35Å; Q333-E337 PolarHBondContact O-N 3.33Å |
| 334 | E | 93.8 | Very high | 92.5 | Very high | 110 Ų | 110 | 79.9 Ų | 79.9 | 51% | 0.514 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.4 | -40.9 | 176.5 | -64.5 | -170 | -166.3 | 0 | 0 | 111.9 | E288 Y332 L336 E337 F338 | E288-E334 HydrophobicContact CG-CB 4.09Å; Y332-E334 VanDerWaalsContact C-N 3.33Å; Y332-E334 PolarHBondContact O-N 2.86Å; E334-L336 VanDerWaalsContact C-N 3.34Å; E334-L336 PolarHBondContact O-N 3.46Å; E334-E337 PolarHBondContact O-N 3.28Å; E334-F338 HydrophobicContact CB-CE2 4.48Å; E334-F338 WeakPolarHBondContact O-CD2 3.39Å; E334-F338 WeakPolarHBondContact O-CG 3.45Å; E334-F338 PolarHBondContact O-N 2.94Å |
| 335 | E | 94.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 75.9 Ų | 75.9 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.9 | -40.2 | 176.7 | -171.4 | 173.4 | 147.4 | 0 | 0 | 111.9 | H283 H287 E288 L291 R322 L326 Y332 Q333 F338 C339 | H283-E335 IonicContact CE1-OE1 3.2Å; H283-E335 PolarHBondContact CE1-OE1 2.77Å; H283-E335 VanDerWaalsContact CE1-OE1 3.25Å; H283-E335 IonicContact CE1-OE2 2.71Å; H283-E335 PolarHBondContact CE1-OE2 3.04Å; H283-E335 IonicContact ND1-OE1 3.85Å; H283-E335 PolarHBondContact ND1-OE1 3.09Å; H283-E335 IonicContact ND1-OE2 3.25Å; H287-E335 WeakPolarHBondContact CB-OE1 3.13Å; H287-E335 WeakPolarHBondContact CB-OE2 3.34Å; E288-E335 HydrophobicContact CB-CB 4.13Å; E288-E335 HydrophobicContact CG-CB 4.38Å; E288-E335 PolarHBondContact N-OE2 3.22Å; L291-E335 HydrophobicContact CD1-CG 3.39Å; R322-E335 WeakPolarHBondContact CD-OE1 3.4Å; R322-E335 IonicContact NE-OE1 2.63Å; L326-E335 HydrophobicContact CD1-CB 3.87Å; L326-E335 HydrophobicContact CD1-CG 3.59Å; Y332-E335 WeakPolarHBondContact O-CB 3.26Å; Y332-E335 PolarHBondContact O-N 3.49Å; Y332-E335 VanDerWaalsContact O-N 3.14Å; Q333-E335 VanDerWaalsContact C-N 3.34Å; Q333-E335 PolarHBondContact O-N 3.47Å; E335-F338 PolarHBondContact O-N 2.87Å; E335-C339 PolarHBondContact O-N 2.96Å; E335-C339 PolarHBondContact O-SG 3.15Å |
| 336 | L | 94.5 | Very high | 92.7 | Very high | 17 Ų | 17 | 72.7 Ų | 72.7 | 9% | 0.089 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -63.1 | -46.6 | 175.2 | 179.6 | 63.4 | 0 | 0 | 0 | 111.2 | C323 Y332 Q333 E334 F338 C339 E340 | C323-L336 HydrophobicContact CB-CD1 3.87Å; Y332-L336 PolarHBondContact O-N 3.28Å; Q333-L336 WeakPolarHBondContact O-CB 3.25Å; Q333-L336 PolarHBondContact O-N 2.93Å; E334-L336 VanDerWaalsContact C-N 3.34Å; E334-L336 PolarHBondContact O-N 3.46Å; L336-F338 VanDerWaalsContact C-N 3.31Å; L336-F338 PolarHBondContact O-N 3.24Å; L336-C339 WeakPolarHBondContact O-CB 3.39Å; L336-C339 PolarHBondContact O-N 3.08Å; L336-E340 HydrophobicContact CD1-CG 4.44Å; L336-E340 WeakPolarHBondContact O-CG 3.37Å; L336-E340 PolarHBondContact O-N 2.91Å |
| 337 | E | 95.9 | Very high | 92.9 | Very high | 102 Ų | 102 | 74.6 Ų | 74.6 | 48% | 0.477 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -60 | -40.3 | 177.4 | -74 | 174.2 | -165.7 | 0 | 0 | 111.9 | Q333 E334 C339 E340 K341 | Q333-E337 PolarHBondContact NE2-OE1 3.04Å; Q333-E337 WeakPolarHBondContact O-CG 3.35Å; Q333-E337 PolarHBondContact O-N 3.33Å; E334-E337 PolarHBondContact O-N 3.28Å; E337-C339 VanDerWaalsContact C-N 3.35Å; E337-C339 PolarHBondContact O-N 2.88Å; E337-E340 PolarHBondContact O-N 3.4Å; E337-K341 VanDerWaalsContact O-CB 3.24Å; E337-K341 WeakPolarHBondContact O-CB 3.48Å; E337-K341 PolarHBondContact O-N 3.48Å |
| 338 | F | 97.2 | Very high | 92.8 | Very high | 41 Ų | 41 | 71.5 Ų | 71.5 | 18% | 0.18 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -64.1 | -39.3 | 173.4 | -69.1 | -46.6 | 0 | 0 | 0 | 112.3 | E288 L291 C295 E334 E335 L336 L342 | E288-F338 HydrophobicContact CG-CD2 4.36Å; E288-F338 HydrophobicContact CG-CE2 4.12Å; L291-F338 HydrophobicContact CB-CB 3.84Å; C295-F338 HydrophobicContact CB-CD1 3.88Å; C295-F338 HydrophobicContact CB-CE1 4.4Å; C295-F338 WeakPolarHBondContact SG-CD1 3.39Å; C295-F338 PolarHBondContact SG-O 2.71Å; C295-F338 VanDerWaalsContact SG-O 3.34Å; E334-F338 HydrophobicContact CB-CE2 4.48Å; E334-F338 WeakPolarHBondContact O-CD2 3.39Å; E334-F338 WeakPolarHBondContact O-CG 3.45Å; E334-F338 PolarHBondContact O-N 2.94Å; E335-F338 PolarHBondContact O-N 2.87Å; L336-F338 VanDerWaalsContact C-N 3.31Å; L336-F338 PolarHBondContact O-N 3.24Å; F338-L342 WeakPolarHBondContact O-CB 3.34Å; F338-L342 VanDerWaalsContact O-CG 3.28Å; F338-L342 WeakPolarHBondContact O-CG 3.2Å; F338-L342 PolarHBondContact O-N 3.41Å |
| 339 | C | 96.7 | Very high | 92 | Very high | 0 Ų | 0 | 67 Ų | 67 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -64.6 | -45.7 | 176.6 | -67.6 | 0 | 0 | 0 | 0 | 111.8 | L291 L319 C323 E335 L336 E337 L342 L343 | L291-C339 WeakPolarHBondContact CD1-SG 3.15Å; L319-C339 HydrophobicContact CD2-CB 4.2Å; C323-C339 WeakPolarHBondContact SG-CB 3.29Å; E335-C339 PolarHBondContact O-N 2.96Å; E335-C339 PolarHBondContact O-SG 3.15Å; L336-C339 WeakPolarHBondContact O-CB 3.39Å; L336-C339 PolarHBondContact O-N 3.08Å; E337-C339 VanDerWaalsContact C-N 3.35Å; E337-C339 PolarHBondContact O-N 2.88Å; C339-L342 PolarHBondContact O-N 2.87Å; C339-L343 WeakPolarHBondContact O-CG 3.29Å; C339-L343 PolarHBondContact O-N 2.85Å |
| 340 | E | 95.7 | Very high | 90.6 | Very high | 103 Ų | 103 | 68.1 Ų | 68.1 | 48% | 0.481 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -63.5 | -43.6 | 177.8 | -70.3 | 179.9 | 170.3 | 0 | 0 | 111.4 | L336 E337 L342 L343 Q344 | L336-E340 HydrophobicContact CD1-CG 4.44Å; L336-E340 WeakPolarHBondContact O-CG 3.37Å; L336-E340 PolarHBondContact O-N 2.91Å; E337-E340 PolarHBondContact O-N 3.4Å; E340-L342 VanDerWaalsContact C-N 3.34Å; E340-L342 PolarHBondContact O-N 2.91Å; E340-L343 PolarHBondContact O-N 2.89Å; E340-Q344 WeakPolarHBondContact O-CB 3.32Å; E340-Q344 PolarHBondContact O-N 2.97Å |
| 341 | K | 96.2 | Very high | 88.7 | Confident | 87 Ų | 87 | 65.2 Ų | 65.2 | 38% | 0.378 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -61.4 | -41 | 175.1 | -174.8 | 174.9 | 179.6 | 179.3 | 0 | 111.9 | E337 Q344 T345 | E337-K341 VanDerWaalsContact O-CB 3.24Å; E337-K341 WeakPolarHBondContact O-CB 3.48Å; E337-K341 PolarHBondContact O-N 3.48Å; K341-Q344 PolarHBondContact O-N 2.87Å; K341-T345 VanDerWaalsContact O-CB 3.29Å; K341-T345 WeakPolarHBondContact O-CB 3.4Å; K341-T345 PolarHBondContact O-N 2.91Å; K341-T345 PolarHBondContact O-OG1 3.41Å |
| 342 | L | 97.3 | Very high | 86.4 | Confident | 0 Ų | 0 | 65.6 Ų | 65.6 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -65.4 | -43.3 | 175.3 | -76.1 | 164.8 | 0 | 0 | 0 | 111.7 | L291 L294 V298 L319 F338 C339 E340 Q344 T345 C346 | L291-L342 HydrophobicContact CD2-CD1 3.69Å; L294-L342 HydrophobicContact CB-CD1 3.97Å; L294-L342 HydrophobicContact CB-CD2 4.05Å; V298-L342 HydrophobicContact CG1-CD2 4.07Å; V298-L342 HydrophobicContact CG2-CD2 3.72Å; L319-L342 HydrophobicContact CD1-CB 3.51Å; L319-L342 HydrophobicContact CD1-CD1 4.33Å; L319-L342 HydrophobicContact CD2-CB 4.47Å; L319-L342 HydrophobicContact CD2-CD1 4Å; F338-L342 WeakPolarHBondContact O-CB 3.34Å; F338-L342 VanDerWaalsContact O-CG 3.28Å; F338-L342 WeakPolarHBondContact O-CG 3.2Å; F338-L342 PolarHBondContact O-N 3.41Å; C339-L342 PolarHBondContact O-N 2.87Å; E340-L342 VanDerWaalsContact C-N 3.34Å; E340-L342 PolarHBondContact O-N 2.91Å; L342-Q344 VanDerWaalsContact C-N 3.34Å; L342-Q344 PolarHBondContact O-N 3.19Å; L342-T345 PolarHBondContact O-N 3.48Å; L342-C346 WeakPolarHBondContact O-CB 3.25Å; L342-C346 PolarHBondContact O-N 2.96Å; L342-C346 PolarHBondContact O-SG 3.41Å |
| 343 | L | 96.5 | Very high | 84.1 | Confident | 22 Ų | 22 | 70.9 Ų | 70.9 | 12% | 0.115 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -60.8 | -43.2 | 174.8 | -75.4 | 169.6 | 0 | 0 | 0 | 111.7 | E316 L319 R320 C339 E340 F347 S348 | E316-L343 HydrophobicContact CG-CD2 3.9Å; L319-L343 HydrophobicContact CB-CD1 4.16Å; L319-L343 HydrophobicContact CB-CD2 3.88Å; L319-L343 HydrophobicContact CB-CG 3.85Å; L319-L343 HydrophobicContact CD1-CD2 4.23Å; L319-L343 HydrophobicContact CD1-CG 4.15Å; R320-L343 HydrophobicContact CG-CD1 4.16Å; R320-L343 HydrophobicContact CG-CD2 3.97Å; C339-L343 WeakPolarHBondContact O-CG 3.29Å; C339-L343 PolarHBondContact O-N 2.85Å; E340-L343 PolarHBondContact O-N 2.89Å; L343-F347 HydrophobicContact CD2-CD2 4.13Å; L343-F347 CarbonylContact O-C 3.44Å; L343-F347 WeakPolarHBondContact O-CA 3.48Å; L343-F347 PolarHBondContact O-N 3.39Å; L343-S348 PolarHBondContact O-N 3.33Å; L343-S348 PolarHBondContact O-OG 2.95Å |
| 344 | Q | 95.4 | Very high | 81.7 | Confident | 140 Ų | 140 | 71.1 Ų | 71.1 | 65% | 0.654 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -63.8 | -52.6 | 177.1 | -167.8 | 180 | 23.5 | 0 | 0 | 111.6 | E340 K341 L342 S348 | E340-Q344 WeakPolarHBondContact O-CB 3.32Å; E340-Q344 PolarHBondContact O-N 2.97Å; K341-Q344 PolarHBondContact O-N 2.87Å; L342-Q344 VanDerWaalsContact C-N 3.34Å; L342-Q344 PolarHBondContact O-N 3.19Å; Q344-S348 WeakPolarHBondContact CA-OG 3.3Å; Q344-S348 VanDerWaalsContact O-CB 3.28Å; Q344-S348 WeakPolarHBondContact O-CB 3.4Å; Q344-S348 PolarHBondContact O-N 3.27Å |
| 345 | T | 94.6 | Very high | 79 | Confident | 51 Ų | 51 | 73.8 Ų | 73.8 | 31% | 0.313 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -69.9 | -39.9 | -174.2 | -49.6 | 0 | 0 | 0 | 0 | 112 | V298 V305 K341 L342 | V298-T345 HydrophobicContact CB-CG2 4.3Å; V298-T345 HydrophobicContact CG2-CG2 4.07Å; V305-T345 HydrophobicContact CG2-CG2 4.18Å; K341-T345 VanDerWaalsContact O-CB 3.29Å; K341-T345 WeakPolarHBondContact O-CB 3.4Å; K341-T345 PolarHBondContact O-N 2.91Å; K341-T345 PolarHBondContact O-OG1 3.41Å; L342-T345 PolarHBondContact O-N 3.48Å |
| 346 | C | 94 | Very high | 76.5 | Confident | 1 Ų | 1 | 81.6 Ų | 81.6 | 1% | 0.007 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -96 | -34.6 | -172.3 | -58.5 | 0 | 0 | 0 | 0 | 113.2 | C308 R309 L342 | C308-C346 HydrophobicContact CB-CB 4.49Å; R309-C346 VanDerWaalsContact CZ-O 3.24Å; R309-C346 PolarHBondContact NE-O 2.95Å; R309-C346 PolarHBondContact NH2-O 3.27Å; L342-C346 WeakPolarHBondContact O-CB 3.25Å; L342-C346 PolarHBondContact O-N 2.96Å; L342-C346 PolarHBondContact O-SG 3.41Å |
| 347 | F | 93.5 | Very high | 73.7 | Confident | 41 Ų | 41 | 95.9 Ų | 95.9 | 18% | 0.18 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -125.6 | -7.5 | -166.1 | -57.7 | -73.6 | 0 | 0 | 0 | 114.6 | C308 R309 L315 E316 L319 L343 S349 | C308-F347 WeakPolarHBondContact O-CZ 3.32Å; R309-F347 HydrophobicContact CG-CE1 4.13Å; L315-F347 HydrophobicContact CB-CE2 4.4Å; L315-F347 HydrophobicContact CB-CZ 4.11Å; L315-F347 HydrophobicContact CD2-CE2 4.33Å; L315-F347 HydrophobicContact CD2-CZ 4.45Å; L315-F347 HydrophobicContact CG-CE2 4.21Å; L315-F347 HydrophobicContact CG-CZ 4.37Å; E316-F347 HydrophobicContact CB-CD1 3.79Å; E316-F347 HydrophobicContact CB-CD2 3.93Å; E316-F347 HydrophobicContact CB-CE1 3.82Å; E316-F347 HydrophobicContact CB-CE2 3.95Å; E316-F347 HydrophobicContact CB-CG 3.85Å; E316-F347 HydrophobicContact CB-CZ 3.9Å; E316-F347 HydrophobicContact CG-CB 3.97Å; E316-F347 HydrophobicContact CG-CD1 4.01Å; E316-F347 HydrophobicContact CG-CD2 3.99Å; E316-F347 HydrophobicContact CG-CG 3.71Å; E316-F347 WeakPolarHBondContact OE2-CD1 3.3Å; L319-F347 HydrophobicContact CD1-CE2 4.25Å; L343-F347 HydrophobicContact CD2-CD2 4.13Å; L343-F347 CarbonylContact O-C 3.44Å; L343-F347 WeakPolarHBondContact O-CA 3.48Å; L343-F347 PolarHBondContact O-N 3.39Å; F347-S349 PolarHBondContact O-N 3.31Å |
| 348 | S | 86.8 | Confident | 72.6 | Confident | 64 Ų | 64 | 95.6 Ų | 95.6 | 45% | 0.448 | 50% | 0.501 | S | S | . | . | trans | -70.9 | 126.4 | 170 | -63 | 0 | 0 | 0 | 0 | 109.1 | L343 Q344 | L343-S348 PolarHBondContact O-N 3.33Å; L343-S348 PolarHBondContact O-OG 2.95Å; Q344-S348 WeakPolarHBondContact CA-OG 3.3Å; Q344-S348 VanDerWaalsContact O-CB 3.28Å; Q344-S348 WeakPolarHBondContact O-CB 3.4Å; Q344-S348 PolarHBondContact O-N 3.27Å | ||
| 349 | S | 65.1 | Low | 71.3 | Confident | 97 Ų | 97 | 98.5 Ų | 98.5 | 68% | 0.678 | 52% | 0.517 | S | S | * | . | trans | -55.5 | 139.3 | 165.9 | -45.2 | 0 | 0 | 0 | 0 | 107.6 | F347 T351 | F347-S349 PolarHBondContact O-N 3.31Å; S349-T351 VanDerWaalsContact C-N 3.3Å; S349-T351 PolarHBondContact O-N 3.07Å | ||
| 350 | P | 55.7 | Low | 69.8 | Low | 124 Ų | 124 | 103.9 Ų | 103.9 | 81% | 0.805 | 55% | 0.546 | S | S | * | . | trans | -55.5 | 107.3 | 162.9 | 23.6 | -29 | 0 | 0 | 0 | 105.5 | D352 | P350-D352 PolarHBondContact O-N 3.04Š| ||
| 351 | T | 46.5 | Very low | 68.3 | Low | 116 Ų | 116 | 104 Ų | 104 | 71% | 0.712 | 55% | 0.55 | S | S | * | . | trans | -50.1 | 129.1 | 164.9 | 39.1 | 0 | 0 | 0 | 0 | 105.9 | S349 D353 | S349-T351 VanDerWaalsContact C-N 3.3Å; S349-T351 PolarHBondContact O-N 3.07Å; T351-D353 VanDerWaalsContact C-N 3.28Å; T351-D353 PolarHBondContact O-N 3.48Å | ||
| 352 | D | 41.3 | Very low | 66.6 | Low | 130 Ų | 130 | 105.1 Ų | 105.1 | 70% | 0.695 | 56% | 0.561 | S | S | * | * | trans | -37.9 | 86.2 | 176.3 | -75.2 | -50.7 | 0 | 0 | 0 | 112.8 | P350 S354 | P350-D352 PolarHBondContact O-N 3.04Å; D352-S354 PolarHBondContact O-N 3.43Å; D352-S354 PolarHBondContact OD1-OG 2.97Å | ||
| 353 | D | 43.6 | Very low | 64.5 | Low | 157 Ų | 157 | 112.1 Ų | 112.1 | 84% | 0.84 | 60% | 0.598 | S | S | * | * | trans | -73.2 | 10.9 | 158.6 | -82.5 | -16.4 | 0 | 0 | 0 | 110 | T351 M355 | T351-D353 VanDerWaalsContact C-N 3.28Å; T351-D353 PolarHBondContact O-N 3.48Å; D353-M355 PolarHBondContact O-N 2.79Å; D353-M355 VanDerWaalsContact O-N 3.14Å | ||
| 354 | S | 41.4 | Very low | 62.3 | Low | 90 Ų | 90 | 118.5 Ų | 118.5 | 63% | 0.629 | 63% | 0.633 | S | S | * | * | trans | -76.9 | 23.8 | 166.2 | 70 | 0 | 0 | 0 | 0 | 113.3 | D352 | D352-S354 PolarHBondContact O-N 3.43Å; D352-S354 PolarHBondContact OD1-OG 2.97Å | ||
| 355 | M | 35.9 | Very low | 59.7 | Low | 167 Ų | 167 | 116.8 Ų | 116.8 | 82% | 0.823 | 63% | 0.631 | S | S | * | * | trans | -109.9 | 48.1 | 167.2 | -74.7 | -150.5 | -170.5 | 0 | 0 | 111.9 | D353 | D353-M355 PolarHBondContact O-N 2.79Å; D353-M355 VanDerWaalsContact O-N 3.14Å | ||
| 356 | D | 42.8 | Very low | 56.8 | Low | 164 Ų | 164 | 122.3 Ų | 122.3 | 88% | 0.877 | 66% | 0.657 | S | S | * | * | trans | -128.5 | 97.1 | 147 | -86 | -32.2 | 0 | 0 | 0 | 107.9 | ||||
| 357 | R | 35.1 | Very low | 53.4 | Low | 317 Ų | 317 | 133.4 Ų | 133.4 | 100% | 1.196 | 72% | 0.717 | S | S | * | * | trans | -76.9 | 0 | 171.9 | -85.5 | -178.2 | 169.2 | 166.4 | -2 | 111.5 |
Retrieved 357 of 357 residues in 621.5 ms
(Link to these results)